#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4a3h h VAL 5 N 0.00 0.49 -0.19 -3.33 2.07 -1.89 0.11 116.25 113.51 4a3h h VAL 5 Ca 0.00 0.00 -0.11 0.00 0.82 0.00 0.00 66.70 67.41 4a3h h VAL 5 Cb 0.00 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.25 4a3h h VAL 5 CO 0.00 0.00 -0.34 0.58 0.02 0.00 0.00 177.57 177.83 4a3h h VAL 6 N -0.51 1.29 -0.47 2.57 2.07 -1.76 -0.66 116.25 118.78 4a3h h VAL 6 Ca -0.00 -1.42 -0.09 0.00 0.82 0.00 0.00 66.70 66.00 4a3h h VAL 6 Cb 0.47 1.52 -0.02 0.00 -1.52 0.00 0.00 31.29 31.74 4a3h h VAL 6 CO -0.05 0.44 -0.08 -0.08 0.02 0.00 0.00 177.57 177.82 4a3h h GLU 7 N 0.35 0.84 -0.12 1.57 4.81 -1.77 0.49 114.58 120.75 4a3h h GLU 7 Ca 0.04 -0.27 -0.18 0.00 -0.13 0.00 0.00 59.36 58.82 4a3h h GLU 7 Cb 0.77 -0.07 0.01 0.00 0.63 0.00 0.00 28.75 30.08 4a3h h GLU 7 CO 0.06 0.89 -0.64 1.49 -0.73 0.00 0.00 179.01 180.08 4a3h h GLU 8 N 0.77 0.65 0.00 1.92 4.81 -0.56 -3.36 114.58 118.81 4a3h h GLU 8 Ca 0.13 -0.53 -0.16 0.00 -0.13 0.00 0.00 59.36 58.67 4a3h h GLU 8 Cb 0.57 0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.03 4a3h h GLU 8 CO 0.03 1.15 -2.13 0.72 -0.73 0.00 0.00 179.01 178.06 4a3h n HIS 9 N -4.09 0.05 -0.41 0.92 8.25 -0.27 -4.92 115.22 114.74 4a3h n HIS 9 Ca -0.08 0.02 0.00 0.00 -0.26 0.00 0.00 57.72 57.40 4a3h n HIS 9 Cb 0.67 -0.73 0.00 0.00 1.12 0.00 0.00 29.99 31.05 4a3h n HIS 9 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 4a3h n GLY 10 N 1.47 3.20 3.66 -1.41 0.00 0.17 -1.86 105.19 110.41 4a3h n GLY 10 Ca -0.16 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.34 4a3h n GLY 10 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 4a3h s GLN 11 N 0.00 4.14 0.24 1.61 2.00 -1.26 -4.79 119.66 121.60 4a3h s GLN 11 Ca 0.00 2.16 -0.08 0.00 -2.00 0.00 0.00 55.36 55.44 4a3h s GLN 11 Cb 0.00 -4.00 -0.07 0.00 0.80 0.00 0.00 33.01 29.74 4a3h s GLN 11 CO 0.00 -0.90 0.54 -0.51 -0.50 0.00 0.00 175.29 173.92 4a3h s LEU 12 N 4.20 4.14 0.33 3.68 1.43 -1.26 -1.81 118.68 129.39 4a3h s LEU 12 Ca 0.74 0.84 -0.12 0.00 -1.03 0.00 0.00 54.13 54.56 4a3h s LEU 12 Cb -0.33 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.29 4a3h s LEU 12 CO 0.30 -0.10 0.62 -0.94 0.23 0.00 0.00 176.35 176.45 4a3h s SER 13 N -2.59 0.21 -0.18 2.29 1.04 -0.71 -4.60 113.70 109.16 4a3h s SER 13 Ca 0.46 -1.12 -0.05 0.00 0.48 0.00 0.00 55.95 55.72 4a3h s SER 13 Cb -0.11 0.72 -0.03 0.00 0.10 0.00 0.00 66.02 66.70 4a3h s SER 13 CO 0.24 -1.40 0.00 -0.63 0.98 0.00 0.00 173.24 172.43 4a3h s ILE 14 N -3.15 4.14 -0.11 -1.02 -1.09 -1.26 -1.10 121.20 117.61 4a3h s ILE 14 Ca 0.21 -0.26 -0.01 0.00 -2.23 0.00 0.00 60.65 58.36 4a3h s ILE 14 Cb -0.03 -2.85 0.03 0.00 -1.58 0.00 0.00 42.46 38.03 4a3h s ILE 14 CO 0.13 0.46 -0.05 -0.55 -1.23 0.00 0.00 174.94 173.69 4a3h s SER 15 N 0.62 2.17 -1.55 3.58 0.15 -0.28 -4.83 113.70 113.56 4a3h s SER 15 Ca -0.00 -0.32 -0.11 0.00 0.70 0.00 0.00 55.95 56.21 4a3h s SER 15 Cb -0.14 -0.76 0.08 0.00 -1.71 0.00 0.00 66.02 63.49 4a3h s SER 15 CO 0.02 -0.15 0.76 0.59 1.20 0.00 0.00 173.24 175.66 4a3h n ASN 16 N 4.98 -2.92 -0.31 5.45 5.03 -1.26 -1.68 115.26 124.56 4a3h n ASN 16 Ca -0.11 -0.92 -0.04 0.00 0.87 0.00 0.00 54.58 54.38 4a3h n ASN 16 Cb 0.50 -3.31 -0.02 0.00 -1.02 0.00 0.00 39.78 35.93 4a3h n ASN 16 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 4a3h n GLY 17 N -1.64 0.68 3.30 7.41 0.00 -1.26 -5.00 105.19 108.67 4a3h n GLY 17 Ca -0.06 -0.47 -0.29 0.00 0.00 0.00 0.00 46.02 45.21 4a3h n GLY 17 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4a3h s GLU 18 N -1.81 1.73 -0.01 1.61 0.41 -0.67 -4.05 118.70 115.91 4a3h s GLU 18 Ca 0.00 -0.99 -0.30 0.00 -0.41 0.00 0.00 54.97 53.27 4a3h s GLU 18 Cb 0.00 -1.82 -0.04 0.00 -1.78 0.00 0.00 34.13 30.49 4a3h s GLU 18 CO 0.00 0.48 1.23 -1.17 -0.49 0.00 0.00 175.26 175.31 4a3h s LEU 19 N -1.02 4.31 0.14 1.80 2.96 -1.26 -1.13 118.68 124.49 4a3h s LEU 19 Ca 0.10 1.93 0.04 0.00 -0.22 0.00 0.00 54.13 55.97 4a3h s LEU 19 Cb -0.09 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.99 4a3h s LEU 19 CO 0.01 -0.57 -0.09 0.68 -1.32 0.00 0.00 176.35 175.06 4a3h s VAL 20 N 1.87 1.07 0.40 1.68 -7.23 -0.25 -2.22 120.40 115.71 4a3h s VAL 20 Ca 0.58 -2.04 -0.03 0.00 -1.81 0.00 0.00 61.98 58.69 4a3h s VAL 20 Cb -0.27 -1.84 0.09 0.00 0.56 0.00 0.00 36.38 34.91 4a3h s VAL 20 CO 0.25 -0.75 0.55 -0.46 -0.31 0.00 0.00 175.10 174.38 4a3h n ASN 21 N -0.18 0.46 0.00 4.85 0.23 0.02 -1.74 115.26 118.90 4a3h n ASN 21 Ca -0.10 -1.46 0.09 0.00 -0.53 0.00 0.00 54.58 52.58 4a3h n ASN 21 Cb 0.61 -0.38 0.44 0.00 -2.08 0.00 0.00 39.78 38.37 4a3h n ASN 21 CO 0.00 0.00 0.00 -1.84 -0.93 0.00 0.00 177.26 174.49 4a3h n GLU 22 N -2.08 0.21 -0.11 -3.83 0.28 -0.75 -0.60 120.64 113.76 4a3h n GLU 22 Ca 0.08 0.13 0.11 0.00 -0.16 0.00 0.00 57.16 57.32 4a3h n GLU 22 Cb 0.29 -1.50 0.16 0.00 1.43 0.00 0.00 31.44 31.82 4a3h n GLU 22 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 4a3h n ARG 23 N -1.32 2.30 -0.90 3.44 1.74 -1.26 -4.97 116.66 115.69 4a3h n ARG 23 Ca 0.08 -2.08 0.00 0.00 -0.77 0.00 0.00 57.85 55.08 4a3h n ARG 23 Cb 0.15 -1.46 0.00 0.00 -1.02 0.00 0.00 32.46 30.13 4a3h n ARG 23 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4a3h n GLY 24 N 1.34 0.55 3.81 -0.13 0.00 0.23 -5.04 105.19 105.95 4a3h n GLY 24 Ca 0.16 -0.01 -0.38 0.00 0.00 0.00 0.00 46.02 45.80 4a3h n GLY 24 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 4a3h s GLU 25 N -0.11 4.25 0.31 1.61 0.41 -1.26 -4.76 118.70 119.16 4a3h s GLU 25 Ca 0.00 0.81 -0.29 0.00 -0.41 0.00 0.00 54.97 55.08 4a3h s GLU 25 Cb 0.00 -3.15 -0.11 0.00 -1.78 0.00 0.00 34.13 29.09 4a3h s GLU 25 CO 0.00 0.57 1.54 -0.65 -0.49 0.00 0.00 175.26 176.23 4a3h s GLN 26 N -1.36 4.14 0.03 1.61 -0.21 -1.26 -0.80 119.66 121.81 4a3h s GLN 26 Ca 0.34 2.53 0.04 0.00 0.02 0.00 0.00 55.36 58.29 4a3h s GLN 26 Cb -0.19 -3.02 -0.02 0.00 1.00 0.00 0.00 33.01 30.78 4a3h s GLN 26 CO 0.21 -0.57 -0.12 0.14 -2.12 0.00 0.00 175.29 172.83 4a3h s VAL 27 N -0.32 0.95 -0.12 1.09 -7.23 -0.94 -4.86 120.40 108.97 4a3h s VAL 27 Ca 0.60 -0.85 0.01 0.00 -1.81 0.00 0.00 61.98 59.93 4a3h s VAL 27 Cb -0.47 -0.86 0.02 0.00 0.56 0.00 0.00 36.38 35.63 4a3h s VAL 27 CO 0.51 0.02 -0.14 -1.58 -0.31 0.00 0.00 175.10 173.60 4a3h s GLN 28 N -0.94 2.15 -0.09 4.82 0.74 -1.26 -4.71 119.66 120.37 4a3h s GLN 28 Ca 0.01 -0.52 -0.11 0.00 0.05 0.00 0.00 55.36 54.79 4a3h s GLN 28 Cb -0.07 -1.91 -0.05 0.00 1.10 0.00 0.00 33.01 32.09 4a3h s GLN 28 CO 0.01 -0.14 0.26 -0.51 -0.55 0.00 0.00 175.29 174.36 4a3h s LEU 29 N 1.22 4.39 -0.03 3.68 1.43 -1.26 -4.99 118.68 123.11 4a3h s LEU 29 Ca -0.02 0.65 -0.00 0.00 -1.03 0.00 0.00 54.13 53.73 4a3h s LEU 29 Cb -0.14 -2.31 0.03 0.00 0.03 0.00 0.00 46.19 43.79 4a3h s LEU 29 CO -0.05 0.31 0.01 -0.54 0.23 0.00 0.00 176.35 176.31 4a3h s LYS 30 N -0.71 0.25 0.00 1.70 1.02 -1.25 -0.62 119.74 120.12 4a3h s LYS 30 Ca 0.18 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.30 4a3h s LYS 30 Cb -0.14 -0.52 0.00 0.00 -0.52 0.00 0.00 37.83 36.66 4a3h s LYS 30 CO 0.07 -0.18 0.00 0.41 -0.92 0.00 0.00 175.35 174.73 4a3h n GLY 31 N 4.41 2.24 3.47 -3.33 0.00 -0.49 -2.07 105.19 109.43 4a3h n GLY 31 Ca -0.21 -0.74 -0.29 0.00 0.00 0.00 0.00 46.02 44.78 4a3h n GLY 31 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 4a3h s MET 32 N 0.63 1.72 -0.06 1.61 -1.94 -1.21 -1.05 119.30 119.00 4a3h s MET 32 Ca 0.00 -1.23 -0.04 0.00 -1.71 0.00 0.00 55.69 52.72 4a3h s MET 32 Cb 0.00 -2.07 -0.04 0.00 2.01 0.00 0.00 34.83 34.73 4a3h s MET 32 CO 0.00 0.47 0.12 0.45 -0.01 0.00 0.00 175.02 176.05 4a3h s SER 33 N -2.19 6.06 1.05 3.03 0.15 0.38 -1.15 113.70 121.03 4a3h s SER 33 Ca 0.18 0.32 -0.13 0.00 0.70 0.00 0.00 55.95 57.02 4a3h s SER 33 Cb -0.10 -1.87 0.22 0.00 -1.71 0.00 0.00 66.02 62.56 4a3h s SER 33 CO 0.10 0.33 1.07 -0.94 1.20 0.00 0.00 173.24 175.00 4a3h s SER 34 N -1.42 2.08 0.22 5.45 1.04 0.15 -0.89 113.70 120.34 4a3h s SER 34 Ca 0.20 1.27 0.00 0.00 0.48 0.00 0.00 55.95 57.90 4a3h s SER 34 Cb -0.12 -1.97 0.00 0.00 0.10 0.00 0.00 66.02 64.03 4a3h s SER 34 CO 0.10 -3.48 0.00 1.57 0.98 0.00 0.00 173.24 172.41 4a3h n HIS 35 N -4.42 -1.44 -1.78 5.02 -0.00 -1.26 -4.55 115.22 106.80 4a3h n HIS 35 Ca 0.04 0.00 -0.42 0.00 0.46 0.00 0.00 57.72 57.80 4a3h n HIS 35 Cb 0.56 0.00 -0.03 0.00 -0.12 0.00 0.00 29.99 30.40 4a3h n HIS 35 CO 0.00 0.00 0.00 0.20 0.46 0.00 0.00 176.34 177.00 4a3h s GLY 36 N -1.63 1.31 0.56 1.57 0.00 -1.26 -4.38 107.32 103.50 4a3h s GLY 36 Ca 0.00 1.54 0.37 0.00 0.00 0.00 0.00 44.72 46.62 4a3h s GLY 36 CO 0.00 2.81 2.10 1.41 0.00 0.00 0.00 173.10 179.42 4a3h h LEU 37 N 6.75 0.00 -0.08 0.66 3.38 -1.79 -0.87 115.31 123.36 4a3h h LEU 37 Ca -0.43 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.54 4a3h h LEU 37 Cb 1.20 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.95 4a3h h LEU 37 CO 0.94 0.00 0.00 0.00 0.09 0.00 0.00 178.44 179.47 4a3h n GLN 38 N -2.99 0.12 -0.02 1.13 0.00 -1.26 -3.27 117.38 111.10 4a3h n GLN 38 Ca -0.01 0.16 -0.03 0.00 0.00 0.00 0.00 57.00 57.13 4a3h n GLN 38 Cb 0.20 -1.66 -0.02 0.00 0.00 0.00 0.00 30.24 28.77 4a3h n GLN 38 CO 0.00 0.00 0.00 0.91 0.00 0.00 0.00 177.06 177.97 4a3h n TRP 39 N -1.87 0.00 -2.41 2.61 8.01 -0.64 -4.87 117.44 118.27 4a3h n TRP 39 Ca 0.06 0.00 -0.10 0.00 -1.31 0.00 0.00 57.50 56.14 4a3h n TRP 39 Cb 0.34 -0.13 0.04 0.00 -2.01 0.00 0.00 31.31 29.55 4a3h n TRP 39 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 4a3h n TYR 40 N -2.63 1.83 0.28 -5.99 4.01 -0.43 -4.86 117.16 109.37 4a3h n TYR 40 Ca -0.06 -2.09 0.14 0.00 -0.16 0.00 0.00 57.90 55.74 4a3h n TYR 40 Cb 0.56 -0.28 0.79 0.00 -0.31 0.00 0.00 39.34 40.11 4a3h n TYR 40 CO 0.00 0.00 0.00 0.78 -0.46 0.00 0.00 176.86 177.18 4a3h h GLY 41 N 2.29 0.00 2.00 2.72 0.00 -1.71 -2.80 103.07 105.57 4a3h h GLY 41 Ca 0.09 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 4a3h h GLY 41 CO 0.43 0.00 -0.02 0.06 0.00 0.00 0.00 176.54 177.01 4a3h h GLN 42 N 0.00 0.00 -0.02 4.80 -0.00 -1.89 -1.66 115.11 116.34 4a3h h GLN 42 Ca -0.00 0.00 0.00 0.00 -0.00 0.00 0.00 58.65 58.65 4a3h h GLN 42 Cb 0.28 0.00 0.00 0.00 -0.00 0.00 0.00 27.48 27.76 4a3h h GLN 42 CO 0.01 0.02 0.00 1.19 -0.00 0.00 0.00 178.83 180.05 4a3h n PHE 43 N -3.18 0.02 -3.69 0.06 3.72 -1.06 -4.65 117.46 108.69 4a3h n PHE 43 Ca -0.01 -0.01 -0.38 