#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1u3d s SER 14 N 0.00 2.62 -0.23 0.00 0.15 -0.56 -2.04 113.70 113.64 1u3d s SER 14 Ca 0.00 -0.45 -0.09 0.00 0.70 0.00 0.00 55.95 56.11 1u3d s SER 14 Cb 0.00 -0.97 -0.04 0.00 -1.71 0.00 0.00 66.02 63.29 1u3d s SER 14 CO 0.00 0.16 0.12 -0.63 1.20 0.00 0.00 173.24 174.09 1u3d s ILE 15 N 0.20 4.99 -0.38 6.45 1.01 0.74 -1.61 121.20 132.60 1u3d s ILE 15 Ca -0.11 0.05 -0.14 0.00 0.00 0.00 0.00 60.65 60.46 1u3d s ILE 15 Cb -0.15 -3.32 0.01 0.00 0.01 0.00 0.00 42.46 39.01 1u3d s ILE 15 CO 0.05 0.36 0.26 -0.69 0.00 0.00 0.00 174.94 174.93 1u3d s VAL 16 N 1.08 5.13 -0.61 2.92 1.01 -0.84 0.71 120.40 129.79 1u3d s VAL 16 Ca 0.06 -0.56 -0.18 0.00 0.00 0.00 0.00 61.98 61.30 1u3d s VAL 16 Cb -0.14 -3.79 0.12 0.00 0.00 0.00 0.00 36.38 32.58 1u3d s VAL 16 CO 0.04 -0.20 0.68 0.86 0.00 0.00 0.00 175.10 176.47 1u3d s TRP 17 N 1.67 3.13 0.03 5.22 -0.00 -0.06 -0.22 118.94 128.71 1u3d s TRP 17 Ca 0.05 -1.15 -0.30 0.00 -0.00 0.00 0.00 56.10 54.70 1u3d s TRP 17 Cb -0.19 -3.96 -0.04 0.00 -0.00 0.00 0.00 33.47 29.29 1u3d s TRP 17 CO 0.09 -1.21 1.00 -0.06 -0.00 0.00 0.00 176.95 176.77 1u3d s PHE 18 N 2.21 3.67 0.00 5.86 0.08 -0.10 -4.46 117.98 125.24 1u3d s PHE 18 Ca 0.11 1.68 0.00 0.00 0.12 0.00 0.00 56.93 58.84 1u3d s PHE 18 Cb -0.24 -3.14 0.00 0.00 -0.57 0.00 0.00 43.02 39.07 1u3d s PHE 18 CO 0.03 -0.11 0.00 0.54 -0.10 0.00 0.00 175.22 175.59 1u3d n ARG 19 N 3.64 0.00 -2.87 0.44 3.00 -1.26 -4.41 116.66 115.19 1u3d n ARG 19 Ca 0.05 0.00 -0.15 0.00 -0.01 0.00 0.00 57.85 57.74 1u3d n ARG 19 Cb 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 32.46 32.96 1u3d n ARG 19 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1u3d n ARG 20 N -2.40 1.40 -2.73 5.56 1.74 -1.26 -4.81 116.66 114.17 1u3d n ARG 20 Ca 0.00 -3.51 -0.05 0.00 -0.77 0.00 0.00 57.85 53.52 1u3d n ARG 20 Cb 0.00 -1.57 0.06 0.00 -1.02 0.00 0.00 32.46 29.93 1u3d n ARG 20 CO 0.00 0.00 0.00 -0.40 -1.52 0.00 0.00 177.63 175.71 1u3d n ASP 21 N 0.03 0.67 -3.33 0.55 5.75 -1.11 -2.38 116.55 116.73 1u3d n ASP 21 Ca 0.19 -2.39 -0.28 0.00 -0.01 0.00 0.00 54.79 52.30 1u3d n ASP 21 Cb 0.72 -0.15 -0.04 0.00 -1.03 0.00 0.00 41.12 40.61 1u3d n ASP 21 CO 0.00 0.00 0.00 0.18 -0.11 0.00 0.00 177.20 177.27 1u3d n LEU 22 N -0.48 2.95 -3.71 -2.12 4.32 0.34 -4.80 117.00 113.51 1u3d n LEU 22 Ca 0.04 -2.25 -0.10 0.00 -0.02 0.00 0.00 56.01 53.68 1u3d n LEU 22 Cb 0.82 -0.87 -0.04 0.00 -1.62 0.00 0.00 43.42 41.71 1u3d n LEU 22 CO 0.11 -0.53 0.24 0.00 -1.22 0.00 0.00 177.39 175.99 1u3d s ARG 23 N 4.86 1.30 -0.01 3.23 1.70 -1.26 -4.34 118.95 124.43 1u3d s ARG 23 Ca 0.42 -0.82 0.13 0.00 -0.47 0.00 0.00 55.73 54.99 1u3d s ARG 23 Cb 0.10 0.51 -0.16 0.00 -0.57 0.00 0.00 34.95 34.83 1u3d s ARG 23 CO 0.09 -0.54 0.44 1.33 -1.08 0.00 0.00 175.30 175.54 1u3d n VAL 24 N -0.31 0.00 -3.59 4.99 0.24 -1.26 -4.79 118.33 113.60 1u3d n VAL 24 Ca -0.12 -0.24 -0.35 0.00 -2.04 0.00 0.00 64.34 61.60 1u3d n VAL 24 Cb 0.63 0.69 -0.05 0.00 -1.47 0.00 0.00 33.84 33.64 1u3d n VAL 24 CO 0.00 0.00 0.00 -0.70 -2.14 0.00 0.00 176.83 173.99 1u3d s GLU 25 N -2.48 3.75 -1.40 7.34 2.12 -1.26 -3.87 118.70 122.90 1u3d s GLU 25 Ca 0.01 0.16 -0.14 0.00 0.36 0.00 0.00 54.97 55.37 1u3d s GLU 25 Cb 0.09 -3.03 0.02 0.00 0.26 0.00 0.00 34.13 31.47 1u3d s GLU 25 CO 0.53 0.58 0.31 -3.47 -0.54 0.00 0.00 175.26 172.68 1u3d n ASP 26 N 1.01 -1.24 -3.98 -1.70 2.03 -0.29 -4.85 116.55 107.53 1u3d n ASP 26 Ca -0.09 -1.26 -0.31 0.00 0.52 0.00 0.00 54.79 53.65 1u3d n ASP 26 Cb 0.52 -1.79 -0.14 0.00 -0.72 0.00 0.00 41.12 38.99 1u3d n ASP 26 CO 0.00 0.00 0.00 0.21 -1.92 0.00 0.00 177.20 175.49 1u3d s ASN 27 N -4.04 4.53 0.25 1.67 3.84 -1.26 -4.85 114.94 115.08 1u3d s ASN 27 Ca 0.20 -2.68 -0.03 0.00 0.21 0.00 0.00 52.86 50.55 1u3d s ASN 27 Cb -0.11 -1.65 0.45 0.00 -0.55 0.00 0.00 41.25 39.39 1u3d s ASN 27 CO 0.98 -0.30 1.78 -0.65 -2.79 0.00 0.00 177.10 176.12 1u3d h PRO 28 N 6.95 0.64 0.00 0.43 0.11 -1.91 -1.00 132.00 137.23 1u3d h PRO 28 Ca -0.06 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.01 1u3d h PRO 28 Cb 0.94 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.91 1u3d h PRO 28 CO 0.63 0.43 -0.00 0.00 -0.21 0.00 0.00 178.00 178.85 1u3d h ALA 29 N 1.50 -0.00 -0.14 -0.75 0.00 -1.93 0.02 119.26 117.96 1u3d h ALA 29 Ca 0.42 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.29 1u3d h ALA 29 Cb 0.50 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1u3d h ALA 29 CO -0.31 -0.43 -0.04 1.25 0.00 0.00 0.00 179.25 179.72 