0.00 -0.05 0.00 0.00 57.45 56.99 4a3h n PHE 43 Cb 0.20 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.63 4a3h n PHE 43 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 4a3h s VAL 44 N -1.98 3.76 0.13 -4.37 1.01 -0.63 -4.77 120.40 113.55 4a3h s VAL 44 Ca 0.41 -1.70 -0.25 0.00 0.00 0.00 0.00 61.98 60.43 4a3h s VAL 44 Cb 0.20 -3.41 0.07 0.00 0.00 0.00 0.00 36.38 33.24 4a3h s VAL 44 CO 0.33 -0.58 0.78 0.54 0.00 0.00 0.00 175.10 176.16 4a3h s ASN 45 N 2.03 -0.38 0.22 3.32 2.20 -1.26 -4.88 114.94 116.18 4a3h s ASN 45 Ca 0.04 -0.18 -0.08 0.00 -0.94 0.00 0.00 52.86 51.71 4a3h s ASN 45 Cb -0.23 0.53 0.32 0.00 -2.00 0.00 0.00 41.25 39.87 4a3h s ASN 45 CO -0.01 -0.91 1.75 0.22 -2.94 0.00 0.00 177.10 175.21 4a3h h TYR 46 N 2.00 0.47 -0.35 1.54 3.20 -1.95 -1.43 116.97 120.45 4a3h h TYR 46 Ca -0.26 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.60 4a3h h TYR 46 Cb 1.26 -0.11 -0.01 0.00 1.54 0.00 0.00 36.73 39.41 4a3h h TYR 46 CO 0.30 0.12 0.04 1.49 -1.64 0.00 0.00 178.16 178.47 4a3h h GLU 47 N 0.46 0.59 -0.36 1.82 4.81 -1.94 0.24 114.58 120.19 4a3h h GLU 47 Ca 0.33 -0.17 -0.12 0.00 -0.13 0.00 0.00 59.36 59.27 4a3h h GLU 47 Cb 0.42 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.72 4a3h h GLU 47 CO -0.31 0.68 -0.27 0.66 -0.73 0.00 0.00 179.01 179.03 4a3h h SER 48 N 0.42 0.77 0.07 1.04 4.64 -1.49 -1.44 113.55 117.56 4a3h h SER 48 Ca 0.10 -0.30 -0.10 0.00 -0.47 0.00 0.00 61.79 61.03 4a3h h SER 48 Cb 0.39 -0.21 -0.01 0.00 -0.31 0.00 0.00 62.40 62.25 4a3h h SER 48 CO 0.01 1.00 -0.32 -0.03 -0.87 0.00 0.00 176.83 176.63 4a3h h MET 49 N 0.64 0.37 -0.39 4.77 1.85 -1.07 -0.89 114.93 120.22 4a3h h MET 49 Ca 0.08 -0.15 -0.15 0.00 -0.61 0.00 0.00 59.70 58.87 4a3h h MET 49 Cb 0.79 -0.02 -0.01 0.00 0.43 0.00 0.00 31.60 32.80 4a3h h MET 49 CO 0.07 0.65 -0.36 -0.22 -0.40 0.00 0.00 176.91 176.64 4a3h h LYS 50 N 0.32 0.91 -0.47 0.39 3.64 -0.73 -0.12 116.57 120.50 4a3h h LYS 50 Ca 0.04 -0.46 -0.02 0.00 -1.27 0.00 0.00 60.65 58.94 4a3h h LYS 50 Cb 0.72 0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.53 4a3h h LYS 50 CO 0.05 1.12 0.21 2.35 -2.27 0.00 0.00 179.45 180.92 4a3h h TRP 51 N 0.75 0.70 -0.75 1.91 2.91 -1.04 0.10 115.95 120.53 4a3h h TRP 51 Ca 0.07 -0.04 0.00 0.00 1.13 0.00 0.00 58.89 60.05 4a3h h TRP 51 Cb 0.95 -0.21 -0.04 0.00 -0.51 0.00 0.00 29.16 29.35 4a3h h TRP 51 CO 0.06 0.57 0.48 -0.07 -1.03 0.00 0.00 178.44 178.45 4a3h h LEU 52 N 0.62 0.88 -0.03 0.65 3.38 -0.91 0.71 115.31 120.61 4a3h h LEU 52 Ca 0.16 -0.04 -0.00 0.00 0.09 0.00 0.00 57.88 58.09 4a3h h LEU 52 Cb 0.15 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 40.67 4a3h h LEU 52 CO -0.02 0.65 0.01 -0.09 0.09 0.00 0.00 178.44 179.08 4a3h h ARG 53 N 1.02 0.04 0.21 1.13 2.43 -0.55 -1.50 114.38 117.15 4a3h h ARG 53 Ca 0.27 -0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 59.12 4a3h h ARG 53 Cb -0.09 -0.01 0.02 0.00 -0.42 0.00 0.00 29.97 29.47 4a3h h ARG 53 CO -0.06 0.12 -1.46 -0.44 -1.51 0.00 0.00 179.97 176.63 4a3h h ASP 54 N -0.06 0.68 0.13 -3.80 3.32 -0.60 -2.25 116.42 113.85 4a3h h ASP 54 Ca 0.01 -0.77 -0.36 0.00 0.02 0.00 0.00 57.03 55.93 4a3h h ASP 54 Cb 0.10 -0.22 -0.05 0.00 0.22 0.00 0.00 39.33 39.37 4a3h h ASP 54 CO -0.00 1.61 -2.18 -0.67 -1.72 0.00 0.00 179.24 176.27 4a3h n ASP 55 N -3.63 1.34 -0.03 6.45 2.03 0.22 -4.48 116.55 118.46 4a3h n ASP 55 Ca -0.16 0.09 -0.04 0.00 0.52 0.00 0.00 54.79 55.21 4a3h n ASP 55 Cb 1.08 -0.13 -0.13 0.00 -0.72 0.00 0.00 41.12 41.22 4a3h n ASP 55 CO 0.00 0.00 0.00 0.79 -1.92 0.00 0.00 177.20 176.07 4a3h n TRP 56 N -3.16 0.57 -0.34 -0.67 7.02 -0.78 -4.92 117.44 115.17 4a3h n TRP 56 Ca -0.34 0.20 0.00 0.00 -1.02 0.00 0.00 57.50 56.34 4a3h n TRP 56 Cb 1.06 -1.02 0.00 0.00 -2.42 0.00 0.00 31.31 28.93 4a3h n TRP 56 CO 0.00 0.00 0.00 0.41 -2.02 0.00 0.00 177.69 176.08 4a3h n GLY 57 N 1.53 0.82 3.69 6.99 0.00 -0.64 -2.77 105.19 114.81 4a3h n GLY 57 Ca -0.18 -0.08 -0.37 0.00 0.00 0.00 0.00 46.02 45.39 4a3h n GLY 57 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 4a3h n ILE 58 N -2.34 4.51 -0.42 -0.61 -5.35 -0.96 -4.93 119.36 109.26 4a3h n ILE 58 Ca 0.00 -0.50 0.00 0.00 -0.27 0.00 0.00 62.75 61.98 4a3h n ILE 58 Cb 0.00 -1.39 0.00 0.00 -1.74 0.00 0.00 39.64 36.51 4a3h n ILE 58 CO 0.00 0.00 0.00 -0.46 -1.76 0.00 0.00 176.55 174.33 4a3h n ASN 59 N -1.49 1.04 -3.73 7.28 0.23 -0.88 -4.54 115.26 113.16 4a3h n ASN 59 Ca 0.15 -1.46 -0.14 0.00 -0.53 0.00 0.00 54.58 52.60 4a3h n ASN 59 Cb 0.48 0.00 -0.09 0.00 -2.08 0.00 0.00 39.78 38.09 4a3h n ASN 59 CO 0.00 0.00 0.00 0.54 -0.93 0.00 0.00 177.26 176.87 4a3h s VAL 60 N -0.46 0.03 -0.03 3.53 0.11 -1.25 -1.55 120.40 120.78 4a3h s VAL 60 Ca 0.00 -0.28 0.02 0.00 -2.93 0.00 0.00 61.98 58.79 4a3h s VAL 60 Cb 0.00 -0.63 0.01 0.00 -1.53 0.00 0.00 36.38 34.23 4a3h s VAL 60 CO 0.00 -0.15 -0.08 0.12 -3.33 0.00 0.00 175.10 171.65 4a3h s PHE 61 N -0.83 0.90 -0.22 1.54 5.36 -0.69 -3.35 117.98 120.69 4a3h s PHE 61 Ca -0.09 -0.23 -0.05 0.00 -0.96 0.00 0.00 56.93 55.60 4a3h s PHE 61 Cb -0.04 -0.66 -0.02 0.00 -0.34 0.00 0.00 43.02 41.96 4a3h s PHE 61 CO 0.04 -0.11 0.01 0.50 -1.46 0.00 0.00 175.22 174.19 4a3h s ARG 62 N 0.30 3.57 -0.52 10.12 3.52 -0.30 -0.80 118.95 134.84 4a3h s ARG 62 Ca -0.05 -0.53 -0.19 0.00 -0.13 0.00 0.00 55.73 54.83 4a3h s ARG 62 Cb -0.09 -3.13 0.06 0.00 -1.56 0.00 0.00 34.95 30.23 4a3h s ARG 62 CO 0.01 -0.10 0.65 0.00 -0.81 0.00 0.00 175.30 175.05 4a3h s ALA 63 N 1.29 3.38 -0.92 6.12 0.00 -0.43 -0.68 121.76 130.52 4a3h s ALA 63 Ca 0.04 -1.77 -0.18 0.00 0.00 0.00 0.00 51.96 50.04 4a3h s ALA 63 Cb -0.15 -3.39 0.14 0.00 0.00 0.00 0.00 23.12 19.72 4a3h s ALA 63 CO 0.01 -2.06 1.10 0.00 0.00 0.00 0.00 175.76 174.81 4a3h s ALA 64 N 2.69 3.41 -0.95 0.00 0.00 -1.26 -1.83 121.76 123.82 4a3h s ALA 64 Ca 0.15 -2.79 -0.18 0.00 0.00 0.00 0.00 51.96 49.15 4a3h s ALA 64 Cb -0.19 -4.01 0.14 0.00 0.00 0.00 0.00 23.12 19.06 4a3h s ALA 64 CO 0.12 -2.93 1.13 1.41 0.00 0.00 0.00 175.76 175.49 4a3h s MET 65 N 2.53 3.66 0.33 0.00 1.75 -0.64 -2.24 119.30 124.68 4a3h s MET 65 Ca 0.31 -1.92 -0.28 0.00 -1.25 0.00 0.00 55.69 52.55 4a3h s MET 65 Cb -0.06 -4.89 -0.12 0.00 2.84 0.00 0.00 34.83 32.61 4a3h s MET 65 CO -0.09 -1.72 1.29 0.66 -0.65 0.00 0.00 175.02 174.51 4a3h n TYR 66 N 6.19 2.23 -0.09 4.11 4.02 -1.26 -1.01 117.16 131.35 4a3h n TYR 66 Ca 0.24 0.55 -0.20 0.00 -0.01 0.00 0.00 57.90 58.48 4a3h n TYR 66 Cb 0.48 -2.41 -0.12 0.00 -0.02 0.00 0.00 39.34 37.27 4a3h n TYR 66 CO 0.00 0.00 0.00 1.79 -1.01 0.00 0.00 176.86 177.64 4a3h h THR 67 N 2.57 1.12 -2.38 -0.72 1.35 -1.88 -0.19 112.91 112.78 4a3h h THR 67 Ca -0.46 -2.23 0.00 0.00 -0.55 0.00 0.00 66.41 63.17 4a3h h THR 67 Cb 1.28 2.53 0.00 0.00 -1.73 0.00 0.00 68.15 70.23 4a3h h THR 67 CO 0.64 0.41 0.00 -0.24 -0.25 0.00 0.00 175.52 176.08 4a3h n SER 68 N -4.43 0.00 -3.90 5.36 2.88 -1.26 -1.43 113.62 110.84 4a3h n SER 68 Ca -0.27 0.00 -0.29 0.00 -1.33 0.00 0.00 58.87 56.98 4a3h n SER 68 Cb 0.65 0.00 0.02 0.00 -0.75 0.00 0.00 64.21 64.14 4a3h n SER 68 CO 0.00 0.00 0.00 -1.20 -1.23 0.00 0.00 175.04 172.61 4a3h n SER 69 N 0.00 -4.10 0.00 -3.46 7.64 -1.26 -0.75 113.62 111.69 4a3h n SER 69 Ca 0.00 -0.80 0.00 0.00 1.01 0.00 0.00 58.87 59.08 4a3h n SER 69 Cb 0.00 -3.84 0.00 0.00 -1.01 0.00 0.00 64.21 59.36 4a3h n SER 69 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 4a3h n GLY 70 N -1.67 0.47 0.00 0.23 0.00 -1.26 -5.02 105.19 97.93 4a3h n GLY 70 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 4a3h n GLY 70 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4a3h n GLY 71 N -2.60 0.91 0.33 -0.02 0.00 0.07 -4.48 105.19 99.41 4a3h n GLY 71 Ca 0.00 -1.46 0.06 0.00 0.00 0.00 0.00 46.02 44.62 4a3h n GLY 71 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 4a3h h TYR 72 N 0.00 0.96 -0.65 1.61 3.20 -0.88 -0.41 116.97 120.80 4a3h h TYR 72 Ca 0.00 0.03 -0.05 0.00 3.14 0.00 0.00 58.73 61.85 4a3h h TYR 72 Cb 0.00 -0.29 -0.03 0.00 1.54 0.00 0.00 36.73 37.95 4a3h h TYR 72 CO 0.00 0.34 0.20 0.82 -1.64 0.00 0.00 178.16 177.87 4a3h h ILE 73 N 0.82 1.25 0.06 1.81 1.08 -1.51 -2.38 117.51 118.65 4a3h h ILE 73 Ca 0.47 -0.87 -0.25 0.00 -0.39 0.00 0.00 64.86 63.82 4a3h h ILE 73 Cb 0.53 0.58 0.01 0.00 -3.07 0.00 0.00 36.82 34.86 4a3h h ILE 73 CO -0.29 0.33 -1.09 0.44 -0.69 0.00 0.00 178.15 176.85 4a3h h ASP 74 N 0.95 0.53 -1.93 1.72 3.32 -1.62 -3.43 116.42 115.96 4a3h h ASP 74 Ca 0.21 -0.48 -0.27 0.00 0.02 0.00 0.00 57.03 56.51 4a3h h ASP 74 Cb 0.30 -0.17 -0.31 0.00 0.22 0.00 0.00 39.33 39.38 4a3h h ASP 74 CO -0.01 1.31 -0.59 -0.62 -1.72 0.00 0.00 179.24 177.62 4a3h s ASP 75 N -7.15 1.05 0.00 6.45 -1.08 -0.21 -5.03 116.67 110.71 4a3h s ASP 75 Ca -0.05 -0.63 0.17 0.00 -0.52 0.00 0.00 52.55 51.52 4a3h s ASP 75 Cb 0.08 0.79 0.79 0.00 -1.46 0.00 0.00 42.92 43.12 4a3h s ASP 75 CO 0.88 -0.37 1.55 -0.81 0.52 0.00 0.00 175.17 176.94 4a3h n PRO 76 N 5.28 0.09 0.20 4.34 -0.04 -0.90 -3.37 135.00 140.59 4a3h n PRO 76 Ca -0.00 0.17 0.18 0.00 -0.04 0.00 0.00 63.50 63.81 4a3h n PRO 76 Cb 0.48 -1.50 0.82 0.00 -0.04 0.00 0.00 33.50 33.26 4a3h n PRO 76 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 4a3h h SER 77 N 0.00 0.00 0.30 3.54 4.64 -1.93 -0.21 113.55 119.88 4a3h h SER 77 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 4a3h h SER 77 Cb 0.25 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.34 4a3h h SER 77 CO 0.00 0.00 0.00 1.62 -0.87 0.00 0.00 176.83 177.58 4a3h h VAL 78 N 0.00 0.00 0.00 0.95 3.04 -1.93 -0.86 116.25 117.45 4a3h h VAL 78 Ca 0.10 -0.14 -0.01 0.00 -1.01 0.00 0.00 66.70 65.63 4a3h h VAL 78 Cb 0.58 1.06 -0.00 0.00 -2.01 0.00 0.00 31.29 30.93 4a3h h VAL 78 CO -0.00 0.00 -0.07 0.07 -1.01 0.00 0.00 177.57 176.56 4a3h h LYS 79 N 0.00 0.00 0.00 4.17 2.10 -1.32 -1.17 116.57 120.34 4a3h h LYS 79 Ca 0.00 0.00 -0.11 0.00 -2.00 0.00 0.00 60.65 58.54 4a3h h LYS 79 Cb 0.15 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 31.46 4a3h h LYS 79 CO 0.00 0.07 -0.50 0.93 -2.00 0.00 0.00 179.45 177.95 4a3h h GLU 80 N 0.00 0.00 -0.13 0.07 4.39 -1.35 -1.95 114.58 115.61 4a3h h GLU 80 Ca -0.00 0.00 -0.17 0.00 0.34 0.00 0.00 59.36 59.53 4a3h h GLU 80 Cb 0.22 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.87 4a3h h GLU 80 CO 0.01 0.50 -0.65 -0.22 -1.16 0.00 0.00 179.01 177.50 4a3h h LYS 