1u3d h LEU 30 N -0.14 -0.13 -1.46 0.00 5.85 -1.81 -1.14 115.31 116.49 1u3d h LEU 30 Ca -0.00 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.79 1u3d h LEU 30 Cb 0.14 0.09 -0.03 0.00 0.37 0.00 0.00 40.66 41.22 1u3d h LEU 30 CO 0.00 -0.05 0.40 0.00 -0.34 0.00 0.00 178.44 178.45 1u3d h ALA 31 N 1.13 1.68 -0.21 1.25 0.00 -1.02 -0.70 119.26 121.39 1u3d h ALA 31 Ca 0.07 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1u3d h ALA 31 Cb 0.10 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1u3d h ALA 31 CO -0.14 0.25 -0.46 0.00 0.00 0.00 0.00 179.25 178.90 1u3d h ALA 32 N 1.65 0.81 -0.30 0.00 0.00 -0.45 -2.47 119.26 118.51 1u3d h ALA 32 Ca 0.24 -0.46 -0.15 0.00 0.00 0.00 0.00 54.91 54.54 1u3d h ALA 32 Cb 0.09 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.77 1u3d h ALA 32 CO -0.07 0.66 -0.38 0.00 0.00 0.00 0.00 179.25 179.46 1u3d h ALA 33 N 1.07 0.45 -0.23 0.00 0.00 -0.24 -2.66 119.26 117.65 1u3d h ALA 33 Ca 0.03 -0.45 -0.07 0.00 0.00 0.00 0.00 54.91 54.42 1u3d h ALA 33 Cb 0.97 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1u3d h ALA 33 CO 0.09 0.54 -0.16 0.28 0.00 0.00 0.00 179.25 179.99 1u3d h VAL 34 N 0.54 1.23 -0.19 0.00 2.07 -1.12 -1.83 116.25 116.95 1u3d h VAL 34 Ca 0.04 -1.02 -0.03 0.00 0.82 0.00 0.00 66.70 66.51 1u3d h VAL 34 Cb 0.97 1.23 -0.01 0.00 -1.52 0.00 0.00 31.29 31.96 1u3d h VAL 34 CO 0.09 0.32 -0.04 0.03 0.02 0.00 0.00 177.57 177.99 1u3d h ARG 35 N 0.36 0.28 0.00 1.57 3.08 -1.32 -3.26 114.38 115.08 1u3d h ARG 35 Ca 0.07 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.07 1u3d h ARG 35 Cb 0.50 -0.05 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1u3d h ARG 35 CO 0.03 0.34 -0.42 0.00 -1.07 0.00 0.00 179.97 178.85 1u3d n ALA 36 N -2.49 2.90 0.00 0.04 0.00 -0.71 -5.05 120.51 115.20 1u3d n ALA 36 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.22 1u3d n ALA 36 Cb 0.21 -1.24 0.00 0.00 0.00 0.00 0.00 19.45 18.42 1u3d n ALA 36 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u3d n GLY 37 N 1.39 2.52 3.35 0.00 0.00 -1.11 -4.99 105.19 106.35 1u3d n GLY 37 Ca 0.05 -1.82 -0.33 0.00 0.00 0.00 0.00 46.02 43.92 1u3d n GLY 37 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1u3d n PRO 38 N -1.95 -0.83 -4.27 1.61 -0.02 -1.26 -4.45 135.00 123.82 1u3d n PRO 38 Ca 0.00 -0.21 -0.20 0.00 -2.02 0.00 0.00 63.50 61.07 1u3d n PRO 38 Cb 0.00 -1.78 -0.11 0.00 -0.02 0.00 0.00 33.50 31.58 1u3d n PRO 38 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1u3d s VAL 39 N -2.33 1.52 -0.24 -1.45 1.01 0.68 -1.49 120.40 118.10 1u3d s VAL 39 Ca 0.56 -1.76 -0.00 0.00 0.00 0.00 0.00 61.98 60.78 1u3d s VAL 39 Cb -0.17 -1.63 0.07 0.00 0.00 0.00 0.00 36.38 34.65 1u3d s VAL 39 CO 0.67 -0.35 0.01 -0.63 0.00 0.00 0.00 175.10 174.81 1u3d s ILE 40 N -2.00 1.13 -0.22 2.22 1.01 -0.63 -2.21 121.20 120.48 1u3d s ILE 40 Ca 0.11 -1.12 -0.29 0.00 0.00 0.00 0.00 60.65 59.34 1u3d s ILE 40 Cb -0.06 -1.59 -0.00 0.00 0.01 0.00 0.00 42.46 40.82 1u3d s ILE 40 CO 0.04 -0.29 1.23 0.00 0.00 0.00 0.00 174.94 175.93 1u3d s ALA 41 N 1.55 3.57 -0.00 9.38 0.00 -1.26 -1.99 121.76 133.02 1u3d s ALA 41 Ca -0.00 0.29 0.08 0.00 0.00 0.00 0.00 51.96 52.33 1u3d s ALA 41 Cb -0.18 -3.66 -0.02 0.00 0.00 0.00 0.00 23.12 19.26 1u3d s ALA 41 CO -0.11 -1.34 -0.25 -1.17 0.00 0.00 0.00 175.76 172.89 1u3d s LEU 42 N 3.71 2.15 -0.03 0.00 2.96 0.69 -0.57 118.68 127.59 1u3d s LEU 42 Ca 0.53 -0.49 0.01 0.00 -0.22 0.00 0.00 54.13 53.97 1u3d s LEU 42 Cb -0.19 -1.35 0.01 0.00 0.50 0.00 0.00 46.19 45.17 1u3d s LEU 42 CO 0.16 0.30 -0.05 0.12 -1.32 0.00 0.00 176.35 175.56 1u3d s PHE 43 N -0.68 0.67 -0.18 5.38 5.36 -0.00 -0.93 117.98 127.60 1u3d s PHE 43 Ca 0.11 -0.16 0.01 0.00 -0.96 0.00 0.00 56.93 55.93 1u3d s PHE 43 Cb -0.10 -0.56 0.02 0.00 -0.34 0.00 0.00 43.02 42.04 1u3d s PHE 43 CO 0.00 -0.13 -0.18 0.08 -1.46 0.00 0.00 175.22 173.53 1u3d s VAL 44 N 0.58 2.00 -0.39 3.12 1.01 -1.26 -1.33 120.40 124.12 1u3d s VAL 44 Ca -0.08 -0.96 -0.17 0.00 0.00 0.00 0.00 61.98 60.78 1u3d s VAL 44 Cb -0.11 -1.84 0.01 0.00 0.00 0.00 0.00 36.38 34.44 1u3d s VAL 44 CO 0.00 0.48 0.43 0.86 0.00 0.00 0.00 175.10 176.87 1u3d s TRP 45 N 1.30 3.18 -0.44 5.22 -0.11 0.51 -4.96 118.94 123.64 1u3d s TRP 45 Ca 0.04 -0.22 0.08 0.00 1.22 0.00 0.00 56.10 57.23 1u3d s TRP 45 Cb -0.14 -2.85 0.28 0.00 -1.50 0.00 0.00 33.47 29.26 1u3d s TRP 45 CO -0.12 -0.62 0.64 0.00 -4.62 0.00 0.00 176.95 172.23 1u3d n ALA 46 N 5.58 2.75 -0.18 5.86 0.00 -1.26 -2.20 120.51 131.06 1u3d n ALA 46 Ca -0.07 -3.71 -0.06 0.00 0.00 0.00 0.00 53.44 49.59 1u3d n ALA 46 Cb 0.48 -0.85 0.03 0.00 0.00 0.00 0.00 19.45 19.12 1u3d n ALA 46 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1u3d h PRO 47 N 3.72 0.67 -0.01 0.00 0.13 -1.93 -2.88 132.00 131.69 1u3d h PRO 47 Ca 0.10 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1u3d h PRO 47 Cb 0.84 -0.15 -0.00 0.00 0.13 0.00 0.00 31.00 31.82 1u3d h PRO 47 CO 0.56 0.44 0.41 1.05 -0.23 0.00 0.00 178.00 180.23 1u3d h GLU 48 N 0.69 0.00 0.00 0.86 9.09 -1.91 1.93 114.58 125.23 1u3d h GLU 48 Ca 0.20 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.61 1u3d h GLU 48 Cb -0.04 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.06 1u3d h GLU 48 CO -0.06 0.00 0.00 -1.91 0.05 0.00 0.00 179.01 177.09 1u3d n GLU 49 N -2.86 0.10 -0.22 1.06 2.13 -1.09 -2.77 120.64 116.99 1u3d n GLU 49 Ca -0.01 0.24 0.10 0.00 0.66 0.00 0.00 57.16 58.14 1u3d n GLU 49 Cb 0.46 -1.66 0.26 0.00 0.27 0.00 0.00 31.44 30.77 1u3d n GLU 49 CO 0.00 0.00 0.00 0.39 -0.41 0.00 0.00 177.13 177.11 1u3d n GLU 50 N -1.84 2.21 0.00 5.31 -0.58 0.65 -5.03 120.64 121.36 1u3d n GLU 50 Ca 0.04 -1.86 0.00 0.00 -0.42 0.00 0.00 57.16 54.92 1u3d n GLU 50 Cb 0.27 -1.44 0.00 0.00 -0.57 0.00 0.00 31.44 29.70 1u3d n GLU 50 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1u3d n GLY 51 N 1.35 3.91 0.04 0.62 0.00 -1.12 -1.49 105.19 108.50 1u3d n GLY 51 Ca 0.18 0.10 0.12 0.00 0.00 0.00 0.00 46.02 46.43 1u3d n GLY 51 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89 1u3d n HIS 52 N 12.55 0.35 -2.30 1.61 -0.00 -1.26 -4.28 115.22 121.90 1u3d n HIS 52 Ca 0.00 0.10 -0.32 0.00 -0.00 0.00 0.00 57.72 57.50 1u3d n HIS 52 Cb 0.00 -0.54 0.01 0.00 -0.00 0.00 0.00 29.99 29.47 1u3d n HIS 52 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1u3d n TYR 53 N -1.87 3.26 -2.41 1.57 4.01 -0.56 -5.03 117.16 116.15 1u3d n TYR 53 Ca 0.05 -2.84 -0.39 0.00 -0.16 0.00 0.00 57.90 54.55 1u3d n TYR 53 Cb 0.40 -0.57 -0.03 0.00 -0.31 0.00 0.00 39.34 38.82 1u3d n TYR 53 CO 0.00 0.00 0.00 -3.38 -0.46 0.00 0.00 176.86 173.02 1u3d s HIS 54 N -3.77 3.34 0.30 -0.72 -3.43 -1.25 -4.88 115.29 104.88 1u3d s HIS 54 Ca 0.49 1.63 -0.29 0.00 -0.80 0.00 0.00 55.06 56.09 1u3d s HIS 54 Cb 0.40 -3.32 -0.13 0.00 -1.43 0.00 0.00 32.58 28.10 1u3d s HIS 54 CO -0.27 -0.88 1.20 -2.30 -2.00 0.00 0.00 174.74 170.49 1u3d n PRO 55 N 0.62 1.81 -1.83 -0.38 -0.02 -1.26 -4.95 135.00 128.99 1u3d n PRO 55 Ca 0.02 0.64 -0.29 0.00 -2.02 0.00 0.00 63.50 61.84 1u3d n PRO 55 Cb 0.46 -2.15 0.13 0.00 -0.02 0.00 0.00 33.50 31.92 1u3d n PRO 55 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1u3d s GLY 56 N -0.31 1.65 0.17 -1.23 0.00 -1.26 -4.76 107.32 101.58 1u3d s GLY 56 Ca 0.59 -0.82 -0.21 0.00 0.00 0.00 0.00 44.72 44.28 1u3d s GLY 56 CO 0.59 -0.21 1.62 -0.09 0.00 0.00 0.00 173.10 175.01 1u3d h ARG 57 N -1.37 -0.19 -0.01 2.90 2.43 -1.94 -0.11 114.38 116.10 1u3d h ARG 57 Ca -0.46 0.01 -0.13 0.00 -0.81 0.00 0.00 59.98 58.59 1u3d h ARG 57 Cb 1.30 0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 30.87 1u3d h ARG 57 CO 0.55 -0.12 -0.59 -0.39 -1.51 0.00 0.00 179.97 177.91 1u3d h VAL 58 N -0.19 1.42 -0.25 0.20 -1.51 -1.88 -1.52 116.25 112.52 1u3d h VAL 58 Ca 0.18 -2.02 -0.02 0.00 -1.23 0.00 0.00 66.70 63.61 1u3d h VAL 58 Cb 0.48 2.08 -0.01 0.00 -2.13 0.00 0.00 31.29 31.71 1u3d h VAL 58 CO -0.50 0.58 0.07 -1.28 -1.23 0.00 0.00 177.57 175.21 1u3d h SER 59 N 0.02 0.37 -0.45 4.19 0.87 -1.67 -1.78 113.55 115.12 1u3d h SER 59 Ca -0.01 -0.22 -0.02 0.00 -1.23 0.00 0.00 61.79 60.31 1u3d h SER 59 Cb 1.05 -0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 62.89 1u3d h SER 59 CO 0.08 0.50 0.23 0.03 -0.53 0.00 0.00 176.83 177.13 1u3d h ARG 60 N 0.23 0.68 -0.48 2.24 3.08 -0.74 0.69 114.38 120.07 1u3d h ARG 60 Ca 0.08 -0.08 -0.10 0.00 0.07 0.00 0.00 59.98 59.95 1u3d h ARG 60 Cb 0.27 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.17 1u3d h ARG 60 CO -0.00 0.53 -0.11 2.35 -1.07 0.00 0.00 179.97 181.68 1u3d h TRP 61 N 0.68 0.96 -0.26 3.04 7.01 -1.01 -0.74 115.95 125.62 1u3d h TRP 61 Ca 0.17 -0.18 -0.04 0.00 2.11 0.00 0.00 58.89 60.94 1u3d h TRP 61 Cb 0.08 -0.24 -0.01 0.00 -2.10 0.00 0.00 29.16 26.89 1u3d h TRP 61 CO 0.01 0.92 -0.00 2.35 -2.79 0.00 0.00 178.44 178.92 1u3d h TRP 62 N 0.78 0.51 -0.37 2.65 2.91 -0.30 -2.86 115.95 119.28 1u3d h TRP 62 Ca 0.13 -0.09 0.03 0.00 1.13 0.00 0.00 58.89 60.09 1u3d h TRP 62 Cb 0.62 -0.13 -0.03 0.00 -0.51 0.00 0.00 29.16 29.10 1u3d h TRP 62 CO 0.04 0.63 0.17 1.25 -1.03 0.00 0.00 178.44 179.50 1u3d