81 N 0.00 0.48 -0.50 2.33 1.63 -1.35 -0.49 116.57 118.67 4a3h h LYS 81 Ca -0.01 -0.35 0.04 0.00 -0.85 0.00 0.00 60.65 59.48 4a3h h LYS 81 Cb 1.04 0.06 -0.04 0.00 -0.60 0.00 0.00 32.23 32.69 4a3h h LYS 81 CO 0.07 0.97 0.27 0.28 -3.45 0.00 0.00 179.45 177.58 4a3h h VAL 82 N 0.35 0.99 -0.78 2.00 2.07 -1.10 -1.36 116.25 118.42 4a3h h VAL 82 Ca -0.01 -0.18 0.03 0.00 0.82 0.00 0.00 66.70 67.35 4a3h h VAL 82 Cb 1.20 0.41 -0.05 0.00 -1.52 0.00 0.00 31.29 31.34 4a3h h VAL 82 CO 0.12 0.10 0.50 0.11 0.02 0.00 0.00 177.57 178.41 4a3h h LYS 83 N 0.53 0.95 -0.56 1.57 1.57 -1.07 -0.57 116.57 118.99 4a3h h LYS 83 Ca 0.21 -0.06 0.03 0.00 -1.87 0.00 0.00 60.65 58.97 4a3h h LYS 83 Cb 0.09 -0.21 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 4a3h h LYS 83 CO -0.13 0.63 0.34 1.49 -0.57 0.00 0.00 179.45 181.20 4a3h h GLU 84 N 0.98 0.64 -0.74 3.15 4.81 -0.73 0.17 114.58 122.86 4a3h h GLU 84 Ca 0.31 -0.04 -0.06 0.00 -0.13 0.00 0.00 59.36 59.44 4a3h h GLU 84 Cb -0.01 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.20 4a3h h GLU 84 CO -0.10 0.42 0.22 0.00 -0.73 0.00 0.00 179.01 178.82 4a3h h ALA 85 N 1.25 0.97 -0.33 2.92 0.00 -0.65 -1.26 119.26 122.17 4a3h h ALA 85 Ca 0.23 -0.23 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 4a3h h ALA 85 Cb 0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 4a3h h ALA 85 CO -0.11 0.66 0.13 0.28 0.00 0.00 0.00 179.25 180.22 4a3h h VAL 86 N 1.10 1.19 -0.80 0.00 2.07 -0.71 -1.31 116.25 117.79 4a3h h VAL 86 Ca 0.24 -0.58 -0.04 0.00 0.82 0.00 0.00 66.70 67.14 4a3h h VAL 86 Cb 0.33 0.95 -0.04 0.00 -1.52 0.00 0.00 31.29 31.01 4a3h h VAL 86 CO -0.00 0.20 0.35 -0.33 0.02 0.00 0.00 177.57 177.81 4a3h h GLU 87 N 0.39 1.18 -0.59 1.57 5.08 -0.80 -0.59 114.58 120.82 4a3h h GLU 87 Ca 0.11 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.22 4a3h h GLU 87 Cb 0.19 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 4a3h h GLU 87 CO -0.01 0.93 0.13 0.00 -1.00 0.00 0.00 179.01 179.07 4a3h h ALA 88 N 1.22 0.78 -0.93 3.43 0.00 -1.07 0.29 119.26 122.97 4a3h h ALA 88 Ca 0.27 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 54.95 4a3h h ALA 88 Cb 0.17 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.69 4a3h h ALA 88 CO -0.03 0.49 0.60 0.00 0.00 0.00 0.00 179.25 180.31 4a3h h ALA 89 N 1.03 1.18 -0.29 0.00 0.00 -0.78 0.22 119.26 120.62 4a3h h ALA 89 Ca 0.18 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.00 4a3h h ALA 89 Cb 0.36 -0.38 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 4a3h h ALA 89 CO 0.00 0.60 0.12 0.82 0.00 0.00 0.00 179.25 180.79 4a3h h ILE 90 N 1.27 1.18 -0.10 0.00 2.04 -0.76 0.42 117.51 121.55 4a3h h ILE 90 Ca 0.34 -0.55 -0.06 0.00 1.00 0.00 0.00 64.86 65.59 4a3h h ILE 90 Cb -0.12 0.99 -0.01 0.00 -0.74 0.00 0.00 36.82 36.95 4a3h h ILE 90 CO -0.07 0.19 -0.23 0.44 0.00 0.00 0.00 178.15 178.48 4a3h h ASP 91 N 0.33 0.16 0.04 1.72 3.32 -0.44 -2.74 116.42 118.80 4a3h h ASP 91 Ca 0.10 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.11 4a3h h ASP 91 Cb 0.18 -0.04 0.00 0.00 0.22 0.00 0.00 39.33 39.69 4a3h h ASP 91 CO -0.01 0.41 -0.08 0.18 -1.72 0.00 0.00 179.24 178.02 4a3h n LEU 92 N -4.20 1.62 -3.55 1.55 4.77 0.72 -4.97 117.00 112.95 4a3h n LEU 92 Ca -0.01 -0.53 -0.22 0.00 -0.03 0.00 0.00 56.01 55.22 4a3h n LEU 92 Cb 0.33 -0.03 0.08 0.00 -2.33 0.00 0.00 43.42 41.48 4a3h n LEU 92 CO 0.39 0.28 0.20 -0.67 -1.33 0.00 0.00 177.39 176.25 4a3h n ASP 93 N 0.14 -4.83 -4.47 -1.43 2.03 0.04 -4.81 116.55 103.22 4a3h n ASP 93 Ca 0.16 -0.57 -0.23 0.00 0.52 0.00 0.00 54.79 54.67 4a3h n ASP 93 Cb 0.39 -5.05 -0.10 0.00 -0.72 0.00 0.00 41.12 35.64 4a3h n ASP 93 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 4a3h s ILE 94 N -3.34 1.73 0.57 5.18 -4.36 -0.60 -2.00 121.20 118.39 4a3h s ILE 94 Ca 0.38 -2.11 -0.12 0.00 -0.26 0.00 0.00 60.65 58.54 4a3h s ILE 94 Cb -0.17 -2.58 -0.05 0.00 1.25 0.00 0.00 42.46 40.91 4a3h s ILE 94 CO 0.73 -0.21 0.98 -0.31 0.24 0.00 0.00 174.94 176.37 4a3h s TYR 95 N -2.94 3.57 -0.06 1.37 2.02 -0.60 -4.43 117.35 116.28 4a3h s TYR 95 Ca 0.31 1.26 -0.04 0.00 -0.37 0.00 0.00 57.07 58.23 4a3h s TYR 95 Cb 0.05 -2.68 0.02 0.00 -0.40 0.00 0.00 41.96 38.96 4a3h s TYR 95 CO 0.14 -0.54 0.15 0.54 -1.57 0.00 0.00 175.55 174.27 4a3h s VAL 96 N -2.96 -0.02 -0.20 0.71 0.11 0.01 -1.71 120.40 116.35 4a3h s VAL 96 Ca 0.55 0.06 -0.06 0.00 -2.93 0.00 0.00 61.98 59.60 4a3h s VAL 96 Cb -0.11 -0.23 -0.03 0.00 -1.53 0.00 0.00 36.38 34.48 4a3h s VAL 96 CO 0.47 0.03 0.03 -0.63 -3.33 0.00 0.00 175.10 171.66 4a3h s ILE 97 N 0.47 4.23 -0.52 7.04 1.01 0.02 -0.74 121.20 132.71 4a3h s ILE 97 Ca -0.03 -0.22 -0.20 0.00 0.00 0.00 0.00 60.65 60.20 4a3h s ILE 97 Cb -0.05 -2.92 0.06 0.00 0.01 0.00 0.00 42.46 39.56 4a3h s ILE 97 CO -0.02 0.43 0.69 -0.63 0.00 0.00 0.00 174.94 175.40 4a3h s ILE 98 N 0.87 4.78 -0.36 2.92 1.01 -0.23 -1.32 121.20 128.87 4a3h s ILE 98 Ca 0.02 -0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.20 4a3h s ILE 98 Cb -0.14 -4.35 0.03 0.00 0.01 0.00 0.00 42.46 38.00 4a3h s ILE 98 CO 0.02 -0.88 0.17 -0.62 0.00 0.00 0.00 174.94 173.64 4a3h s ASP 99 N 2.76 5.59 -0.85 3.58 2.15 -0.76 -0.51 116.67 128.63 4a3h s ASP 99 Ca 0.18 -0.96 -0.25 0.00 0.43 0.00 0.00 52.55 51.94 4a3h s ASP 99 Cb -0.18 -1.98 0.02 0.00 -0.30 0.00 0.00 42.92 40.48 4a3h s ASP 99 CO 0.13 -0.34 1.53 0.86 -0.17 0.00 0.00 175.17 177.17 4a3h s TRP 100 N 1.52 2.21 -1.22 -5.34 -0.11 -0.36 -1.63 118.94 114.02 4a3h s TRP 100 Ca 0.02 -0.12 -0.10 0.00 1.22 0.00 0.00 56.10 57.11 4a3h s TRP 100 Cb -0.19 -4.49 0.20 0.00 -1.50 0.00 0.00 33.47 27.49 4a3h s TRP 100 CO 0.06 -2.01 1.58 1.58 -4.62 0.00 0.00 176.95 173.54 4a3h n HIS 101 N 10.38 3.92 -2.29 5.86 -0.00 -0.18 -1.45 115.22 131.46 4a3h n HIS 101 Ca 0.22 -3.11 -0.35 0.00 0.46 0.00 0.00 57.72 54.94 4a3h n HIS 101 Cb 0.50 -1.94 -0.00 0.00 -0.12 0.00 0.00 29.99 28.42 4a3h n HIS 101 CO 0.00 0.00 0.00 0.96 0.46 0.00 0.00 176.34 177.76 4a3h s ILE 102 N 0.33 3.32 0.00 3.57 -4.36 -1.26 -2.94 121.20 119.86 4a3h s ILE 102 Ca 0.39 0.81 0.00 0.00 -0.26 0.00 0.00 60.65 61.59 4a3h s ILE 102 Cb 0.02 -3.32 0.00 0.00 1.25 0.00 0.00 42.46 40.41 4a3h s ILE 102 CO 0.01 -0.20 0.00 -0.11 0.24 0.00 0.00 174.94 174.88 4a3h n LEU 103 N -1.31 0.00 0.21 0.37 7.94 -1.26 -3.28 117.00 119.67 4a3h n LEU 103 Ca 0.11 0.00 0.06 0.00 -1.11 0.00 0.00 56.01 55.07 4a3h n LEU 103 Cb 0.51 0.00 0.48 0.00 0.53 0.00 0.00 43.42 44.95 4a3h n LEU 103 CO 0.42 0.00 0.83 0.77 -1.11 0.00 0.00 177.39 178.30 4a3h h SER 104 N 0.00 0.00 -0.98 1.96 4.64 -1.92 -3.05 113.55 114.19 4a3h h SER 104 Ca 0.00 0.00 -0.71 0.00 -0.47 0.00 0.00 61.79 60.61 4a3h h SER 104 Cb 0.00 0.00 -0.10 0.00 -0.31 0.00 0.00 62.40 61.99 4a3h h SER 104 CO 0.00 0.26 2.26 -0.90 -0.87 0.00 0.00 176.83 177.58 4a3h n ASP 105 N -4.02 4.73 0.24 4.97 5.75 -1.26 -4.81 116.55 122.14 4a3h n ASP 105 Ca -0.02 -2.94 0.15 0.00 -0.01 0.00 0.00 54.79 51.97 4a3h n ASP 105 Cb 0.33 -1.64 0.51 0.00 -1.03 0.00 0.00 41.12 39.28 4a3h n ASP 105 CO 0.00 0.00 0.00 -0.55 -0.11 0.00 0.00 177.20 176.54 4a3h h ASN 106 N 6.73 0.00 -3.51 -1.12 -1.07 -1.84 -3.40 115.58 111.37 4a3h h ASN 106 Ca 0.45 0.00 -0.63 0.00 0.07 0.00 0.00 56.30 56.18 4a3h h ASN 106 Cb 0.76 0.00 -0.19 0.00 -2.07 0.00 0.00 38.32 36.83 4a3h h ASN 106 CO 1.56 0.00 -0.59 -0.62 0.07 0.00 0.00 177.43 177.86 4a3h s ASP 107 N -5.68 5.45 0.58 6.14 -1.08 -1.26 -1.81 116.67 119.02 4a3h s ASP 107 Ca 0.04 -0.05 0.39 0.00 -0.52 0.00 0.00 52.55 52.40 4a3h s ASP 107 Cb 0.08 -1.96 1.95 0.00 -1.46 0.00 0.00 42.92 41.53 4a3h s ASP 107 CO 0.57 0.06 2.17 1.55 0.52 0.00 0.00 175.17 180.04 4a3h h PRO 108 N 7.51 0.00 0.00 4.34 0.13 -1.91 -1.80 132.00 140.27 4a3h h PRO 108 Ca -0.37 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.76 4a3h h PRO 108 Cb 1.17 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.30 4a3h h PRO 108 CO 0.63 0.00 0.00 -0.91 -0.23 0.00 0.00 178.00 177.49 4a3h h ASN 109 N 0.00 0.00 -0.39 1.44 2.35 -1.94 -3.18 115.58 113.87 4a3h h ASN 109 Ca 0.00 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.81 4a3h h ASN 109 Cb 0.16 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.48 4a3h h ASN 109 CO 0.00 0.00 0.05 0.40 -1.65 0.00 0.00 177.43 176.23 4a3h h ILE 110 N 0.00 0.77 -0.50 2.81 2.04 -1.68 -2.83 117.51 118.12 4a3h h ILE 110 Ca 0.00 -0.06 -0.33 0.00 1.00 0.00 0.00 64.86 65.47 4a3h h ILE 110 Cb 0.42 0.58 -0.22 0.00 -0.74 0.00 0.00 36.82 36.87 4a3h h ILE 110 CO 0.00 0.03 -0.28 -1.22 0.00 0.00 0.00 178.15 176.68 4a3h n TYR 111 N -5.13 1.69 -0.07 1.37 4.01 -1.23 -4.79 117.16 113.02 4a3h n TYR 111 Ca 0.02 -1.95 0.01 0.00 -0.16 0.00 0.00 57.90 55.82 4a3h n TYR 111 Cb 0.19 -0.52 0.31 0.00 -0.31 0.00 0.00 39.34 39.01 4a3h n TYR 111 CO 0.00 0.00 0.00 1.57 -0.46 0.00 0.00 176.86 177.97 4a3h h LYS 112 N 1.49 0.68 -0.37 -0.72 2.10 -1.48 0.15 116.57 118.42 4a3h h LYS 112 Ca 0.28 -0.08 -0.04 0.00 -2.00 0.00 0.00 60.65 58.81 4a3h h LYS 112 Cb 1.43 -0.13 -0.02 0.00 -0.90 0.00 0.00 32.23 32.61 4a3h h LYS 112 CO 0.58 0.54 0.09 0.93 -2.00 0.00 0.00 179.45 179.60 4a3h h GLU 113 N 0.68 0.60 -0.32 0.07 4.39 -1.86 -0.20 114.58 117.94 4a3h h GLU 113 Ca 0.17 -0.14 -0.07 0.00 0.34 0.00 0.00 59.36 59.65 4a3h h GLU 113 Cb 0.09 -0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.65 4a3h h GLU 113 CO -0.02 0.63 -0.11 0.93 -1.16 0.00 0.00 179.01 179.28 4a3h h GLU 114 N 0.45 0.55 -0.55 2.33 3.07 -1.82 -2.10 114.58 116.51 4a3h h GLU 114 Ca 0.12 -0.16 -0.03 0.00 -0.50 0.00 0.00 59.36 58.78 4a3h h GLU 114 Cb 0.30 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 28.13 4a3h h GLU 114 CO 0.00 0.66 0.21 0.00 -1.40 0.00 0.00 179.01 178.48 4a3h h ALA 115 N 1.38 0.72 -0.54 3.43 0.00 -0.62 -0.27 119.26 123.37 4a3h h ALA 115 Ca 0.09 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 4a3h h ALA 115 Cb 0.50 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 4a3h h ALA 115 CO 0.03 0.34 0.33 0.87 0.00 0.00 0.00 179.25 180.82 4a3h h LYS 116 N 0.76 0.73 -0.56 0.00 1.57 -0.82 0.11 116.57 118.36 4a3h h LYS 116 Ca 0.18 -0.07 -0.06 0.00 -1.87 0.00 0.00 60.65 58.84 4a3h h LYS 116 Cb 0.22 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.35 4a3h h LYS 116 CO -0.01 0.53 0.12 -0.44 -0.57 0.00 0.00 179.45 179.07 4a3h h ASP 117 N 0.72 0.86 -0.25 0.86 3.32 -1.12 -0.96 116.42 119.85 