h LEU 63 N 0.25 0.24 -0.49 0.65 5.85 -0.66 0.22 115.31 121.37 1u3d h LEU 63 Ca 0.07 0.02 0.08 0.00 0.84 0.00 0.00 57.88 58.90 1u3d h LEU 63 Cb 0.43 -0.02 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 1u3d h LEU 63 CO 0.01 0.18 0.12 0.50 -0.34 0.00 0.00 178.44 178.91 1u3d h LYS 64 N 0.35 0.25 0.02 1.25 3.64 -1.11 0.96 116.57 121.93 1u3d h LYS 64 Ca 0.16 -0.02 -0.21 0.00 -1.27 0.00 0.00 60.65 59.32 1u3d h LYS 64 Cb 0.08 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.83 1u3d h LYS 64 CO -0.12 0.17 -0.96 -0.91 -2.27 0.00 0.00 179.45 175.35 1u3d h ASN 65 N 0.26 0.10 -0.47 4.20 2.35 -1.21 -2.87 115.58 117.94 1u3d h ASN 65 Ca 0.24 -0.10 -0.06 0.00 -0.55 0.00 0.00 56.30 55.83 1u3d h ASN 65 Cb 0.30 -0.03 -0.02 0.00 0.05 0.00 0.00 38.32 38.62 1u3d h ASN 65 CO -0.30 1.00 0.05 -1.28 -1.65 0.00 0.00 177.43 175.26 1u3d h SER 66 N 0.03 0.77 -0.24 5.81 0.87 -0.11 -2.69 113.55 117.99 1u3d h SER 66 Ca -0.03 -0.28 -0.05 0.00 -1.23 0.00 0.00 61.79 60.20 1u3d h SER 66 Cb 1.67 -0.20 -0.02 0.00 -0.44 0.00 0.00 62.40 63.41 1u3d h SER 66 CO 0.13 0.85 -0.00 -0.07 -0.53 0.00 0.00 176.83 177.22 1u3d h LEU 67 N 0.66 0.51 -0.30 2.23 3.38 -0.84 -0.40 115.31 120.55 1u3d h LEU 67 Ca 0.14 -0.10 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1u3d h LEU 67 Cb 0.43 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 41.03 1u3d h LEU 67 CO 0.01 0.58 0.06 0.00 0.09 0.00 0.00 178.44 179.19 1u3d h ALA 68 N 1.48 0.40 -0.58 1.53 0.00 -1.32 0.45 119.26 121.23 1u3d h ALA 68 Ca 0.11 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.77 1u3d h ALA 68 Cb 0.34 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1u3d h ALA 68 CO 0.01 0.08 0.11 0.37 0.00 0.00 0.00 179.25 179.82 1u3d h GLN 69 N 0.33 0.92 0.00 0.00 4.15 -1.15 0.34 115.11 119.69 1u3d h GLN 69 Ca 0.09 -0.21 -0.00 0.00 0.77 0.00 0.00 58.65 59.30 1u3d h GLN 69 Cb 0.32 -0.12 0.00 0.00 0.21 0.00 0.00 27.48 27.89 1u3d h GLN 69 CO 0.00 0.84 -0.00 1.25 -1.93 0.00 0.00 178.83 179.00 1u3d h LEU 70 N 0.87 -0.00 -0.44 -2.39 5.85 -0.64 -0.23 115.31 118.33 1u3d h LEU 70 Ca 0.18 -0.07 0.02 0.00 0.84 0.00 0.00 57.88 58.85 1u3d h LEU 70 Cb 0.36 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.36 1u3d h LEU 70 CO 0.01 0.07 0.26 -0.78 -0.34 0.00 0.00 178.44 177.66 1u3d h ASP 71 N -0.07 0.43 -0.82 1.25 3.58 -0.68 -0.44 116.42 119.67 1u3d h ASP 71 Ca -0.00 0.00 0.07 0.00 0.42 0.00 0.00 57.03 57.52 1u3d h ASP 71 Cb 0.07 -0.09 -0.06 0.00 1.72 0.00 0.00 39.33 40.97 1u3d h ASP 71 CO 0.00 0.31 0.49 -1.28 -2.88 0.00 0.00 179.24 175.88 1u3d h SER 72 N 0.53 0.76 0.42 2.28 0.87 -0.69 0.86 113.55 118.57 1u3d h SER 72 Ca 0.18 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.74 1u3d h SER 72 Cb 0.01 -0.13 0.00 0.00 -0.44 0.00 0.00 62.40 61.84 1u3d h SER 72 CO -0.08 0.48 -0.20 0.28 -0.53 0.00 0.00 176.83 176.78 1u3d h SER 73 N 0.89 -0.47 -0.84 6.23 0.02 -0.34 -2.28 113.55 116.75 1u3d h SER 73 Ca 0.36 -0.06 0.13 0.00 -0.84 0.00 0.00 61.79 61.38 1u3d h SER 73 Cb 0.20 0.12 -0.09 0.00 0.14 0.00 0.00 62.40 62.78 1u3d h SER 73 CO -0.19 -0.22 0.45 -0.07 -1.14 0.00 0.00 176.83 175.66 1u3d h LEU 74 N -0.72 0.58 -0.65 5.07 3.38 -0.79 -0.52 115.31 121.68 1u3d h LEU 74 Ca -0.06 0.07 0.02 0.00 0.09 0.00 0.00 57.88 58.01 1u3d h LEU 74 Cb 0.51 -0.03 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 1u3d h LEU 74 CO 0.09 0.28 0.41 0.03 0.09 0.00 0.00 178.44 179.35 1u3d h ARG 75 N 0.69 0.79 -0.54 1.13 3.08 0.41 -0.37 114.38 119.58 1u3d h ARG 75 Ca 0.44 -0.05 0.14 0.00 0.07 0.00 0.00 59.98 60.58 1u3d h ARG 75 Cb 0.54 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 30.39 1u3d h ARG 75 CO -0.32 0.52 0.38 0.77 -1.07 0.00 0.00 179.97 180.26 1u3d h SER 76 N 0.82 0.07 0.00 7.04 0.02 -0.52 -0.03 113.55 120.95 1u3d h SER 76 Ca 0.25 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.21 1u3d h SER 76 Cb -0.02 -0.01 0.00 0.00 0.14 0.00 0.00 62.40 62.51 1u3d h SER 76 CO -0.09 0.04 -0.04 0.18 -1.14 0.00 0.00 176.83 175.79 1u3d n LEU 77 N -4.40 1.83 0.00 5.07 4.77 -0.24 -4.98 117.00 119.04 1u3d n LEU 77 Ca 0.10 -0.61 0.00 0.00 -0.03 0.00 0.00 56.01 55.47 1u3d n LEU 77 Cb 0.56 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.64 1u3d n LEU 77 CO 0.36 0.31 0.00 0.61 -1.33 0.00 0.00 177.39 177.34 1u3d n GLY 78 N 1.24 2.35 3.44 -0.72 0.00 -0.02 -0.28 105.19 111.20 1u3d n GLY 78 Ca 0.17 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.97 1u3d n GLY 78 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1u3d s THR 79 N -2.14 1.45 0.41 2.61 -1.32 -0.90 -4.38 115.64 111.37 1u3d s THR 79 Ca 0.00 -2.06 0.08 0.00 -1.21 0.00 0.00 61.69 58.50 1u3d s THR 79 Cb 0.00 -2.62 -0.02 0.00 -1.51 0.00 0.00 72.50 68.35 1u3d s THR 79 CO 0.00 -0.17 0.35 0.00 -2.21 0.00 0.00 174.62 172.60 1u3d s LEU 81 N -4.10 3.96 -0.23 0.00 2.96 -1.26 -4.10 118.68 115.91 1u3d s LEU 81 Ca 0.47 0.12 -0.09 0.00 -0.22 0.00 0.00 54.13 54.41 1u3d s LEU 81 Cb -0.03 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.60 1u3d s LEU 81 CO 0.27 0.16 0.13 -0.63 -1.32 0.00 0.00 176.35 174.96 1u3d s ILE 82 N 0.48 5.14 -0.03 6.68 1.01 0.27 -4.96 121.20 129.79 1u3d s ILE 82 Ca 0.05 0.10 0.03 0.00 0.00 0.00 0.00 60.65 60.83 1u3d s ILE 82 Cb -0.12 -3.38 -0.03 0.00 0.01 0.00 0.00 42.46 38.94 1u3d s ILE 82 CO 0.00 0.38 -0.11 0.42 0.00 0.00 0.00 174.94 175.63 1u3d s THR 83 N 0.92 3.36 -0.03 2.92 -4.23 -1.26 -0.82 115.64 116.50 1u3d s THR 83 Ca 0.06 -0.73 0.02 0.00 -1.18 0.00 0.00 61.69 59.86 1u3d s THR 83 Cb -0.13 -2.39 0.01 0.00 1.34 0.00 0.00 72.50 71.33 1u3d s THR 83 CO 0.03 0.51 -0.07 -0.54 -0.54 0.00 0.00 174.62 174.01 1u3d s LYS 84 N -1.03 0.85 -0.19 3.99 -0.14 -0.44 -1.54 119.74 121.24 1u3d s LYS 84 Ca 0.14 -0.22 -0.07 0.00 -1.36 0.00 0.00 55.97 54.45 1u3d s LYS 84 Cb -0.11 -0.81 -0.04 0.00 -1.68 0.00 0.00 37.83 35.19 1u3d s LYS 84 CO 0.03 0.05 0.07 0.50 -0.76 0.00 0.00 175.35 175.23 1u3d s ARG 85 N 0.40 3.95 0.24 1.68 6.06 -1.26 -0.36 118.95 129.65 1u3d s ARG 85 Ca -0.06 -0.35 -0.22 0.00 -2.50 0.00 0.00 55.73 52.60 1u3d s ARG 85 Cb -0.10 -3.24 0.05 0.00 0.06 0.00 0.00 34.95 31.73 1u3d s ARG 85 CO 0.00 0.22 0.87 -1.54 -2.50 0.00 0.00 175.30 172.36 1u3d s SER 86 N 0.51 -0.14 0.00 -2.12 1.04 -0.93 -4.97 113.70 107.09 1u3d s SER 86 Ca 0.03 -0.65 0.19 0.00 0.48 0.00 0.00 55.95 56.01 1u3d s SER 86 Cb -0.13 0.63 -0.12 0.00 0.10 0.00 0.00 66.02 66.50 1u3d s SER 86 CO 0.01 -1.19 0.87 0.41 0.98 0.00 0.00 173.24 174.32 1u3d n THR 87 N -0.52 0.00 -3.49 2.02 -1.04 -1.26 -3.99 114.28 106.00 1u3d n THR 87 Ca -0.05 -0.16 -0.21 0.00 -2.04 0.00 0.00 64.05 61.58 1u3d n THR 87 Cb 0.60 1.10 -0.13 0.00 -1.82 0.00 0.00 70.33 70.08 1u3d n THR 87 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1u3d s ASP 88 N -2.52 1.99 0.26 8.00 2.15 -1.26 -4.60 116.67 120.69 1u3d s ASP 88 Ca 0.11 -0.61 -0.05 0.00 0.43 0.00 0.00 52.55 52.43 1u3d s ASP 88 Cb 0.15 0.20 0.32 0.00 -0.30 0.00 0.00 42.92 43.29 1u3d s ASP 88 CO 0.65 -0.37 1.93 0.77 -0.17 0.00 0.00 175.17 177.98 1u3d h SER 89 N 8.33 1.10 0.09 -0.34 4.64 -1.93 -1.77 113.55 123.68 1u3d h SER 89 Ca -0.16 -0.02 0.01 0.00 -0.47 0.00 0.00 61.79 61.14 1u3d h SER 89 Cb 1.10 -0.26 -0.02 0.00 -0.31 0.00 0.00 62.40 62.91 1u3d h SER 89 CO 0.33 0.78 -0.13 0.58 -0.87 0.00 0.00 176.83 177.51 1u3d h VAL 90 N 1.29 0.70 -0.38 0.95 2.07 -1.96 -0.58 116.25 118.34 1u3d h VAL 90 Ca 0.37 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.98 1u3d h VAL 90 Cb -0.08 0.70 -0.08 0.00 -1.52 0.00 0.00 31.29 30.31 1u3d h VAL 90 CO -0.10 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 177.32 1u3d h ALA 91 N 0.61 0.13 -0.91 1.67 0.00 -1.91 -0.01 119.26 118.84 1u3d h ALA 91 Ca 0.02 0.14 0.14 0.00 0.00 0.00 0.00 54.91 55.20 1u3d h ALA 91 Cb 0.28 0.42 -0.07 0.00 0.00 0.00 0.00 17.79 18.41 1u3d h ALA 91 CO -0.06 -0.53 0.58 0.77 0.00 0.00 0.00 179.25 180.01 1u3d h SER 92 N -0.10 0.71 0.25 0.00 0.02 -0.81 0.41 113.55 114.04 1u3d h SER 92 Ca 0.19 0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1u3d h SER 92 Cb 0.39 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1u3d h SER 92 CO -0.45 0.37 -0.13 -0.07 -1.14 0.00 0.00 176.83 175.41 1u3d h LEU 93 N 0.76 -0.31 -0.26 5.07 3.38 0.58 -0.80 115.31 123.73 1u3d h LEU 93 Ca 0.45 0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.49 1u3d h LEU 93 Cb 0.65 0.08 -0.06 0.00 0.09 0.00 0.00 40.66 41.43 1u3d h LEU 93 CO -0.21 -0.22 -0.11 -0.07 0.09 0.00 0.00 178.44 177.92 1u3d h LEU 94 N -0.35 -0.38 -2.08 1.67 4.07 -0.36 0.36 115.31 118.24 1u3d h LEU 94 Ca -0.03 0.10 -0.01 0.00 0.08 0.00 0.00 57.88 58.02 1u3d h LEU 94 Cb 0.28 0.22 -0.00 0.00 1.08 0.00 0.00 40.66 42.23 1u3d h LEU 94 CO 0.05 -0.14 -0.04 0.44 -1.08 0.00 0.00 178.44 177.67 1u3d h ASP 95 N -0.07 0.00 0.10 -0.43 5.19 -0.82 0.76 116.42 121.14 1u3d h ASP 95 Ca 0.13 0.00 -0.19 0.00 -0.62 0.00 0.00 57.03 56.36 1u3d h ASP 95 Cb 0.27 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.79 1u3d h ASP 95 CO -0.31 0.04 -0.91 0.58 -3.12 0.00 0.00 179.24 175.52 1u3d h VAL 96 N 0.00 1.35 -0.06 -1.35 2.07 0.75 -3.25 116.25 