4a3h h ASP 117 Ca 0.19 -0.24 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 4a3h h ASP 117 Cb -0.01 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.30 4a3h h ASP 117 CO -0.04 0.88 0.06 0.15 -1.72 0.00 0.00 179.24 178.58 4a3h h PHE 118 N 0.80 0.43 0.00 4.55 3.57 -0.71 -1.78 116.94 123.80 4a3h h PHE 118 Ca 0.17 -0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.53 4a3h h PHE 118 Cb 0.37 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 4a3h h PHE 118 CO 0.03 0.49 -0.42 0.74 -2.23 0.00 0.00 178.31 176.92 4a3h h PHE 119 N 0.24 0.00 -0.02 0.41 0.04 -0.78 -0.62 116.94 116.21 4a3h h PHE 119 Ca 0.08 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.85 4a3h h PHE 119 Cb 0.28 0.00 -0.00 0.00 2.20 0.00 0.00 35.95 38.43 4a3h h PHE 119 CO 0.01 0.42 0.01 0.22 -0.60 0.00 0.00 178.31 178.37 4a3h h ASP 120 N 0.00 0.02 -0.30 2.17 3.58 -1.03 -0.45 116.42 120.41 4a3h h ASP 120 Ca -0.00 -0.11 -0.00 0.00 0.42 0.00 0.00 57.03 57.33 4a3h h ASP 120 Cb 0.86 -0.01 -0.01 0.00 1.72 0.00 0.00 39.33 41.89 4a3h h ASP 120 CO 0.05 0.13 0.17 -0.08 -2.88 0.00 0.00 179.24 176.63 4a3h h GLU 121 N -0.08 0.41 -0.46 0.28 4.81 -0.97 -0.33 114.58 118.25 4a3h h GLU 121 Ca 0.01 -0.04 -0.11 0.00 -0.13 0.00 0.00 59.36 59.09 4a3h h GLU 121 Cb 0.11 -0.08 -0.01 0.00 0.63 0.00 0.00 28.75 29.39 4a3h h GLU 121 CO -0.00 0.33 -0.15 0.52 -0.73 0.00 0.00 179.01 178.98 4a3h h MET 122 N 0.37 0.90 -0.03 1.92 2.86 -1.08 -1.39 114.93 118.49 4a3h h MET 122 Ca 0.11 -0.36 -0.12 0.00 -2.06 0.00 0.00 59.70 57.27 4a3h h MET 122 Cb 0.03 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 31.63 4a3h h MET 122 CO -0.02 1.01 -0.52 0.66 1.06 0.00 0.00 176.91 179.11 4a3h h SER 123 N 0.74 0.09 -0.55 1.22 4.64 -1.00 -0.94 113.55 117.76 4a3h h SER 123 Ca 0.11 -0.04 -0.10 0.00 -0.47 0.00 0.00 61.79 61.29 4a3h h SER 123 Cb 0.70 -0.03 -0.02 0.00 -0.31 0.00 0.00 62.40 62.75 4a3h h SER 123 CO 0.05 0.59 -0.04 -0.08 -0.87 0.00 0.00 176.83 176.48 4a3h h GLU 124 N 0.06 1.00 -0.15 4.77 4.81 -0.76 0.33 114.58 124.65 4a3h h GLU 124 Ca -0.00 -0.34 -0.12 0.00 -0.13 0.00 0.00 59.36 58.76 4a3h h GLU 124 Cb 0.94 -0.08 0.00 0.00 0.63 0.00 0.00 28.75 30.24 4a3h h GLU 124 CO 0.07 1.02 -0.39 -0.07 -0.73 0.00 0.00 179.01 178.91 4a3h h LEU 125 N 0.88 0.60 -2.01 1.64 3.38 -1.05 -3.38 115.31 115.35 4a3h h LEU 125 Ca 0.15 -0.58 0.00 0.00 0.09 0.00 0.00 57.88 57.54 4a3h h LEU 125 Cb 0.60 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 41.18 4a3h h LEU 125 CO 0.04 1.07 0.00 -1.22 0.09 0.00 0.00 178.44 178.42 4a3h n TYR 126 N -4.30 0.06 0.15 1.13 4.01 -0.37 -4.74 117.16 113.10 4a3h n TYR 126 Ca -0.07 -0.24 0.04 0.00 -0.16 0.00 0.00 57.90 57.47 4a3h n TYR 126 Cb 0.53 -0.02 0.18 0.00 -0.31 0.00 0.00 39.34 39.72 4a3h n TYR 126 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4a3h n GLY 127 N -0.02 -0.70 1.41 2.72 0.00 0.11 -1.66 105.19 107.04 4a3h n GLY 127 Ca 0.02 0.02 -0.06 0.00 0.00 0.00 0.00 46.02 46.01 4a3h n GLY 127 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 4a3h n ASP 128 N -1.65 3.21 -4.39 1.61 2.03 -1.26 -4.66 116.55 111.43 4a3h n ASP 128 Ca 0.01 -3.56 -0.31 0.00 0.52 0.00 0.00 54.79 51.45 4a3h n ASP 128 Cb 0.05 -0.67 -0.14 0.00 -0.72 0.00 0.00 41.12 39.64 4a3h n ASP 128 CO 0.00 0.00 0.00 -0.31 -1.92 0.00 0.00 177.20 174.97 4a3h s TYR 129 N -3.16 2.45 -1.14 -0.67 1.51 -0.66 -5.03 117.35 110.64 4a3h s TYR 129 Ca 0.48 -0.33 0.28 0.00 -1.01 0.00 0.00 57.07 56.49 4a3h s TYR 129 Cb 0.41 -1.46 1.13 0.00 -0.11 0.00 0.00 41.96 41.93 4a3h s TYR 129 CO 0.05 0.15 1.84 -0.35 -1.11 0.00 0.00 175.55 176.13 4a3h n PRO 130 N 1.85 0.15 0.17 -1.71 -0.04 -1.26 -3.88 135.00 130.27 4a3h n PRO 130 Ca -0.17 -0.03 0.03 0.00 -0.04 0.00 0.00 63.50 63.29 4a3h n PRO 130 Cb 0.52 -1.50 0.29 0.00 -0.04 0.00 0.00 33.50 32.77 4a3h n PRO 130 CO 0.00 0.00 0.00 -0.91 -0.04 0.00 0.00 175.50 174.55 4a3h h ASN 131 N 0.08 0.00 -3.45 3.54 4.21 -1.89 -3.43 115.58 114.64 4a3h h ASN 131 Ca 0.00 0.00 -0.54 0.00 1.21 0.00 0.00 56.30 56.97 4a3h h ASN 131 Cb 0.45 0.00 -0.03 0.00 -1.12 0.00 0.00 38.32 37.62 4a3h h ASN 131 CO 0.00 0.46 0.26 -0.69 -1.29 0.00 0.00 177.43 176.17 4a3h s VAL 132 N -3.73 4.76 -0.12 2.81 1.01 -1.25 -0.81 120.40 123.08 4a3h s VAL 132 Ca -0.01 1.83 0.02 0.00 0.00 0.00 0.00 61.98 63.82 4a3h s VAL 132 Cb 0.12 -4.21 0.01 0.00 0.00 0.00 0.00 36.38 32.30 4a3h s VAL 132 CO 0.72 0.28 -0.18 -0.63 0.00 0.00 0.00 175.10 175.29 4a3h s ILE 133 N 0.39 1.69 -0.20 2.22 1.01 0.08 -4.22 121.20 122.18 4a3h s ILE 133 Ca 0.44 -0.76 -0.12 0.00 0.00 0.00 0.00 60.65 60.21 4a3h s ILE 133 Cb -0.21 -1.52 -0.05 0.00 0.01 0.00 0.00 42.46 40.69 4a3h s ILE 133 CO 0.25 0.48 0.20 -0.31 0.00 0.00 0.00 174.94 175.57 4a3h s TYR 134 N 0.87 3.39 -0.37 3.97 2.02 -0.42 -1.07 117.35 125.75 4a3h s TYR 134 Ca -0.08 0.39 -0.00 0.00 -0.37 0.00 0.00 57.07 57.01 4a3h s TYR 134 Cb -0.15 -2.27 0.10 0.00 -0.40 0.00 0.00 41.96 39.24 4a3h s TYR 134 CO -0.01 0.19 0.12 -2.00 -1.57 0.00 0.00 175.55 172.29 4a3h s GLU 135 N 0.67 1.87 0.05 -0.62 2.12 0.33 -0.20 118.70 122.92 4a3h s GLU 135 Ca 0.11 -1.77 0.28 0.00 0.36 0.00 0.00 54.97 53.94 4a3h s GLU 135 Cb -0.12 -3.40 1.00 0.00 0.26 0.00 0.00 34.13 31.86 4a3h s GLU 135 CO 0.02 -0.97 1.79 0.44 -0.54 0.00 0.00 175.26 176.00 4a3h n ILE 136 N 4.48 0.14 -3.11 -3.70 -5.35 -0.98 -1.22 119.36 109.61 4a3h n ILE 136 Ca -0.01 -0.07 0.02 0.00 -0.27 0.00 0.00 62.75 62.41 4a3h n ILE 136 Cb 0.42 -0.39 -0.01 0.00 -1.74 0.00 0.00 39.64 37.92 4a3h n ILE 136 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 4a3h s ALA 137 N -3.03 -2.85 0.00 -1.28 0.00 -1.25 -4.71 121.76 108.64 4a3h s ALA 137 Ca 0.12 0.54 0.00 0.00 0.00 0.00 0.00 51.96 52.63 4a3h s ALA 137 Cb 0.17 -2.78 0.00 0.00 0.00 0.00 0.00 23.12 20.51 4a3h s ALA 137 CO 0.58 -2.24 0.66 -1.71 0.00 0.00 0.00 175.76 173.05 4a3h n ASN 138 N 4.38 0.00 -3.38 0.00 5.15 -0.53 -3.18 115.26 117.70 4a3h n ASN 138 Ca 0.09 0.66 -0.27 0.00 -0.60 0.00 0.00 54.58 54.46 4a3h n ASN 138 Cb 0.58 -0.28 -0.10 0.00 -0.53 0.00 0.00 39.78 39.46 4a3h n ASN 138 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 4a3h n GLU 139 N -2.24 0.26 -1.59 1.20 1.02 -1.21 -4.62 120.64 113.46 4a3h n GLU 139 Ca 0.00 -3.20 -0.44 0.00 -0.02 0.00 0.00 57.16 53.50 4a3h n GLU 139 Cb 0.00 -1.64 -0.01 0.00 -0.02 0.00 0.00 31.44 29.76 4a3h n GLU 139 CO 0.00 0.00 0.00 -2.30 1.18 0.00 0.00 177.13 176.01 4a3h n PRO 140 N 2.70 1.32 -3.59 3.49 -0.02 -1.26 -4.49 135.00 133.16 4a3h n PRO 140 Ca 0.29 0.46 -0.11 0.00 -2.02 0.00 0.00 63.50 62.13 4a3h n PRO 140 Cb 0.48 -1.84 -0.03 0.00 -0.02 0.00 0.00 33.50 32.08 4a3h n PRO 140 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 4a3h s ASN 141 N -0.59 -0.37 0.00 2.55 2.20 -0.75 -0.77 114.94 117.22 4a3h s ASN 141 Ca 0.59 -0.25 0.00 0.00 -0.94 0.00 0.00 52.86 52.26 4a3h s ASN 141 Cb -0.69 0.56 0.00 0.00 -2.00 0.00 0.00 41.25 39.12 4a3h s ASN 141 CO 0.60 -0.96 0.00 0.61 -2.94 0.00 0.00 177.10 174.40 4a3h n GLY 142 N -0.32 2.70 0.27 0.45 0.00 -1.26 -4.54 105.19 102.49 4a3h n GLY 142 Ca -0.14 -1.65 0.12 0.00 0.00 0.00 0.00 46.02 44.35 4a3h n GLY 142 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 4a3h h SER 143 N 0.00 0.00 -0.04 1.61 0.02 -2.01 -2.17 113.55 110.96 4a3h h SER 143 Ca 0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 4a3h h SER 143 Cb 0.00 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.54 4a3h h SER 143 CO 0.00 0.06 0.00 -0.90 -1.14 0.00 0.00 176.83 174.85 4a3h n ASP 144 N -3.90 1.06 -4.05 3.07 5.75 -1.26 -4.69 116.55 112.53 4a3h n ASP 144 Ca -0.03 -1.42 -0.32 0.00 -0.01 0.00 0.00 54.79 53.01 4a3h n ASP 144 Cb 0.16 -0.02 -0.15 0.00 -1.03 0.00 0.00 41.12 40.08 4a3h n ASP 144 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 4a3h s VAL 145 N -1.96 2.32 0.26 2.12 1.01 -0.82 -4.95 120.40 118.39 4a3h s VAL 145 Ca 0.38 -2.03 0.11 0.00 0.00 0.00 0.00 61.98 60.44 4a3h s VAL 145 Cb 0.20 -2.57 -0.05 0.00 0.00 0.00 0.00 36.38 33.96 4a3h s VAL 145 CO 0.32 -0.37 -0.13 0.42 0.00 0.00 0.00 175.10 175.33 4a3h s THR 146 N 1.00 2.86 0.11 3.92 -4.23 -1.26 -4.70 115.64 113.34 4a3h s THR 146 Ca 0.03 -2.15 -0.29 0.00 -1.18 0.00 0.00 61.69 58.09 4a3h s THR 146 Cb -0.20 -2.49 -0.09 0.00 1.34 0.00 0.00 72.50 71.06 4a3h s THR 146 CO -0.06 -0.35 1.61 -0.25 -0.54 0.00 0.00 174.62 175.03 4a3h h TRP 147 N 2.26 -0.92 -0.41 3.99 2.91 -1.96 0.19 115.95 122.00 4a3h h TRP 147 Ca -0.42 0.02 -0.11 0.00 1.13 0.00 0.00 58.89 59.50 4a3h h TRP 147 Cb 1.25 0.39 -0.02 0.00 -0.51 0.00 0.00 29.16 30.27 4a3h h TRP 147 CO 0.75 -0.45 -0.19 0.78 -1.03 0.00 0.00 178.44 178.30 4a3h h GLY 148 N -0.59 0.87 0.82 2.65 0.00 -1.96 0.15 103.07 105.02 4a3h h GLY 148 Ca 0.02 -0.72 -0.32 0.00 0.00 0.00 0.00 47.33 46.32 4a3h h GLY 148 CO -0.17 0.66 -1.83 0.70 0.00 0.00 0.00 176.54 175.90 4a3h n ASN 149 N -4.13 1.16 -0.00 0.19 3.02 -1.21 -4.57 115.26 109.72 4a3h n ASN 149 Ca 0.01 0.34 -0.02 0.00 -0.03 0.00 0.00 54.58 54.87 4a3h n ASN 149 Cb 0.42 -0.22 -0.01 0.00 -0.61 0.00 0.00 39.78 39.36 4a3h n ASN 149 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 4a3h n GLN 150 N -3.14 0.04 -0.03 3.52 3.00 -0.08 -4.78 117.38 115.90 4a3h n GLN 150 Ca -0.22 0.02 -0.13 0.00 -0.01 0.00 0.00 57.00 56.66 4a3h n GLN 150 Cb 1.06 -0.57 -0.11 0.00 0.00 0.00 0.00 30.24 30.62 4a3h n GLN 150 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.06 177.88 4a3h h ILE 151 N -0.07 1.52 -0.15 5.09 2.04 -1.08 -2.72 117.51 122.14 4a3h h ILE 151 Ca -0.04 -1.53 0.00 0.00 1.00 0.00 0.00 64.86 64.29 4a3h h ILE 151 Cb 0.86 2.56 -0.01 0.00 -0.74 0.00 0.00 36.82 39.50 4a3h h ILE 151 CO -0.02 0.40 0.08 0.50 0.00 0.00 0.00 178.15 179.11 4a3h h LYS 152 N -0.65 0.17 -0.90 2.37 3.64 -0.93 -0.74 116.57 119.54 4a3h h LYS 152 Ca -0.00 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 4a3h h LYS 152 Cb 0.65 -0.04 -0.04 0.00 -0.41 0.00 0.00 32.23 32.39 4a3h h LYS 152 CO 0.00 0.11 0.58 -1.35 -2.27 0.00 0.00 179.45 176.52 4a3h h PRO 153 N 0.18 1.19 -0.23 1.90 0.11 -1.78 -0.22 132.00 133.16 4a3h h PRO 153 Ca 0.06 -0.08 0.02 0.00 0.11 0.00 0.00 66.00 66.10 4a3h h PRO 153 Cb -0.01 -0.26 -0.02 0.00 0.11 0.00 0.00 31.00 30.82 4a3h h PRO 153 CO -0.02 0.80 0.09 -0.92 -0.21 0.00 0.00 178.00 177.74 4a3h h TYR 154 N 1.23 0.17 -0.75 0.65 3.20 -1.13 -2.30 116.97 118.04 4a3h h TYR 154 Ca 