115.76 1u3d h VAL 96 Ca -0.00 -2.43 -0.01 0.00 0.82 0.00 0.00 66.70 65.08 1u3d h VAL 96 Cb 0.30 2.99 -0.00 0.00 -1.52 0.00 0.00 31.29 33.06 1u3d h VAL 96 CO 0.00 0.66 0.01 1.62 0.02 0.00 0.00 177.57 179.89 1u3d h VAL 97 N -0.51 1.19 0.00 2.57 3.04 -0.11 -1.30 116.25 121.13 1u3d h VAL 97 Ca -0.19 -0.57 -0.01 0.00 -1.01 0.00 0.00 66.70 64.91 1u3d h VAL 97 Cb 1.54 1.46 -0.00 0.00 -2.01 0.00 0.00 31.29 32.28 1u3d h VAL 97 CO 0.06 0.16 -0.01 0.29 -1.01 0.00 0.00 177.57 177.06 1u3d n LYS 98 N -4.92 0.75 0.00 4.17 5.02 0.26 0.66 118.16 124.11 1u3d n LYS 98 Ca -0.07 -0.07 0.00 0.00 -2.02 0.00 0.00 58.31 56.15 1u3d n LYS 98 Cb 0.14 -1.23 0.00 0.00 -0.02 0.00 0.00 35.03 33.93 1u3d n LYS 98 CO 0.00 0.00 0.00 -1.13 -0.52 0.00 0.00 177.40 175.75 1u3d n SER 99 N 1.76 0.00 -0.04 4.39 3.41 -1.10 -4.87 113.62 117.17 1u3d n SER 99 Ca 0.03 0.00 -0.04 0.00 -0.26 0.00 0.00 58.87 58.60 1u3d n SER 99 Cb 0.37 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.24 1u3d n SER 99 CO 0.00 0.00 0.00 1.07 -0.16 0.00 0.00 175.04 175.95 1u3d n THR 100 N -0.04 0.61 -2.03 6.66 5.66 -0.51 -5.04 114.28 119.60 1u3d n THR 100 Ca 0.00 -0.40 0.00 0.00 -3.05 0.00 0.00 64.05 60.60 1u3d n THR 100 Cb 0.00 -0.63 0.00 0.00 -1.55 0.00 0.00 70.33 68.15 1u3d n THR 100 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1u3d n GLY 101 N 2.33 0.53 3.89 1.09 0.00 0.21 -4.98 105.19 108.27 1u3d n GLY 101 Ca -0.15 -0.50 -0.31 0.00 0.00 0.00 0.00 46.02 45.06 1u3d n GLY 101 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1u3d s ALA 102 N -2.95 3.74 -0.15 4.61 0.00 -1.20 -4.51 121.76 121.29 1u3d s ALA 102 Ca 0.00 -0.51 0.08 0.00 0.00 0.00 0.00 51.96 51.54 1u3d s ALA 102 Cb 0.00 -2.19 -0.12 0.00 0.00 0.00 0.00 23.12 20.81 1u3d s ALA 102 CO 0.00 0.61 0.25 -1.13 0.00 0.00 0.00 175.76 175.49 1u3d n SER 103 N -0.03 2.07 -4.04 0.00 3.41 -0.87 -4.89 113.62 109.26 1u3d n SER 103 Ca -0.02 -0.26 -0.12 0.00 -0.26 0.00 0.00 58.87 58.21 1u3d n SER 103 Cb 0.52 1.24 -0.11 0.00 -0.26 0.00 0.00 64.21 65.60 1u3d n SER 103 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 1u3d s GLN 104 N -2.29 0.48 -0.12 4.33 -0.21 -1.26 -0.59 119.66 120.01 1u3d s GLN 104 Ca -0.01 -0.73 -0.01 0.00 0.02 0.00 0.00 55.36 54.64 1u3d s GLN 104 Cb 0.06 -0.20 0.03 0.00 1.00 0.00 0.00 33.01 33.89 1u3d s GLN 104 CO 0.35 0.03 -0.06 -1.50 -2.12 0.00 0.00 175.29 171.98 1u3d s ILE 105 N -1.40 0.96 -0.14 1.08 2.07 -0.44 -0.19 121.20 123.14 1u3d s ILE 105 Ca -0.11 -0.30 -0.05 0.00 -1.41 0.00 0.00 60.65 58.78 1u3d s ILE 105 Cb -0.10 -1.02 -0.04 0.00 0.13 0.00 0.00 42.46 41.43 1u3d s ILE 105 CO 0.00 0.31 0.04 -0.36 -1.91 0.00 0.00 174.94 173.02 1u3d s PHE 106 N 1.73 3.25 0.12 3.50 0.40 0.22 -2.28 117.98 124.93 1u3d s PHE 106 Ca 0.04 0.15 -0.11 0.00 -0.60 0.00 0.00 56.93 56.41 1u3d s PHE 106 Cb -0.13 -1.94 0.01 0.00 0.51 0.00 0.00 43.02 41.46 1u3d s PHE 106 CO -0.08 0.34 0.28 -0.59 0.70 0.00 0.00 175.22 175.87 1u3d s PHE 107 N -0.29 0.14 -0.05 0.36 -0.12 -0.93 -0.88 117.98 116.20 1u3d s PHE 107 Ca 0.08 -0.52 -0.03 0.00 -0.05 0.00 0.00 56.93 56.41 1u3d s PHE 107 Cb -0.12 0.03 -0.04 0.00 -0.63 0.00 0.00 43.02 42.26 1u3d s PHE 107 CO 0.02 -0.65 0.10 -0.80 -0.05 0.00 0.00 175.22 173.84 1u3d s ASN 108 N -2.88 5.93 0.94 1.98 0.01 -1.26 -1.85 114.94 117.81 1u3d s ASN 108 Ca 0.08 0.28 -0.10 0.00 -0.71 0.00 0.00 52.86 52.40 1u3d s ASN 108 Cb 0.03 -1.80 0.16 0.00 0.41 0.00 0.00 41.25 40.06 1u3d s ASN 108 CO -0.08 0.33 1.13 -1.00 -1.51 0.00 0.00 177.10 175.97 1u3d s HIS 109 N -1.11 1.63 -0.01 2.20 3.76 -0.12 -4.88 115.29 116.76 1u3d s HIS 109 Ca 0.20 1.70 -0.04 0.00 -0.15 0.00 0.00 55.06 56.77 1u3d s HIS 109 Cb -0.12 -3.30 -0.00 0.00 1.11 0.00 0.00 32.58 30.27 1u3d s HIS 109 CO 0.10 -2.91 0.07 -0.51 -0.85 0.00 0.00 174.74 170.64 1u3d s LEU 110 N -6.66 1.78 -0.04 0.89 1.43 -1.26 -4.73 118.68 110.09 1u3d s LEU 110 Ca 0.67 -0.11 0.06 0.00 -1.03 0.00 0.00 54.13 53.72 1u3d s LEU 110 Cb -0.23 0.36 0.12 0.00 0.03 0.00 0.00 46.19 46.47 1u3d s LEU 110 CO 0.59 -0.20 1.08 -1.22 0.23 0.00 0.00 176.35 176.83 1u3d n TYR 111 N 2.19 0.09 -2.78 0.29 4.02 -1.26 -4.51 117.16 115.20 1u3d n TYR 111 Ca -0.18 -0.63 -0.33 0.00 -0.01 0.00 0.00 57.90 56.75 1u3d n TYR 111 Cb 0.57 -0.08 -0.06 0.00 -0.02 0.00 0.00 39.34 39.75 1u3d n TYR 111 CO 0.00 0.00 0.00 0.16 -1.01 0.00 0.00 176.86 176.01 1u3d s ASP 112 N -1.46 6.82 0.18 7.72 1.47 -1.26 -4.10 116.67 126.04 1u3d s ASP 112 Ca 0.11 1.56 -0.24 0.00 1.18 0.00 0.00 52.55 55.17 1u3d s ASP 112 Cb 0.09 -2.49 0.08 0.00 -0.34 0.00 0.00 42.92 40.25 1u3d s ASP 112 CO 0.03 -0.39 1.57 -0.65 0.68 0.00 0.00 175.17 176.41 1u3d h PRO 113 N 1.71 -0.18 -0.83 2.11 0.11 -1.85 0.03 132.00 133.11 1u3d h PRO 113 Ca -0.48 0.01 0.07 0.00 0.11 0.00 0.00 66.00 65.71 1u3d h PRO 113 Cb 1.18 0.04 -0.05 0.00 0.11 0.00 0.00 31.00 32.28 1u3d h PRO 113 CO 0.62 -0.12 0.54 -0.07 -0.21 0.00 0.00 178.00 178.76 1u3d h LEU 114 N -0.18 0.78 -0.16 2.35 3.38 -1.93 -2.07 115.31 117.48 1u3d h LEU 114 Ca 0.21 0.01 -0.23 0.00 0.09 0.00 0.00 57.88 57.96 1u3d h LEU 114 Cb 0.56 -0.16 0.01 0.00 0.09 0.00 0.00 40.66 41.16 1u3d h LEU 114 CO -0.72 0.49 -0.83 0.28 0.09 0.00 0.00 178.44 177.75 1u3d h SER 115 N 0.88 0.88 -0.17 -0.43 0.02 -1.73 -3.04 113.55 109.96 1u3d h SER 115 Ca 0.36 -0.60 0.05 0.00 -0.84 0.00 0.00 61.79 60.76 1u3d h SER 115 Cb 0.27 -0.26 -0.05 0.00 0.14 0.00 0.00 62.40 62.50 1u3d h SER 115 CO -0.13 1.40 -0.17 -0.07 -1.14 0.00 0.00 176.83 176.72 1u3d h LEU 116 N 0.47 -0.52 0.78 5.07 3.38 -0.32 0.18 115.31 124.35 1u3d h LEU 116 Ca -0.07 0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.97 1u3d h LEU 116 Cb 1.46 0.25 0.01 0.00 0.09 0.00 0.00 40.66 42.47 1u3d h LEU 116 CO 0.17 -0.21 -0.37 1.62 0.09 0.00 0.00 178.44 179.73 1u3d h VAL 117 N -0.19 0.09 -0.80 1.22 3.04 -1.55 -2.81 116.25 115.25 1u3d h VAL 117 Ca 0.11 -0.19 0.20 0.00 -1.01 0.00 0.00 66.70 65.80 1u3d h VAL 117 Cb 0.35 0.11 -0.05 0.00 -2.01 0.00 0.00 31.29 29.69 1u3d h VAL 117 CO -0.28 0.01 0.55 -0.09 -1.01 0.00 0.00 177.57 176.75 1u3d h ARG 118 N -1.22 0.23 -0.35 4.17 2.43 -1.49 -0.86 114.38 117.30 1u3d h ARG 118 Ca -0.11 -0.01 -0.11 0.00 -0.81 0.00 0.00 59.98 58.94 1u3d h ARG 118 Cb 0.81 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 30.30 1u3d h ARG 118 CO 0.17 0.15 -0.21 -0.44 -1.51 0.00 0.00 179.97 178.13 1u3d h ASP 119 N 0.23 0.79 0.07 -3.80 3.32 -0.90 -1.14 116.42 115.01 1u3d h ASP 119 Ca 0.40 -0.43 -0.00 0.00 0.02 0.00 0.00 57.03 57.02 1u3d h ASP 119 Cb 1.21 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 40.54 1u3d h ASP 119 CO -0.09 1.04 -0.03 0.45 -1.72 0.00 0.00 179.24 178.89 1u3d h HIS 120 N 0.54 -0.09 -0.28 4.55 3.86 -1.00 -1.38 115.15 121.35 1u3d h HIS 120 Ca 0.07 -0.00 0.08 0.00 -1.16 0.00 0.00 60.37 59.36 1u3d h HIS 120 Cb 0.77 0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 1u3d h HIS 120 CO 0.06 0.13 0.27 -0.09 0.86 0.00 0.00 177.93 179.16 1u3d h ARG 121 N -0.30 0.00 0.14 2.45 2.43 -1.20 -0.83 114.38 117.07 1u3d h ARG 121 Ca -0.01 0.00 -0.01 0.00 -0.81 0.00 0.00 59.98 59.15 1u3d h ARG 121 Cb 0.26 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.81 1u3d h ARG 121 CO 0.02 0.00 -0.07 0.00 -1.51 0.00 0.00 179.97 178.41 1u3d h ALA 122 N 1.73 -0.19 -0.48 2.80 0.00 -0.56 -2.81 119.26 119.74 1u3d h ALA 122 Ca 0.13 -0.24 0.06 0.00 0.00 0.00 0.00 54.91 54.87 1u3d h ALA 122 Cb 0.67 0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.48 1u3d h ALA 122 CO -0.00 -0.28 0.18 -0.22 0.00 0.00 0.00 179.25 178.93 1u3d h LYS 123 N -0.85 0.35 0.08 0.00 1.63 -0.36 -1.68 116.57 115.73 1u3d h LYS 123 Ca -0.02 -0.02 -0.00 0.00 -0.85 0.00 0.00 60.65 59.76 1u3d h LYS 123 Cb 0.54 -0.08 -0.00 0.00 -0.60 0.00 0.00 32.23 32.09 1u3d h LYS 123 CO 0.03 0.23 -0.07 -0.44 -3.45 0.00 0.00 179.45 175.75 1u3d h ASP 124 N 0.36 -0.18 -0.79 4.20 3.32 -1.29 0.39 116.42 122.43 1u3d h ASP 124 Ca 0.23 0.01 0.16 0.00 0.02 0.00 0.00 57.03 57.46 1u3d h ASP 124 Cb 0.23 0.06 -0.11 0.00 0.22 0.00 0.00 39.33 39.73 1u3d h ASP 124 CO -0.23 -0.09 0.30 0.58 -1.72 0.00 0.00 179.24 178.08 1u3d h VAL 125 N -0.14 0.59 0.03 -1.35 2.07 -1.46 0.16 116.25 116.15 1u3d h VAL 125 Ca -0.01 -0.14 -0.24 0.00 0.82 0.00 0.00 66.70 67.13 1u3d h VAL 125 Cb 0.12 0.14 0.01 0.00 -1.52 0.00 0.00 31.29 30.04 1u3d h VAL 125 CO -0.00 0.07 -1.02 -0.07 0.02 0.00 0.00 177.57 176.57 1u3d h LEU 126 N 0.41 0.54 0.02 2.57 4.07 -1.29 -3.19 115.31 118.44 1u3d h LEU 126 Ca 0.45 -0.46 -0.24 0.00 0.08 0.00 0.00 57.88 57.71 1u3d h LEU 126 Cb 0.75 -0.17 0.02 0.00 1.08 0.00 0.00 40.66 42.34 1u3d h LEU 126 CO -0.45 1.28 -0.94 0.00 -1.08 0.00 0.00 178.44 177.24 1u3d h THR 127 N 0.21 1.33 0.00 0.22 1.03 -0.63 0.15 112.91 115.21 1u3d h THR 127 Ca -0.10 -2.24 0.00 0.00 -0.01 0.00 0.00 66.41 64.06 1u3d h THR 127 Cb 1.68 2.51 0.00 0.00 -1.07 0.00 0.00 68.15 71.27 1u3d h THR 127 CO 0.18 0.68 0.00 0.00 -0.01 0.00 0.00 175.52 176.37 1u3d n ALA 128 N -2.64 2.66 -1.63 0.00 0.00 0.54 -1.33 120.51 118.12 1u3d n ALA 128 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.33 1u3d n ALA 128 Cb 