0.33 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.20 4a3h h TYR 154 Cb -0.12 -0.05 -0.04 0.00 1.54 0.00 0.00 36.73 38.07 4a3h h TYR 154 CO 0.00 0.09 0.43 0.00 -1.64 0.00 0.00 178.16 177.04 4a3h h ALA 155 N 1.13 1.34 0.00 1.82 0.00 -0.50 -1.05 119.26 122.00 4a3h h ALA 155 Ca 0.09 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.90 4a3h h ALA 155 Cb 0.04 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.53 4a3h h ALA 155 CO -0.08 0.55 0.00 0.39 0.00 0.00 0.00 179.25 180.11 4a3h n GLU 156 N -4.37 0.08 -0.05 0.00 1.02 -0.15 -0.60 120.64 116.57 4a3h n GLU 156 Ca 0.08 0.26 -0.20 0.00 -0.02 0.00 0.00 57.16 57.28 4a3h n GLU 156 Cb 0.09 -1.63 -0.13 0.00 -0.02 0.00 0.00 31.44 29.74 4a3h n GLU 156 CO 0.00 0.00 0.00 0.39 1.18 0.00 0.00 177.13 178.70 4a3h n GLU 157 N -1.77 0.72 0.11 3.49 1.02 -0.56 -4.51 120.64 119.14 4a3h n GLU 157 Ca 0.04 0.22 -0.18 0.00 -0.02 0.00 0.00 57.16 57.21 4a3h n GLU 157 Cb 0.23 -1.64 -0.14 0.00 -0.02 0.00 0.00 31.44 29.87 4a3h n GLU 157 CO 0.00 0.00 0.00 0.28 1.18 0.00 0.00 177.13 178.59 4a3h h VAL 158 N 0.04 1.44 -0.57 2.62 2.07 -1.04 -3.35 116.25 117.46 4a3h h VAL 158 Ca -0.49 -2.98 0.00 0.00 0.82 0.00 0.00 66.70 64.06 4a3h h VAL 158 Cb 1.98 2.97 -0.03 0.00 -1.52 0.00 0.00 31.29 34.69 4a3h h VAL 158 CO 0.02 0.87 0.37 0.40 0.02 0.00 0.00 177.57 179.26 4a3h h ILE 159 N 0.09 1.15 -1.00 4.57 2.04 -1.10 -2.14 117.51 121.12 4a3h h ILE 159 Ca -0.17 -0.28 0.08 0.00 1.00 0.00 0.00 64.86 65.50 4a3h h ILE 159 Cb 2.02 0.32 -0.07 0.00 -0.74 0.00 0.00 36.82 38.35 4a3h h ILE 159 CO 0.22 0.14 0.64 -0.65 0.00 0.00 0.00 178.15 178.50 4a3h h PRO 160 N 0.77 1.08 -0.13 2.37 0.11 -1.79 -0.21 132.00 134.20 4a3h h PRO 160 Ca 0.21 -0.06 0.02 0.00 0.11 0.00 0.00 66.00 66.28 4a3h h PRO 160 Cb -0.08 -0.24 -0.02 0.00 0.11 0.00 0.00 31.00 30.76 4a3h h PRO 160 CO -0.04 0.71 -0.02 0.82 -0.21 0.00 0.00 178.00 179.26 4a3h h ILE 161 N 1.11 0.89 -0.27 4.15 1.08 -1.53 -1.64 117.51 121.29 4a3h h ILE 161 Ca 0.45 -0.01 -0.00 0.00 -0.39 0.00 0.00 64.86 64.91 4a3h h ILE 161 Cb 0.27 0.87 -0.01 0.00 -3.07 0.00 0.00 36.82 34.88 4a3h h ILE 161 CO -0.20 0.00 0.15 0.40 -0.69 0.00 0.00 178.15 177.81 4a3h h ILE 162 N 0.02 1.12 0.00 -0.67 2.04 -0.98 -3.11 117.51 115.92 4a3h h ILE 162 Ca 0.06 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 65.59 4a3h h ILE 162 Cb 0.09 0.83 -0.00 0.00 -0.74 0.00 0.00 36.82 36.99 4a3h h ILE 162 CO -0.12 0.12 -0.15 0.03 0.00 0.00 0.00 178.15 178.03 4a3h h ARG 163 N 0.33 0.00 0.00 2.37 2.47 -0.88 0.11 114.38 118.79 4a3h h ARG 163 Ca 0.10 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 58.79 4a3h h ARG 163 Cb 0.05 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 28.37 4a3h h ARG 163 CO -0.02 0.15 -0.12 -0.97 0.56 0.00 0.00 179.97 179.57 4a3h h ASN 164 N 0.00 0.00 0.00 7.04 -1.24 -1.23 -3.23 115.58 116.92 4a3h h ASN 164 Ca -0.00 0.00 -0.06 0.00 0.71 0.00 0.00 56.30 56.95 4a3h h ASN 164 Cb 0.42 0.00 -0.01 0.00 0.73 0.00 0.00 38.32 39.46 4a3h h ASN 164 CO 0.02 0.12 -1.58 0.59 -1.29 0.00 0.00 177.43 175.29 4a3h n ASN 165 N -3.38 2.41 -3.35 1.15 3.02 -0.31 -4.93 115.26 109.87 4a3h n ASN 165 Ca -0.01 0.00 -0.15 0.00 -0.03 0.00 0.00 54.58 54.40 4a3h n ASN 165 Cb 0.31 1.30 -0.07 0.00 -0.61 0.00 0.00 39.78 40.70 4a3h n ASN 165 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 4a3h s ASP 166 N -3.59 1.02 0.57 6.41 -1.08 0.25 -4.70 116.67 115.55 4a3h s ASP 166 Ca -0.04 -1.14 0.36 0.00 -0.52 0.00 0.00 52.55 51.21 4a3h s ASP 166 Cb 0.06 0.71 1.65 0.00 -1.46 0.00 0.00 42.92 43.88 4a3h s ASP 166 CO 0.46 -0.30 2.08 1.55 0.52 0.00 0.00 175.17 179.48 4a3h h PRO 167 N 7.54 0.00 0.00 4.34 0.13 -1.80 -3.33 132.00 138.87 4a3h h PRO 167 Ca -0.02 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.11 4a3h h PRO 167 Cb 1.08 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.21 4a3h h PRO 167 CO 0.24 0.00 -0.03 0.27 -0.23 0.00 0.00 178.00 178.25 4a3h n ASN 168 N -3.05 0.00 -4.73 1.44 0.23 -1.26 -4.96 115.26 102.93 4a3h n ASN 168 Ca -0.00 -1.06 -0.33 0.00 -0.53 0.00 0.00 54.58 52.65 4a3h n ASN 168 Cb 0.23 -0.01 0.09 0.00 -2.08 0.00 0.00 39.78 38.01 4a3h n ASN 168 CO 0.00 0.00 0.00 0.20 -0.93 0.00 0.00 177.26 176.53 4a3h s ASN 169 N -0.06 4.28 0.32 0.53 0.01 -1.26 -4.86 114.94 113.90 4a3h s ASN 169 Ca 0.00 2.20 -0.29 0.00 -0.71 0.00 0.00 52.86 54.06 4a3h s ASN 169 Cb 0.00 -2.57 -0.10 0.00 0.41 0.00 0.00 41.25 38.99 4a3h s ASN 169 CO 0.00 -2.19 1.34 -0.63 -1.51 0.00 0.00 177.10 174.11 4a3h s ILE 170 N -2.23 2.66 -0.16 0.60 -1.09 -1.26 -4.91 121.20 114.82 4a3h s ILE 170 Ca 0.70 0.65 0.02 0.00 -2.23 0.00 0.00 60.65 59.79 4a3h s ILE 170 Cb -0.25 -3.41 0.01 0.00 -1.58 0.00 0.00 42.46 37.23 4a3h s ILE 170 CO 0.47 0.14 -0.21 -0.63 -1.23 0.00 0.00 174.94 173.49 4a3h s ILE 171 N -0.92 2.12 -0.23 2.92 1.01 -0.79 -1.30 121.20 124.00 4a3h s ILE 171 Ca 0.51 -0.94 -0.12 0.00 0.00 0.00 0.00 60.65 60.09 4a3h s ILE 171 Cb -0.41 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.15 4a3h s ILE 171 CO 0.52 0.54 0.25 -0.63 0.00 0.00 0.00 174.94 175.62 4a3h s ILE 172 N 1.00 5.30 -0.16 2.92 1.01 0.72 -1.19 121.20 130.79 4a3h s ILE 172 Ca -0.02 0.36 -0.02 0.00 0.00 0.00 0.00 60.65 60.97 4a3h s ILE 172 Cb -0.15 -3.58 -0.01 0.00 0.01 0.00 0.00 42.46 38.73 4a3h s ILE 172 CO -0.06 0.30 -0.10 -0.69 0.00 0.00 0.00 174.94 174.39 4a3h s VAL 173 N 1.27 3.21 0.83 2.92 1.01 0.28 -2.31 120.40 127.60 4a3h s VAL 173 Ca 0.11 -0.59 -0.11 0.00 0.00 0.00 0.00 61.98 61.39 4a3h s VAL 173 Cb -0.14 -2.39 0.09 0.00 0.00 0.00 0.00 36.38 33.94 4a3h s VAL 173 CO 0.06 0.49 1.14 -0.83 0.00 0.00 0.00 175.10 175.97 4a3h s GLY 174 N 0.71 1.83 0.38 4.51 0.00 -1.19 -1.21 107.32 112.35 4a3h s GLY 174 Ca -0.05 0.55 0.07 0.00 0.00 0.00 0.00 44.72 45.29 4a3h s GLY 174 CO 0.02 0.94 0.01 -0.51 0.00 0.00 0.00 173.10 173.56 4a3h s THR 175 N -2.59 1.86 1.01 0.90 -4.23 -1.26 -4.79 115.64 106.54 4a3h s THR 175 Ca 0.66 -2.03 -0.12 0.00 -1.18 0.00 0.00 61.69 59.03 4a3h s THR 175 Cb -0.22 -2.91 0.20 0.00 1.34 0.00 0.00 72.50 70.91 4a3h s THR 175 CO 0.54 -0.03 1.08 -0.83 -0.54 0.00 0.00 174.62 174.84 4a3h s GLY 176 N -3.65 1.61 -1.22 3.99 0.00 -1.26 -1.18 107.32 105.61 4a3h s GLY 176 Ca 0.35 0.09 -0.04 0.00 0.00 0.00 0.00 44.72 45.12 4a3h s GLY 176 CO 0.17 0.66 0.80 2.41 0.00 0.00 0.00 173.10 177.14 4a3h n THR 177 N -4.40 -5.71 -3.40 0.90 -1.04 -1.20 -1.25 114.28 98.16 4a3h n THR 177 Ca 0.07 -0.70 -0.18 0.00 -2.04 0.00 0.00 64.05 61.19 4a3h n THR 177 Cb 0.54 -4.53 0.08 0.00 -1.82 0.00 0.00 70.33 64.60 4a3h n THR 177 CO 0.00 0.00 0.00 0.79 -0.64 0.00 0.00 175.07 175.22 4a3h n TRP 178 N -4.06 -2.25 -3.73 -1.42 8.01 0.05 -2.82 117.44 111.22 4a3h n TRP 178 Ca -0.23 0.91 -0.24 0.00 -1.31 0.00 0.00 57.50 56.63 4a3h n TRP 178 Cb 0.66 -4.90 0.04 0.00 -2.01 0.00 0.00 31.31 25.09 4a3h n TRP 178 CO 0.00 0.00 0.00 0.43 -1.01 0.00 0.00 177.69 177.11 4a3h n SER 179 N -2.96 -2.98 -0.01 -0.99 7.64 -0.32 -4.55 113.62 109.45 4a3h n SER 179 Ca -0.20 -0.76 0.02 0.00 1.01 0.00 0.00 58.87 58.94 4a3h n SER 179 Cb 0.63 -4.22 -0.06 0.00 -1.01 0.00 0.00 64.21 59.56 4a3h n SER 179 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 4a3h n GLN 180 N -4.47 0.88 -2.06 1.43 6.02 -0.46 -0.86 117.38 117.86 4a3h n GLN 180 Ca -0.16 -0.05 -0.41 0.00 -0.01 0.00 0.00 57.00 56.37 4a3h n GLN 180 Cb 0.62 -1.18 -0.00 0.00 1.02 0.00 0.00 30.24 30.70 4a3h n GLN 180 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 4a3h n ASP 181 N -1.88 6.36 0.24 1.08 2.03 -0.38 -4.56 116.55 119.43 4a3h n ASP 181 Ca -0.04 -3.04 0.14 0.00 0.52 0.00 0.00 54.79 52.37 4a3h n ASP 181 Cb 0.33 -1.46 0.43 0.00 -0.72 0.00 0.00 41.12 39.69 4a3h n ASP 181 CO 0.00 0.00 0.00 -0.37 -1.92 0.00 0.00 177.20 174.91 4a3h h VAL 182 N 3.30 0.07 -0.09 5.18 -1.51 -1.87 -3.22 116.25 118.10 4a3h h VAL 182 Ca 0.57 -0.82 -0.00 0.00 -1.23 0.00 0.00 66.70 65.21 4a3h h VAL 182 Cb 0.48 1.77 -0.00 0.00 -2.13 0.00 0.00 31.29 31.41 4a3h h VAL 182 CO 1.62 0.03 0.05 -0.74 -1.23 0.00 0.00 177.57 177.30 4a3h h HIS 183 N 0.00 0.13 -0.55 5.19 -0.00 -1.83 0.11 115.15 118.21 4a3h h HIS 183 Ca -0.00 -0.00 -0.10 0.00 -0.00 0.00 0.00 60.37 60.27 4a3h h HIS 183 Cb 0.77 -0.04 -0.02 0.00 -0.00 0.00 0.00 27.41 28.11 4a3h h HIS 183 CO 0.00 0.16 -0.05 0.45 -0.00 0.00 0.00 177.93 178.49 4a3h h HIS 184 N 0.06 1.08 -0.62 5.26 3.86 -1.96 -2.59 115.15 120.25 4a3h h HIS 184 Ca 0.03 -0.19 -0.09 0.00 -1.16 0.00 0.00 60.37 58.96 4a3h h HIS 184 Cb 0.07 -0.28 -0.02 0.00 1.06 0.00 0.00 27.41 28.24 4a3h h HIS 184 CO -0.05 0.98 0.05 0.00 0.86 0.00 0.00 177.93 179.77 4a3h h ALA 185 N 1.04 0.92 0.00 2.45 0.00 -1.52 -2.84 119.26 119.31 4a3h h ALA 185 Ca 0.15 -0.29 -0.05 0.00 0.00 0.00 0.00 54.91 54.73 4a3h h ALA 185 Cb 0.59 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 4a3h h ALA 185 CO 0.04 0.65 -0.23 0.00 0.00 0.00 0.00 179.25 179.71 4a3h h ALA 186 N 1.07 1.18 -0.00 0.00 0.00 -0.48 -1.44 119.26 119.59 4a3h h ALA 186 Ca 0.18 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.88 4a3h h ALA 186 Cb 0.49 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.24 4a3h h ALA 186 CO 0.02 0.29 -0.14 -0.25 0.00 0.00 0.00 179.25 179.18 4a3h n ASP 187 N -3.62 0.34 -2.98 0.00 8.00 -1.00 -4.29 116.55 113.00 4a3h n ASP 187 Ca -0.01 -0.28 -0.14 0.00 0.71 0.00 0.00 54.79 55.08 4a3h n ASP 187 Cb 0.36 -0.13 0.02 0.00 -0.02 0.00 0.00 41.12 41.36 4a3h n ASP 187 CO 0.00 0.00 0.00 -3.20 -0.39 0.00 0.00 177.20 173.61 4a3h n ASN 188 N -1.17 -0.53 -4.76 -2.24 5.15 -0.57 -5.11 115.26 106.03 4a3h n ASN 188 Ca 0.12 -3.28 -0.35 0.00 -0.60 0.00 0.00 54.58 50.46 4a3h n ASN 188 Cb 0.30 0.48 0.04 0.00 -0.53 0.00 0.00 39.78 40.06 4a3h n ASN 188 CO 0.00 0.00 0.00 -1.10 1.40 0.00 0.00 177.26 177.56 4a3h s GLN 189 N -1.28 2.92 0.57 1.20 -0.21 -1.01 -4.89 119.66 116.97 4a3h s GLN 189 Ca 0.32 1.73 -0.18 0.00 0.02 0.00 0.00 55.36 57.25 4a3h s GLN 189 Cb 0.33 -1.93 -0.04 0.00 1.00 0.00 0.00 33.01 32.36 4a3h s GLN 189 CO -0.06 -1.22 1.10 -0.51 -2.12 0.00 0.00 175.29 172.47 4a3h s LEU 190 N -4.24 3.63 0.20 2.90 1.43 -1.26 -4.99 118.68 116.34 4a3h s LEU 190 Ca 0.75 2.03 -0.01 0.00 -1.03 0.00 0.00 54.13 55.87 4a3h s LEU 190 Cb -0.28 -4.56 0.12 0.00 0.03 0.00 0.00 46.19 41.50 4a3h s LEU 190 CO 0.34 -1.25 1.49 0.00 0.23 0.00 0.00 176.35 177.16 4a3h h ALA 191 N 0.82 0.69 -2.32 4.21 0.00 -2.02 -3.45 119.26 117.19 4a3h h ALA 191 Ca -0.49 -0.55 -0.58 0.00 0.00 0.00 0.00 54.91 53.30 4a3h h ALA 191 Cb 1.24 -0.07 0.06 0.00 0.00 0.00 0.00 17.79 19.02 4a3h h ALA 191 CO 0.57 0.72 0.78 -3.47 0.00 0.00 0.00 179.25 177.84 4a3h n ASP 192 N -3.91 3.11 0.06 0.00 -0.08 -1.26 -4.86 116.55 109.61 4a3h n ASP 192 Ca -0.03 1.09 0.12 0.00 -1.51 0.00 0.00 54.79 54.46 4a3h n ASP 192 Cb 0.64 -1.44 0.46 0.00 2.34 0.00 0.00 41.12 43.12 4a3h n ASP 192 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 4a3h n PRO 193 N 3.18 0.12 -1.81 -0.67 -0.04 -1.26 -3.29 135.00 131.23 4a3h n PRO 193 Ca 0.16 0.22 -0.26 0.00 -0.04 0.00 0.00 63.50 63.58 4a3h n PRO 193 Cb 0.30 -1.68 0.04 0.00 -0.04 0.00 0.00 33.50 32.12 4a3h n PRO 193 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 4a3h n ASN 194 N -1.90 5.47 -4.85 3.54 3.02 -1.26 -4.38 115.26 114.90 4a3h n ASN 194 Ca 0.05 -3.76 -0.33 0.00 -0.03 0.00 0.00 54.58 50.51 4a3h n ASN 194 Cb 0.30 -0.50 -0.06 0.00 -0.61 0.00 0.00 39.78 38.92 4a3h n ASN 194 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 4a3h s VAL 195 N -4.60 5.10 0.13 2.41 1.01 -1.21 -1.89 120.40 121.35 4a3h s VAL 195 Ca 0.54 -0.34 0.07 0.00 0.00 0.00 0.00 61.98 62.25 4a3h s VAL 195 Cb 0.43 -3.39 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 4a3h s VAL 195 CO 0.03 0.28 -0.18 -0.04 0.00 0.00 0.00 175.10 175.19 4a3h s MET 196 N -2.01 1.14 -0.11 2.72 -1.94 -0.33 -4.58 119.30 114.18 4a3h s MET 196 Ca 0.27 -1.27 -0.05 0.00 -1.71 0.00 0.00 55.69 52.94 4a3h s MET 196 Cb -0.12 -1.20 -0.04 0.00 2.01 0.00 0.00 34.83 35.48 4a3h s MET 196 CO 0.19 0.25 0.08 0.71 -0.01 0.00 0.00 175.02 176.24 4a3h s TYR 197 N -1.78 3.40 0.25 -0.03 2.02 -0.03 -0.56 117.35 120.62 4a3h s TYR 197 Ca 0.10 0.36 -0.30 0.00 -0.37 0.00 0.00 57.07 56.87 4a3h s TYR 197 Cb -0.07 -1.89 -0.09 0.00 -0.40 0.00 0.00 41.96 39.51 4a3h s TYR 197 CO 0.05 0.59 0.97 0.00 -1.57 0.00 0.00 175.55 175.58 4a3h s ALA 198 N -0.87 3.35 -0.07 3.71 0.00 -0.35 -1.58 121.76 125.94 4a3h s ALA 198 Ca 0.14 0.66 0.01 0.00 0.00 0.00 0.00 51.96 52.77 4a3h s ALA 198 Cb -0.12 -3.23 0.02 0.00 0.00 0.00 0.00 23.12 19.79 4a3h s ALA 198 CO 0.03 0.15 -0.07 0.12 0.00 0.00 0.00 175.76 175.99 4a3h s PHE 199 N -1.18 1.17 -0.02 0.00 5.36 -0.98 -4.27 117.98 118.05 4a3h s PHE 199 Ca 0.42 -0.46 0.08 0.00 -0.96 0.00 0.00 56.93 56.01 4a3h s PHE 199 Cb -0.27 -0.97 -0.02 0.00 -0.34 0.00 0.00 43.02 41.42 4a3h s PHE 199 CO 0.33 -0.33 -0.26 -1.01 -1.46 0.00 0.00 175.22 172.50 4a3h s HIS 200 N 1.18 2.31 0.08 10.12 3.76 -0.04 -3.70 115.29 129.01 4a3h s HIS 200 Ca -0.06 -0.44 -0.03 0.00 -0.15 0.00 0.00 55.06 54.39 4a3h s HIS 200 Cb -0.14 -1.48 -0.03 0.00 1.11 0.00 0.00 32.58 32.03 4a3h s HIS 200 CO -0.02 -0.03 0.04 -0.59 -0.85 0.00 0.00 174.74 173.29 4a3h s PHE 201 N -0.61 0.53 -0.07 1.40 -0.12 -1.19 -4.68 117.98 113.25 4a3h s PHE 201 Ca 0.10 -1.02 0.02 0.00 -0.05 0.00 0.00 56.93 55.98 4a3h s PHE 201 Cb -0.10 -0.34 0.01 0.00 -0.63 0.00 0.00 43.02 41.96 4a3h s PHE 201 CO -0.01 -0.45 -0.11 0.71 -0.05 0.00 0.00 175.22 175.30 4a3h s TYR 202 N -3.94 1.41 -0.53 3.49 2.02 -1.26 -1.38 117.35 117.14 4a3h s TYR 202 Ca 0.11 -0.53 0.21 0.00 -0.37 0.00 0.00 57.07 56.49 4a3h s TYR 202 Cb 0.07 -1.05 0.92 0.00 -0.40 0.00 0.00 41.96 41.50 4a3h s TYR 202 CO -0.07 -0.29 1.64 0.00 -1.57 0.00 0.00 175.55 175.26 4a3h n ALA 203 N 3.91 1.55 0.35 3.71 0.00 -0.29 -1.68 120.51 128.05 4a3h n ALA 203 Ca -0.22 0.08 0.13 0.00 0.00 0.00 0.00 53.44 53.42 4a3h n ALA 203 Cb 0.51 -1.34 0.55 0.00 0.00 0.00 0.00 19.45 19.17 4a3h n ALA 203 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 4a3h h GLY 204 N 1.88 0.00 -6.17 0.00 0.00 -1.14 -3.42 103.07 94.21 4a3h h GLY 204 Ca 0.00 0.00 -0.61 0.00 0.00 0.00 0.00 47.33 46.72 4a3h h GLY 204 CO 0.00 0.00 -0.52 -1.59 0.00 0.00 0.00 176.54 174.43 4a3h s THR 205 N -3.41 5.19 0.07 4.70 2.01 -0.68 -4.89 115.64 118.62 4a3h s THR 205 Ca 0.03 0.11 -0.30 0.00 0.31 0.00 0.00 61.69 61.83 4a3h s THR 205 Cb 0.09 -3.35 -0.09 0.00 0.01 0.00 0.00 72.50 69.15 4a3h s THR 205 CO 0.39 0.46 1.92 -1.00 -0.69 0.00 0.00 174.62 175.70 4a3h s HIS 206 N 0.28 1.56 -1.19 4.92 3.76 -1.26 -4.89 115.29 118.48 4a3h s HIS 206 Ca 0.07 -0.32 0.16 0.00 -0.15 0.00 0.00 55.06 54.82 4a3h s HIS 206 Cb -0.11 -4.23 0.52 0.00 1.11 0.00 0.00 32.58 29.86 4a3h s HIS 206 CO -0.01 -5.36 1.43 0.41 -0.85 0.00 0.00 174.74 170.36 4a3h n GLY 207 N 4.45 2.82 0.28 -2.22 0.00 -1.26 -4.71 105.19 104.55 4a3h n GLY 207 Ca 0.19 -0.66 -0.08 0.00 0.00 0.00 0.00 46.02 45.47 4a3h n GLY 207 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 4a3h h GLN 208 N 3.09 0.96 -0.15 1.61 4.15 -2.00 -1.27 115.11 121.50 4a3h h GLN 208 Ca 0.00 -0.20 -0.16 0.00 0.77 0.00 0.00 58.65 59.06 4a3h h GLN 208 Cb 1.03 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 28.57 4a3h h GLN 208 CO 0.07 0.84 -0.56 -0.97 -1.93 0.00 0.00 178.83 176.29 4a3h h ASN 209 N 0.89 0.52 -0.57 -0.69 -1.24 -2.00 -2.50 115.58 109.99 4a3h h ASN 209 Ca 0.20 -0.28 -0.05 0.00 0.71 0.00 0.00 56.30 56.88 4a3h h ASN 209 Cb 0.27 -0.15 -0.03 0.00 0.73 0.00 0.00 38.32 39.15 4a3h h ASN 209 CO -0.01 0.97 0.16 -0.07 -1.29 0.00 0.00 177.43 177.19 4a3h h LEU 210 N 0.35 0.88 -0.56 0.34 3.38 -1.78 0.17 115.31 118.09 4a3h h LEU 210 Ca 0.00 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.82 4a3h h LEU 210 Cb 1.09 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.58 4a3h h LEU 210 CO 0.10 0.84 0.36 0.03 0.09 0.00 0.00 178.44 179.86 4a3h h ARG 211 N 0.90 0.75 -0.10 1.13 3.08 -1.18 -1.17 114.38 117.78 4a3h h ARG 211 Ca 0.20 -0.05 -0.05 0.00 0.07 0.00 0.00 59.98 60.15 4a3h h ARG 211 Cb 0.30 -0.16 -0.01 0.00 0.08 0.00 0.00 29.97 30.18 4a3h h ARG 211 CO -0.00 0.51 -0.16 -0.44 -1.07 0.00 0.00 179.97 178.81 4a3h h ASP 212 N 0.76 0.15 -0.38 7.04 3.32 -0.90 -1.04 116.42 125.39 4a3h h ASP 212 Ca 0.20 -0.03 -0.15 0.00 0.02 0.00 0.00 57.03 57.07 4a3h h ASP 212 Cb -0.07 -0.04 -0.01 0.00 0.22 0.00 0.00 39.33 39.44 4a3h h ASP 212 CO -0.04 0.33 -0.37 1.56 -1.72 0.00 0.00 179.24 179.00 4a3h h GLN 213 N 0.16 0.91 -0.50 3.56 1.08 -0.45 -0.68 115.11 119.18 4a3h h GLN 213 Ca 0.03 -0.48 -0.01 0.00 -1.45 0.00 0.00 58.65 56.74 4a3h h GLN 213 Cb 0.37 0.02 -0.02 0.00 -0.05 0.00 0.00 27.48 27.80 4a3h h GLN 213 CO 0.02 1.13 0.26 0.28 -0.95 0.00 0.00 178.83 179.57 4a3h h VAL 214 N 0.72 1.19 -0.66 -0.54 2.07 -0.82 -1.73 116.25 116.47 4a3h h VAL 214 Ca 0.06 -0.50 0.02 0.00 0.82 0.00 0.00 66.70 67.10 4a3h h VAL 214 Cb 0.96 0.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.28 4a3h h VAL 214 CO 0.09 0.20 0.42 0.44 0.02 0.00 0.00 177.57 178.75 4a3h h ASP 215 N 0.67 0.70 -0.41 0.57 3.32 -0.96 -0.18 116.42 120.13 4a3h h ASP 215 Ca 0.18 -0.01 0.06 0.00 0.02 0.00 0.00 57.03 57.28 4a3h h ASP 215 Cb 0.09 -0.16 -0.05 0.00 0.22 0.00 0.00 39.33 39.43 4a3h h ASP 215 CO -0.02 0.50 0.12 0.22 -1.72 0.00 0.00 179.24 178.33 4a3h h TYR 216 N 0.84 0.21 -0.48 4.55 3.20 -0.71 -0.32 116.97 124.25 4a3h h TYR 216 Ca 0.26 0.02 -0.02 0.00 3.14 0.00 0.00 58.73 62.13 4a3h h TYR 216 Cb -0.02 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.19 4a3h h TYR 216 CO -0.04 0.06 0.23 0.00 -1.64 0.00 0.00 178.16 176.77 4a3h h ALA 217 N 1.29 0.62 -0.88 1.82 0.00 -0.78 -2.12 119.26 119.20 4a3h h ALA 217 Ca 0.20 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 55.01 4a3h h ALA 217 Cb 0.21 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.76 4a3h h ALA 217 CO -0.22 0.18 0.58 -0.07 0.00 0.00 0.00 179.25 179.72 4a3h h LEU 218 N 0.63 0.97 -1.26 0.00 3.38 -0.79 -1.30 115.31 116.93 4a3h h LEU 218 Ca 0.16 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.12 4a3h h LEU 218 Cb 0.13 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.65 4a3h h LEU 218 CO -0.02 0.68 0.00 0.44 0.09 0.00 0.00 178.44 179.63 4a3h h ASP 219 N 1.13 0.00 -0.16 -0.43 3.32 -0.39 -0.93 116.42 118.96 4a3h h ASP 219 Ca 0.34 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.39 4a3h h ASP 219 Cb -0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.52 4a3h h ASP 219 CO -0.09 0.00 0.00 0.00 -1.72 0.00 0.00 179.24 177.43 4a3h n GLN 220 N -2.45 1.86 -0.77 3.56 1.13 -0.51 -4.92 117.38 115.27 4a3h n GLN 220 Ca 0.00 -1.28 0.00 0.00 -1.94 0.00 0.00 57.00 53.78 4a3h n GLN 220 Cb 0.17 -1.43 0.00 0.00 0.11 0.00 0.00 30.24 29.08 4a3h n GLN 220 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 4a3h n GLY 221 N 1.21 0.70 3.74 1.08 0.00 -0.35 -5.02 105.19 106.54 4a3h n GLY 221 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 4a3h n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4a3h s ALA 222 N -2.48 3.34 0.02 4.61 0.00 -1.09 -4.10 121.76 122.06 4a3h s ALA 222 Ca 0.00 0.72 -0.19 0.00 0.00 0.00 0.00 51.96 52.49 4a3h s ALA 222 Cb 0.00 -3.29 -0.06 0.00 0.00 0.00 0.00 23.12 19.77 4a3h s ALA 222 CO 0.00 -0.05 0.54 0.00 0.00 0.00 0.00 175.76 176.24 4a3h s ALA 223 N -0.55 3.57 -0.07 0.00 0.00 -1.26 -4.22 121.76 119.24 4a3h s ALA 223 Ca 0.46 -0.04 0.05 0.00 0.00 0.00 0.00 51.96 52.43 4a3h s ALA 223 Cb -0.27 -2.61 -0.00 0.00 0.00 0.00 0.00 23.12 20.23 4a3h s ALA 223 CO 0.34 0.32 -0.22 0.42 0.00 0.00 0.00 175.76 176.62 4a3h s ILE 224 N -0.72 1.86 -0.16 0.00 -1.09 -1.26 -0.85 121.20 118.99 4a3h s ILE 224 Ca 0.28 -0.94 0.01 0.00 -2.23 0.00 0.00 60.65 57.78 4a3h s ILE 224 Cb -0.18 -1.60 0.01 0.00 -1.58 0.00 0.00 42.46 39.11 4a3h s ILE 224 CO 0.17 0.52 -0.19 0.12 -1.23 0.00 0.00 174.94 174.33 4a3h s PHE 225 N 0.11 2.73 -1.25 3.97 2.19 -0.62 -4.50 117.98 120.61 4a3h s PHE 225 Ca -0.10 -1.31 -0.15 0.00 0.33 0.00 0.00 56.93 55.70 4a3h s PHE 225 Cb -0.15 -1.87 0.13 0.00 -1.31 0.00 0.00 43.02 39.83 4a3h s PHE 225 CO 0.05 -0.61 1.58 0.28 1.83 0.00 0.00 175.22 178.35 4a3h n VAL 226 N 4.21 4.13 1.06 3.12 0.31 -0.08 -2.33 118.33 128.76 4a3h n VAL 226 Ca -0.20 -4.45 0.11 0.00 -0.01 0.00 0.00 64.34 59.79 4a3h n VAL 226 Cb 0.51 -2.42 0.57 0.00 -0.91 0.00 0.00 33.84 31.58 4a3h n VAL 226 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 4a3h n SER 227 N 6.52 0.00 -3.65 4.52 3.41 -1.24 -2.02 113.62 121.15 4a3h n SER 227 Ca 0.42 -0.02 -0.07 0.00 -0.26 0.00 0.00 58.87 58.93 4a3h n SER 227 Cb 0.43 -0.29 -0.07 0.00 -0.26 0.00 0.00 64.21 64.02 4a3h n SER 227 CO 0.00 0.00 0.00 -0.70 -0.16 0.00 0.00 175.04 174.18 4a3h s GLU 228 N -2.58 0.64 0.04 4.33 2.12 -1.23 -4.37 118.70 117.65 4a3h s GLU 228 Ca 0.21 1.18 -0.19 0.00 0.36 0.00 0.00 54.97 56.53 4a3h s GLU 228 Cb 0.15 0.19 0.04 0.00 0.26 0.00 0.00 34.13 34.77 4a3h s GLU 228 CO 0.34 -0.16 0.43 1.67 -0.54 0.00 0.00 175.26 177.01 4a3h s TRP 229 N 1.75 -0.30 0.13 5.30 1.48 -0.96 -3.17 118.94 123.17 4a3h s TRP 229 Ca -0.09 0.28 0.03 0.00 -1.06 0.00 0.00 56.10 55.26 4a3h s TRP 229 Cb -0.06 0.24 -0.04 0.00 -1.16 0.00 0.00 33.47 32.45 4a3h s TRP 229 CO -0.19 -0.59 -0.08 0.20 -4.06 0.00 0.00 176.95 172.24 4a3h s GLY 230 N -1.99 0.96 0.00 3.67 0.00 -0.48 -0.61 107.32 108.87 4a3h s GLY 230 Ca -0.05 -1.44 0.28 0.00 0.00 0.00 0.00 44.72 43.51 4a3h s GLY 230 CO -0.02 -1.54 1.81 -1.30 0.00 0.00 0.00 173.10 172.05 4a3h n THR 231 N -0.14 0.00 -2.40 0.90 -2.24 -1.26 -1.14 114.28 107.99 4a3h n THR 231 Ca -0.11 -0.03 0.00 0.00 -2.27 0.00 0.00 64.05 61.64 4a3h n THR 231 Cb 0.61 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.67 4a3h n THR 231 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 4a3h n SER 232 N -1.23 0.00 -4.32 3.42 3.41 -1.26 -0.72 113.62 112.91 4a3h n SER 232 Ca 0.11 -0.89 -0.29 0.00 -0.26 0.00 0.00 58.87 57.53 4a3h n SER 232 Cb 0.30 0.00 0.17 0.00 -0.26 0.00 0.00 64.21 64.43 4a3h n SER 232 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 4a3h s ALA 233 N -2.48 1.82 -0.06 7.33 0.00 -0.45 -0.76 121.76 127.15 4a3h s ALA 233 Ca 0.00 -0.91 0.29 0.00 0.00 0.00 0.00 51.96 51.34 4a3h s ALA 233 Cb 0.00 -2.89 1.40 0.00 0.00 0.00 0.00 23.12 21.64 4a3h s ALA 233 CO 0.00 -2.55 1.87 0.00 0.00 0.00 0.00 175.76 175.08 4a3h h ALA 234 N -1.74 1.00 0.00 0.00 0.00 -1.87 -0.91 119.26 115.74 4a3h h ALA 234 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 4a3h h ALA 234 Cb 1.28 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.07 4a3h h ALA 234 CO 0.47 0.00 0.00 0.25 0.00 0.00 0.00 179.25 179.97 4a3h n THR 235 N -2.55 0.48 -0.20 0.00 -2.24 -1.26 -4.89 114.28 103.62 4a3h n THR 235 Ca -0.00 -0.15 0.00 0.00 -2.27 0.00 0.00 64.05 61.62 4a3h n THR 235 Cb 0.14 -0.62 0.00 0.00 -2.10 0.00 0.00 70.33 67.75 4a3h n THR 235 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4a3h n GLY 236 N 1.21 0.68 0.00 3.38 0.00 -0.35 -5.01 105.19 105.10 4a3h n GLY 236 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 4a3h n GLY 236 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 4a3h n ASP 237 N 0.00 0.18 -1.55 1.61 2.03 -1.25 -1.75 116.55 115.82 4a3h n ASP 237 Ca 0.00 0.00 -0.11 0.00 0.52 0.00 0.00 54.79 55.20 4a3h n ASP 237 Cb 0.00 0.00 0.01 0.00 -0.72 0.00 0.00 41.12 40.41 4a3h n ASP 237 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 4a3h n GLY 238 N 1.63 0.05 0.00 0.27 0.00 -1.26 -1.35 105.19 104.54 4a3h n GLY 238 Ca 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 46.02 45.67 4a3h n GLY 238 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4a3h n GLY 239 N -1.11 2.62 3.46 -0.02 0.00 -1.26 -4.62 105.19 104.26 4a3h n GLY 239 Ca -0.07 -1.85 -0.33 0.00 0.00 0.00 0.00 46.02 43.76 4a3h n GLY 239 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4a3h s VAL 240 N -2.59 3.38 -0.63 1.61 1.01 -1.26 -3.93 120.40 117.99 4a3h s VAL 240 Ca 0.00 -0.57 0.06 0.00 0.00 0.00 0.00 61.98 61.47 4a3h s VAL 240 Cb 0.00 -2.41 0.23 0.00 0.00 0.00 0.00 36.38 34.20 4a3h s VAL 240 CO 0.00 0.55 0.66 0.49 0.00 0.00 0.00 175.10 176.80 4a3h n PHE 241 N 3.02 3.07 0.18 5.22 3.01 0.10 -4.95 117.46 127.11 4a3h n PHE 241 Ca -0.18 -4.11 0.03 0.00 1.01 0.00 0.00 57.45 54.20 4a3h n PHE 241 Cb 0.53 -0.53 0.33 0.00 -0.01 0.00 0.00 39.48 39.80 4a3h n PHE 241 CO 0.00 0.00 0.00 -0.07 1.01 0.00 0.00 176.76 177.70 4a3h h LEU 242 N 4.47 0.00 -0.06 4.37 3.38 -1.94 -1.25 115.31 124.29 4a3h h LEU 242 Ca 0.18 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.14 4a3h h LEU 242 Cb 0.71 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.46 4a3h h LEU 242 CO 0.76 0.42 0.01 0.44 0.09 0.00 0.00 178.44 180.16 4a3h h ASP 243 N 0.00 0.09 0.30 -0.43 3.32 -1.97 -0.82 116.42 116.91 4a3h h ASP 243 Ca -0.00 -0.24 -0.10 0.00 0.02 0.00 0.00 57.03 56.70 4a3h h ASP 243 Cb 0.79 -0.02 -0.01 0.00 0.22 0.00 0.00 39.33 40.30 4a3h h ASP 243 CO 0.05 0.31 -0.42 -0.08 -1.72 0.00 0.00 179.24 177.39 4a3h h GLU 244 N -0.14 0.16 -0.70 3.56 4.57 -1.83 -2.29 114.58 117.90 4a3h h GLU 244 Ca 0.02 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.05 4a3h h GLU 244 Cb 0.26 -0.00 -0.03 0.00 -0.16 0.00 0.00 28.75 28.82 4a3h h GLU 244 CO 0.00 0.55 0.16 0.00 -1.18 0.00 0.00 179.01 178.55 4a3h h ALA 245 N 1.44 0.96 -0.72 2.92 0.00 -1.06 -1.76 119.26 121.03 4a3h h ALA 245 Ca 0.01 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.63 4a3h h ALA 245 Cb 0.80 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.29 4a3h h ALA 245 CO 0.06 0.67 0.31 0.37 0.00 0.00 0.00 179.25 180.66 4a3h h GLN 246 N 1.07 1.07 -0.41 0.00 5.75 -0.76 0.91 115.11 122.73 4a3h h GLN 246 Ca 0.22 -0.18 0.05 0.00 -0.15 0.00 0.00 58.65 58.60 4a3h h GLN 246 Cb 0.38 -0.18 -0.05 0.00 1.07 0.00 0.00 27.48 28.70 4a3h h GLN 246 CO 0.00 0.86 0.13 0.28 -2.65 0.00 0.00 178.83 177.45 4a3h h VAL 247 N 1.03 0.85 -0.61 2.39 2.07 -1.00 -0.46 116.25 120.52 4a3h h VAL 247 Ca 0.24 -0.10 -0.08 0.00 0.82 0.00 0.00 66.70 67.59 4a3h h VAL 247 Cb 0.17 0.55 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 4a3h h VAL 247 CO -0.02 0.05 0.07 -0.50 0.02 0.00 0.00 177.57 177.19 4a3h h TRP 248 N 0.28 1.08 -0.40 1.57 4.06 -0.69 -1.63 115.95 120.22 4a3h h TRP 248 Ca 0.19 -0.15 0.03 0.00 2.06 0.00 0.00 58.89 61.02 4a3h h TRP 248 Cb 0.19 -0.30 -0.03 0.00 -1.00 0.00 0.00 29.16 28.03 4a3h h TRP 248 CO -0.16 0.93 0.20 0.82 -3.56 0.00 0.00 178.44 176.66 4a3h h ILE 249 N 0.95 0.97 -0.66 1.49 1.08 -0.38 0.12 117.51 121.08 4a3h h ILE 249 Ca 0.19 -0.14 -0.07 0.00 -0.39 0.00 0.00 64.86 64.44 4a3h h ILE 249 Cb 0.45 0.54 -0.03 0.00 -3.07 0.00 0.00 36.82 34.71 4a3h h ILE 249 CO 0.02 0.07 0.12 0.44 -0.69 0.00 0.00 178.15 178.11 4a3h h ASP 250 N 0.40 1.02 -0.22 1.72 3.32 -0.96 -1.40 116.42 120.30 4a3h h ASP 250 Ca 0.17 -0.23 0.01 0.00 0.02 0.00 0.00 57.03 57.00 4a3h h ASP 250 Cb 0.08 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.34 4a3h h ASP 250 CO -0.12 1.01 0.11 0.15 -1.72 0.00 0.00 179.24 178.67 4a3h h PHE 251 N 1.01 0.20 -0.65 4.55 3.57 -0.97 -1.21 116.94 123.44 4a3h h PHE 251 Ca 0.20 0.01 -0.05 0.00 3.53 0.00 0.00 57.97 61.66 4a3h h PHE 251 Cb 0.41 -0.06 -0.03 0.00 2.79 0.00 0.00 35.95 39.06 4a3h h PHE 251 CO 0.03 0.12 0.21 0.52 -2.23 0.00 0.00 178.31 176.95 4a3h h MET 252 N 0.23 0.99 -0.46 1.11 2.86 -0.70 -1.49 114.93 117.48 4a3h h MET 252 Ca 0.09 -0.20 -0.04 0.00 -2.06 0.00 0.00 59.70 57.49 4a3h h MET 252 Cb 0.02 -0.15 -0.02 0.00 0.06 0.00 0.00 31.60 31.51 4a3h h MET 252 CO -0.06 0.85 0.12 -0.44 1.06 0.00 0.00 176.91 178.44 4a3h h ASP 253 N 0.96 0.69 0.17 1.22 3.32 -0.95 0.83 116.42 122.66 4a3h h ASP 253 Ca 0.21 -0.22 -0.05 0.00 0.02 0.00 0.00 57.03 56.99 4a3h h ASP 253 Cb 0.27 -0.18 -0.01 0.00 0.22 0.00 0.00 39.33 39.63 4a3h h ASP 253 CO -0.01 0.73 -0.21 -0.33 -1.72 0.00 0.00 179.24 177.71 4a3h h GLU 254 N 0.61 0.08 -0.50 3.56 5.08 -0.78 -2.59 114.58 120.04 4a3h h GLU 254 Ca 0.15 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 4a3h h GLU 254 Cb 0.31 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.55 4a3h h GLU 254 CO -0.00 0.28 0.00 0.54 -1.00 0.00 0.00 179.01 178.83 4a3h n ARG 255 N -4.26 2.59 -3.90 2.33 3.00 -0.60 -4.97 116.66 110.84 4a3h n ARG 255 Ca -0.02 -2.42 -0.25 0.00 -0.01 0.00 0.00 57.85 55.15 4a3h n ARG 255 Cb 0.29 -1.54 -0.01 0.00 0.00 0.00 0.00 32.46 31.20 4a3h n ARG 255 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 4a3h n ASN 256 N 1.57 -0.47 -4.74 0.55 5.15 -0.15 -4.96 115.26 112.20 4a3h n ASN 256 Ca 0.21 -0.97 -0.36 0.00 -0.60 0.00 0.00 54.58 52.86 4a3h n ASN 256 Cb 0.62 -3.24 -0.07 0.00 -0.53 0.00 0.00 39.78 36.56 4a3h n ASN 256 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 4a3h s LEU 257 N -6.91 4.26 0.48 1.20 1.43 0.11 -4.81 118.68 114.44 4a3h s LEU 257 Ca 0.00 0.51 -0.19 0.00 -1.03 0.00 0.00 54.13 53.42 4a3h s LEU 257 Cb -0.00 -2.34 -0.09 0.00 0.03 0.00 0.00 46.19 43.79 4a3h s LEU 257 CO 0.87 0.14 0.98 -0.44 0.23 0.00 0.00 176.35 178.14 4a3h s SER 258 N 0.26 6.66 0.12 2.29 0.01 -1.26 -4.72 113.70 117.06 4a3h s SER 258 Ca 0.16 1.68 -0.18 0.00 1.31 0.00 0.00 55.95 58.92 4a3h s SER 258 Cb -0.13 -2.53 0.04 0.00 0.21 0.00 0.00 66.02 63.61 4a3h s SER 258 CO 0.04 -0.55 0.45 -1.66 0.41 0.00 0.00 173.24 171.93 4a3h s TRP 259 N -2.34 -0.30 -0.06 2.43 1.48 0.21 -0.90 118.94 119.46 4a3h s TRP 259 Ca 0.62 0.06 0.00 0.00 -1.06 0.00 0.00 56.10 55.71 4a3h s TRP 259 Cb -0.11 0.33 0.02 0.00 -1.16 0.00 0.00 33.47 32.55 4a3h s TRP 259 CO 0.22 -0.72 -0.04 0.00 -4.06 0.00 0.00 176.95 172.36 4a3h s ALA 260 N -3.58 0.78 0.19 2.67 0.00 -0.86 -1.40 121.76 119.56 4a3h s ALA 260 Ca 0.01 -0.15 -0.20 0.00 0.00 0.00 0.00 51.96 51.62 4a3h s ALA 260 Cb 0.01 -0.59 -0.08 0.00 0.00 0.00 0.00 23.12 22.46 4a3h s ALA 260 CO -0.11 -0.21 0.70 1.21 0.00 0.00 0.00 175.76 177.36 4a3h s ASN 261 N 1.35 7.10 -0.30 0.00 3.84 -0.21 -2.25 114.94 124.47 4a3h s ASN 261 Ca -0.04 1.42 -0.11 0.00 0.21 0.00 0.00 52.86 54.34 4a3h s ASN 261 Cb -0.13 -2.42 -0.03 0.00 -0.55 0.00 0.00 41.25 38.12 4a3h s ASN 261 CO -0.02 0.10 0.17 0.86 -2.79 0.00 0.00 177.10 175.42 4a3h s TRP 262 N -1.40 3.19 0.26 0.43 -0.11 0.22 -0.47 118.94 121.06 4a3h s TRP 262 Ca 0.40 -0.19 -0.20 0.00 1.22 0.00 0.00 56.10 57.33 4a3h s TRP 262 Cb -0.18 -2.37 0.02 0.00 -1.50 0.00 0.00 33.47 29.44 4a3h s TRP 262 CO 0.22 -0.30 0.67 -1.54 -4.62 0.00 0.00 176.95 171.37 4a3h s SER 263 N 1.70 -0.26 -0.97 5.86 1.04 -1.05 -4.58 113.70 115.44 4a3h s SER 263 Ca 0.06 -0.61 -0.17 0.00 0.48 0.00 0.00 55.95 55.71 4a3h s SER 263 Cb -0.16 0.69 0.15 0.00 0.10 0.00 0.00 66.02 66.80 4a3h s SER 263 CO 0.09 -1.28 1.15 -0.22 0.98 0.00 0.00 173.24 173.96 4a3h s LEU 264 N -2.92 5.18 0.21 2.42 2.96 -0.07 -1.39 118.68 125.08 4a3h s LEU 264 Ca 0.12 -2.27 -0.21 0.00 -0.22 0.00 0.00 54.13 51.55 4a3h s LEU 264 Cb -0.05 -2.38 0.04 0.00 0.50 0.00 0.00 46.19 44.30 4a3h s LEU 264 CO 0.06 -0.97 0.63 0.28 -1.32 0.00 0.00 176.35 175.03 4a3h s THR 265 N 2.28 0.01 -2.28 3.68 -1.32 -1.26 -4.00 115.64 112.74 4a3h s THR 265 Ca 0.33 -0.55 0.23 0.00 -1.21 0.00 0.00 61.69 60.49 4a3h s THR 265 Cb -0.05 -1.51 0.52 0.00 -1.51 0.00 0.00 72.50 69.95 4a3h s THR 265 CO -0.08 -0.02 1.46 0.00 -2.21 0.00 0.00 174.62 173.77 4a3h n HIS 266 N -0.40 0.69 -1.61 9.09 1.44 -1.26 -1.84 115.22 121.32 4a3h n HIS 266 Ca -0.11 -0.35 -0.44 0.00 -2.01 0.00 0.00 57.72 54.82 4a3h n HIS 266 Cb 0.62 0.00 -0.01 0.00 0.12 0.00 0.00 29.99 30.72 4a3h n HIS 266 CO 0.00 0.00 0.00 1.17 -2.81 0.00 0.00 176.34 174.70 4a3h n LYS 267 N 1.54 1.52 -2.09 -1.40 4.81 -1.26 -4.29 118.16 116.99 4a3h n LYS 267 Ca 0.21 0.53 -0.42 0.00 -0.87 0.00 0.00 58.31 57.76 4a3h n LYS 267 Cb 0.61 -1.96 0.00 0.00 0.02 0.00 0.00 35.03 33.70 4a3h n LYS 267 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 4a3h n ASP 268 N 1.07 4.33 -3.83 3.14 2.03 -1.26 -4.64 116.55 117.39 4a3h n ASP 268 Ca 0.08 -2.88 -0.12 0.00 0.52 0.00 0.00 54.79 52.40 4a3h n ASP 268 Cb 0.33 -1.69 -0.10 0.00 -0.72 0.00 0.00 41.12 38.95 4a3h n ASP 268 CO 0.00 0.00 0.00 -1.83 -1.92 0.00 0.00 177.20 173.45 4a3h s GLU 269 N 3.50 0.49 0.40 -0.67 -1.05 -1.26 -5.07 118.70 115.05 4a3h s GLU 269 Ca 0.49 -0.22 0.11 0.00 -0.15 0.00 0.00 54.97 55.20 4a3h s GLU 269 Cb 0.10 0.21 0.91 0.00 -0.44 0.00 0.00 34.13 34.91 4a3h s GLU 269 CO -0.02 -0.12 1.96 0.77 0.95 0.00 0.00 175.26 178.80 4a3h h SER 270 N 4.44 0.50 1.13 0.83 0.02 -1.85 -1.62 113.55 117.00 4a3h h SER 270 Ca -0.30 0.01 0.00 0.00 -0.84 0.00 0.00 61.79 60.66 4a3h h SER 270 Cb 1.19 -0.09 0.00 0.00 0.14 0.00 0.00 62.40 63.63 4a3h h SER 270 CO 0.40 0.30 0.00 -1.54 -1.14 0.00 0.00 176.83 174.85 4a3h n SER 271 N -4.48 0.76 -4.74 3.07 3.41 -0.71 -4.51 113.62 106.42 4a3h n SER 271 Ca 0.11 0.62 -0.42 0.00 -0.26 0.00 0.00 58.87 58.92 4a3h n SER 271 Cb 0.33 -0.81 -0.03 0.00 -0.26 0.00 0.00 64.21 63.45 4a3h n SER 271 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 4a3h s ALA 272 N -3.21 3.65 -0.30 7.33 0.00 -0.61 -2.52 121.76 126.10 4a3h s ALA 272 Ca 0.08 1.31 0.25 0.00 0.00 0.00 0.00 51.96 53.59 4a3h s ALA 272 Cb 0.11 -3.57 0.55 0.00 0.00 0.00 0.00 23.12 20.21 4a3h s ALA 272 CO 0.50 -0.73 1.68 0.00 0.00 0.00 0.00 175.76 177.22 4a3h h ALA 273 N 5.61 0.98 -2.87 0.00 0.00 -1.25 -3.39 119.26 118.34 4a3h h ALA 273 Ca -0.45 -0.03 -0.63 0.00 0.00 0.00 0.00 54.91 53.80 4a3h h ALA 273 Cb 1.21 -0.01 -0.15 0.00 0.00 0.00 0.00 17.79 18.85 4a3h h ALA 273 CO 0.82 0.04 -0.75 -0.51 0.00 0.00 0.00 179.25 178.85 4a3h s LEU 274 N -6.23 2.78 0.36 0.00 1.43 -0.77 -1.39 118.68 114.86 4a3h s LEU 274 Ca 0.05 -0.74 0.02 0.00 -1.03 0.00 0.00 54.13 52.44 4a3h s LEU 274 Cb 0.06 -1.44 -0.02 0.00 0.03 0.00 0.00 46.19 44.82 4a3h s LEU 274 CO 0.65 0.09 0.55 -0.04 0.23 0.00 0.00 176.35 177.83 4a3h s MET 275 N -2.96 3.30 0.43 1.70 -1.94 0.18 -4.24 119.30 115.77 4a3h s MET 275 Ca 0.25 -0.54 0.28 0.00 -1.71 0.00 0.00 55.69 53.98 4a3h s MET 275 Cb -0.08 -2.68 1.39 0.00 2.01 0.00 0.00 34.83 35.46 4a3h s MET 275 CO 0.14 0.05 1.63 -1.35 -0.01 0.00 0.00 175.02 175.48 4a3h h PRO 276 N 0.72 0.11 -0.63 2.03 0.11 -1.88 -1.38 132.00 131.08 4a3h h PRO 276 Ca -0.48 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.62 4a3h h PRO 276 Cb 1.24 -0.02 0.00 0.00 0.11 0.00 0.00 31.00 32.32 4a3h h PRO 276 CO 0.59 0.07 0.00 0.41 -0.21 0.00 0.00 178.00 178.86 4a3h n GLY 277 N -1.50 2.07 3.71 -0.55 0.00 -1.26 -4.95 105.19 102.72 4a3h n GLY 277 Ca 0.36 -0.69 -0.42 0.00 0.00 0.00 0.00 46.02 45.27 4a3h n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4a3h s ALA 278 N -1.46 3.60 0.26 4.61 0.00 -0.52 -4.96 121.76 123.29 4a3h s ALA 278 Ca 0.42 1.12 -0.30 0.00 0.00 0.00 0.00 51.96 53.20 4a3h s ALA 278 Cb 0.24 -3.54 -0.10 0.00 0.00 0.00 0.00 23.12 19.72 4a3h s ALA 278 CO 0.25 -0.64 1.33 1.21 0.00 0.00 0.00 175.76 177.91 4a3h s ASN 279 N 1.15 6.81 0.25 0.00 3.84 -1.26 -4.89 114.94 120.84 4a3h s ASN 279 Ca 0.65 2.56 0.22 0.00 0.21 0.00 0.00 52.86 56.50 4a3h s ASN 279 Cb -0.37 -2.63 0.97 0.00 -0.55 0.00 0.00 41.25 38.68 4a3h s ASN 279 CO 0.30 -0.56 1.67 -0.81 -2.79 0.00 0.00 177.10 174.92 4a3h n PRO 280 N 1.91 0.17 -0.49 0.43 -0.04 -1.26 -1.95 135.00 133.77 4a3h n PRO 280 Ca 0.04 0.45 0.09 0.00 -0.04 0.00 0.00 63.50 64.03 4a3h n PRO 280 Cb 0.42 -1.86 0.30 0.00 -0.04 0.00 0.00 33.50 32.32 4a3h n PRO 280 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 4a3h n THR 281 N -2.18 1.71 -1.48 0.52 -2.24 -1.26 -4.46 114.28 104.89 4a3h n THR 281 Ca 0.02 -1.27 0.00 0.00 -2.27 0.00 0.00 64.05 60.53 4a3h n THR 281 Cb 0.19 0.15 0.00 0.00 -2.10 0.00 0.00 70.33 68.58 4a3h n THR 281 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4a3h n GLY 282 N 0.75 -1.80 1.91 3.38 0.00 -0.82 -3.25 105.19 105.35 4a3h n GLY 282 Ca 0.22 -1.79 0.00 0.00 0.00 0.00 0.00 46.02 44.46 4a3h n GLY 282 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4a3h n GLY 283 N 0.00 0.42 3.74 -0.02 0.00 -1.26 -4.52 105.19 103.55 4a3h n GLY 283 Ca 0.00 -1.00 -0.42 0.00 0.00 0.00 0.00 46.02 44.60 4a3h n GLY 283 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 4a3h s TRP 284 N -2.00 2.79 0.72 1.61 0.51 -1.26 -5.02 118.94 116.29 4a3h s TRP 284 Ca 0.00 0.71 -0.07 0.00 -2.12 0.00 0.00 56.10 54.62 4a3h s TRP 284 Cb 0.00 -4.08 0.07 0.00 -0.81 0.00 0.00 33.47 28.66 4a3h s TRP 284 CO 0.00 -3.70 1.02 0.95 -0.51 0.00 0.00 176.95 174.71 4a3h s THR 285 N 0.22 2.26 0.28 2.01 -4.23 -1.26 -4.94 115.64 109.98 4a3h s THR 285 Ca 0.65 -0.29 -0.01 0.00 -1.18 0.00 0.00 61.69 60.86 4a3h s THR 285 Cb -0.48 -2.97 0.28 0.00 1.34 0.00 0.00 72.50 70.66 4a3h s THR 285 CO 0.45 0.00 1.89 -0.33 -0.54 0.00 0.00 174.62 176.09 4a3h h GLU 286 N -0.63 1.10 0.00 3.99 3.07 -1.95 -1.29 114.58 118.86 4a3h h GLU 286 Ca -0.44 -0.07 0.00 0.00 -0.50 0.00 0.00 59.36 58.36 4a3h h GLU 286 Cb 1.31 -0.25 0.00 0.00 -0.84 0.00 0.00 28.75 28.97 4a3h h GLU 286 CO 0.57 0.73 0.00 0.00 -1.40 0.00 0.00 179.01 178.91 4a3h h ALA 287 N 1.47 1.00 -0.00 3.43 0.00 -2.01 -2.72 119.26 120.43 4a3h h ALA 287 Ca 0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.33 4a3h h ALA 287 Cb 0.19 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.98 4a3h h ALA 287 CO -0.17 0.00 -0.27 0.39 0.00 0.00 0.00 179.25 179.20 4a3h n GLU 288 N -2.97 0.44 -3.70 0.00 1.02 -0.49 -4.81 120.64 110.13 4a3h n GLU 288 Ca 0.00 -0.22 -0.37 0.00 -0.02 0.00 0.00 57.16 56.55 4a3h n GLU 288 Cb 0.26 -1.50 -0.06 0.00 -0.02 0.00 0.00 31.44 30.13 4a3h n GLU 288 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 4a3h s LEU 289 N -2.71 4.42 0.94 -4.62 1.43 -1.03 -0.65 118.68 116.47 4a3h s LEU 289 Ca 0.20 0.70 -0.14 0.00 -1.03 0.00 0.00 54.13 53.85 4a3h s LEU 289 Cb 0.19 -2.37 0.16 0.00 0.03 0.00 0.00 46.19 44.20 4a3h s LEU 289 CO 0.57 0.35 1.21 -0.94 0.23 0.00 0.00 176.35 177.77 4a3h s SER 290 N -1.14 3.28 0.26 2.29 1.04 -0.49 -4.72 113.70 114.22 4a3h s SER 290 Ca 0.20 0.63 -0.03 0.00 0.48 0.00 0.00 55.95 57.23 4a3h s SER 290 Cb -0.14 -0.96 0.37 0.00 0.10 0.00 0.00 66.02 65.39 4a3h s SER 290 CO 0.10 -2.66 1.89 -0.65 0.98 0.00 0.00 173.24 172.89 4a3h h PRO 291 N -1.58 1.18 -0.04 4.02 0.11 -1.88 1.00 132.00 134.80 4a3h h PRO 291 Ca -0.47 -0.07 -0.00 0.00 0.11 0.00 0.00 66.00 65.57 4a3h h PRO 291 Cb 1.29 -0.27 -0.00 0.00 0.11 0.00 0.00 31.00 32.14 4a3h h PRO 291 CO 0.51 0.78 0.01 1.03 -0.21 0.00 0.00 178.00 180.11 4a3h h SER 292 N 1.21 0.06 -0.91 -2.05 0.87 -1.82 -2.68 113.55 108.24 4a3h h SER 292 Ca 0.42 -0.26 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 4a3h h SER 292 Cb 0.09 -0.02 -0.04 0.00 -0.44 0.00 0.00 62.40 61.99 4a3h h SER 292 CO -0.15 0.30 0.54 1.23 -0.53 0.00 0.00 176.83 178.22 4a3h h GLY 293 N -0.18 1.32 0.82 5.77 0.00 -1.40 -0.73 103.07 108.66 4a3h h GLY 293 Ca 0.01 -0.55 0.03 0.00 0.00 0.00 0.00 47.33 46.82 4a3h h GLY 293 CO 0.00 0.54 0.23 -0.84 0.00 0.00 0.00 176.54 176.47 4a3h h THR 294 N 1.25 0.99 -0.18 4.70 2.02 -0.84 0.07 112.91 120.94 4a3h h THR 294 Ca 0.32 -0.16 -0.01 0.00 0.77 0.00 0.00 66.41 67.33 4a3h h THR 294 Cb -0.05 0.49 -0.01 0.00 -1.74 0.00 0.00 68.15 66.84 4a3h h THR 294 CO -0.06 0.08 0.06 0.15 0.37 0.00 0.00 175.52 176.13 4a3h h PHE 295 N 0.46 0.28 -0.64 3.16 3.57 -1.15 -1.88 116.94 120.74 4a3h h PHE 295 Ca 0.18 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.63 4a3h h PHE 295 Cb 0.07 -0.08 -0.03 0.00 2.79 0.00 0.00 35.95 38.70 4a3h h PHE 295 CO -0.09 0.36 0.31 0.28 -2.23 0.00 0.00 178.31 176.93 4a3h h VAL 296 N 0.12 1.22 -0.76 1.41 2.07 -0.94 -0.90 116.25 118.46 4a3h h VAL 296 Ca 0.06 -0.63 0.04 0.00 0.82 0.00 0.00 66.70 66.99 4a3h h VAL 296 Cb 0.21 0.44 -0.05 0.00 -1.52 0.00 0.00 31.29 30.37 4a3h h VAL 296 CO -0.00 0.26 0.48 -0.09 0.02 0.00 0.00 177.57 178.23 4a3h h ARG 297 N 0.89 0.90 -0.58 1.57 2.43 -0.95 -1.50 114.38 117.14 4a3h h ARG 297 Ca 0.22 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.30 4a3h h ARG 297 Cb 0.12 -0.20 -0.03 0.00 -0.42 0.00 0.00 29.97 29.44 4a3h h ARG 297 CO -0.03 0.60 0.22 0.93 -1.51 0.00 0.00 179.97 180.18 4a3h h GLU 298 N 0.93 0.88 -0.83 0.20 5.08 -0.82 -0.41 114.58 119.60 4a3h h GLU 298 Ca 0.31 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 4a3h h GLU 298 Cb 0.04 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 29.11 4a3h h GLU 298 CO -0.12 0.76 0.52 0.87 -1.00 0.00 0.00 179.01 180.04 4a3h h LYS 299 N 0.80 1.11 -0.11 2.33 1.79 -0.45 -0.73 116.57 121.32 4a3h h LYS 299 Ca 0.19 -0.09 -0.20 0.00 -2.18 0.00 0.00 60.65 58.37 4a3h h LYS 299 Cb 0.22 -0.24 0.00 0.00 -1.58 0.00 0.00 32.23 30.64 4a3h h LYS 299 CO -0.01 0.77 -0.75 0.82 -1.08 0.00 0.00 179.45 179.19 4a3h h ILE 300 N 1.13 1.34 -0.46 1.86 2.04 -0.98 -2.66 117.51 119.77 4a3h h ILE 300 Ca 0.30 -2.07 -0.08 0.00 1.00 0.00 0.00 64.86 64.01 4a3h h ILE 300 Cb -0.08 2.06 -0.02 0.00 -0.74 0.00 0.00 36.82 38.04 4a3h h ILE 300 CO -0.06 0.64 -0.04 0.03 0.00 0.00 0.00 178.15 178.72 4a3h h ARG 301 N 0.38 0.79 -0.52 2.37 3.08 -0.89 -2.28 114.38 117.31 4a3h h ARG 301 Ca -0.04 -0.23 -0.05 0.00 0.07 0.00 0.00 59.98 59.73 4a3h h ARG 301 Cb 1.35 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 31.29 4a3h h ARG 301 CO 0.14 0.82 0.11 0.93 -1.07 0.00 0.00 179.97 180.90 4a3h h GLU 302 N 0.73 0.81 0.00 0.04 5.08 -1.10 -3.50 114.58 116.63 4a3h h GLU 302 Ca 0.14 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 4a3h h GLU 302 Cb 0.50 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.63 4a3h h GLU 302 CO 0.03 0.74 0.00 0.45 -1.00 0.00 0.00 179.01 179.22