0.84 -1.07 0.00 0.00 0.00 0.00 0.00 19.45 19.22 1u3d n ALA 128 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1u3d n GLN 129 N 0.92 0.00 -1.63 0.00 1.13 -1.11 -4.93 117.38 111.75 1u3d n GLN 129 Ca 0.00 -0.23 0.00 0.00 -1.94 0.00 0.00 57.00 54.83 1u3d n GLN 129 Cb 0.39 -0.21 0.00 0.00 0.11 0.00 0.00 30.24 30.54 1u3d n GLN 129 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1u3d n GLY 130 N 0.00 0.85 3.11 1.08 0.00 -0.44 -5.04 105.19 104.75 1u3d n GLY 130 Ca 0.00 -0.61 -0.29 0.00 0.00 0.00 0.00 46.02 45.12 1u3d n GLY 130 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u3d s ILE 131 N -2.26 1.62 -0.03 -0.61 -1.09 0.50 -4.94 121.20 114.38 1u3d s ILE 131 Ca 0.00 -0.74 -0.30 0.00 -2.23 0.00 0.00 60.65 57.38 1u3d s ILE 131 Cb 0.00 -1.44 -0.03 0.00 -1.58 0.00 0.00 42.46 39.41 1u3d s ILE 131 CO 0.00 0.46 1.14 0.00 -1.23 0.00 0.00 174.94 175.31 1u3d s ALA 132 N 0.65 3.41 -0.22 9.38 0.00 0.24 -3.67 121.76 131.55 1u3d s ALA 132 Ca -0.13 0.62 0.02 0.00 0.00 0.00 0.00 51.96 52.46 1u3d s ALA 132 Cb -0.16 -3.46 0.04 0.00 0.00 0.00 0.00 23.12 19.53 1u3d s ALA 132 CO 0.04 -0.59 -0.16 0.14 0.00 0.00 0.00 175.76 175.19 1u3d s VAL 133 N 1.75 2.12 0.10 0.00 -7.23 -1.26 -1.33 120.40 114.55 1u3d s VAL 133 Ca 0.55 -1.26 0.08 0.00 -1.81 0.00 0.00 61.98 59.54 1u3d s VAL 133 Cb -0.24 -2.06 -0.04 0.00 0.56 0.00 0.00 36.38 34.60 1u3d s VAL 133 CO 0.24 0.28 -0.16 -0.60 -0.31 0.00 0.00 175.10 174.55 1u3d s ARG 134 N 1.21 1.94 -0.08 4.82 6.06 -0.97 -5.01 118.95 126.92 1u3d s ARG 134 Ca -0.01 -1.09 -0.00 0.00 -2.50 0.00 0.00 55.73 52.12 1u3d s ARG 134 Cb -0.16 -2.19 0.02 0.00 0.06 0.00 0.00 34.95 32.69 1u3d s ARG 134 CO -0.09 0.50 -0.05 0.45 -2.50 0.00 0.00 175.30 173.61 1u3d s SER 135 N -2.03 1.71 0.51 -2.12 0.15 -1.26 -2.19 113.70 108.48 1u3d s SER 135 Ca 0.18 -0.19 0.03 0.00 0.70 0.00 0.00 55.95 56.67 1u3d s SER 135 Cb -0.11 -0.63 -0.00 0.00 -1.71 0.00 0.00 66.02 63.57 1u3d s SER 135 CO 0.10 -0.12 0.11 -0.36 1.20 0.00 0.00 173.24 174.18 1u3d s PHE 136 N 1.55 1.86 -0.45 3.44 0.40 -0.77 -4.89 117.98 119.11 1u3d s PHE 136 Ca 0.00 -0.90 -0.16 0.00 -0.60 0.00 0.00 56.93 55.27 1u3d s PHE 136 Cb -0.13 -1.71 0.04 0.00 0.51 0.00 0.00 43.02 41.73 1u3d s PHE 136 CO -0.04 0.05 0.41 1.21 0.70 0.00 0.00 175.22 177.55 1u3d s ASN 137 N -3.98 6.16 -0.01 1.36 2.47 -1.26 -0.94 114.94 118.74 1u3d s ASN 137 Ca 0.16 -0.96 0.06 0.00 0.42 0.00 0.00 52.86 52.54 1u3d s ASN 137 Cb 0.01 -2.20 -0.09 0.00 -1.45 0.00 0.00 41.25 37.51 1u3d s ASN 137 CO 0.09 -0.61 0.17 0.00 -3.72 0.00 0.00 177.10 173.03 1u3d n ALA 138 N 5.44 2.37 0.57 1.71 0.00 -1.26 -4.78 120.51 124.56 1u3d n ALA 138 Ca -0.10 -0.16 0.07 0.00 0.00 0.00 0.00 53.44 53.26 1u3d n ALA 138 Cb 0.46 -0.22 0.06 0.00 0.00 0.00 0.00 19.45 19.75 1u3d n ALA 138 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1u3d n ASP 139 N -1.59 2.22 -4.21 0.00 10.43 -1.26 -4.73 116.55 117.41 1u3d n ASP 139 Ca -0.01 -1.61 -0.12 0.00 2.57 0.00 0.00 54.79 55.62 1u3d n ASP 139 Cb 0.15 -0.01 -0.10 0.00 1.84 0.00 0.00 41.12 43.00 1u3d n ASP 139 CO 0.00 0.00 0.00 -0.76 -1.07 0.00 0.00 177.20 175.37 1u3d s LEU 140 N -1.18 1.86 0.13 0.64 1.43 -1.26 -4.83 118.68 115.46 1u3d s LEU 140 Ca 0.17 -1.23 -0.04 0.00 -1.03 0.00 0.00 54.13 52.00 1u3d s LEU 140 Cb 0.12 0.12 -0.09 0.00 0.03 0.00 0.00 46.19 46.36 1u3d s LEU 140 CO 0.18 -0.67 1.31 -0.07 0.23 0.00 0.00 176.35 177.33 1u3d h LEU 141 N 2.71 0.54 -7.46 1.79 3.38 -1.95 -3.45 115.31 110.86 1u3d h LEU 141 Ca -0.36 -0.43 -0.13 0.00 0.09 0.00 0.00 57.88 57.05 1u3d h LEU 141 Cb 1.21 -0.16 -0.23 0.00 0.09 0.00 0.00 40.66 41.57 1u3d h LEU 141 CO 0.60 1.22 -0.31 -0.31 0.09 0.00 0.00 178.44 179.74 1u3d s TYR 142 N -3.28 -0.26 0.52 1.13 2.02 -1.26 -4.61 117.35 111.61 1u3d s TYR 142 Ca -0.06 0.57 -0.21 0.00 -0.37 0.00 0.00 57.07 57.00 1u3d s TYR 142 Cb 0.09 0.10 -0.06 0.00 -0.40 0.00 0.00 41.96 41.70 1u3d s TYR 142 CO 0.87 -0.28 1.23 -1.21 -1.57 0.00 0.00 175.55 174.59 1u3d s GLU 143 N -0.56 3.35 0.60 -0.62 0.41 -1.26 -4.86 118.70 115.76 1u3d s GLU 143 Ca -0.07 1.91 0.30 0.00 -0.41 0.00 0.00 54.97 56.70 1u3d s GLU 143 Cb -0.04 -2.22 1.63 0.00 -1.78 0.00 0.00 34.13 31.72 1u3d s GLU 143 CO 0.02 -0.92 2.02 -1.00 -0.49 0.00 0.00 175.26 174.89 1u3d h PRO 144 N 1.53 0.00 0.00 0.39 0.13 -1.94 -0.87 132.00 131.23 1u3d h PRO 144 Ca -0.50 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 64.61 1u3d h PRO 144 Cb 1.28 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.40 1u3d h PRO 144 CO 0.58 0.00 -0.07 0.11 -0.23 0.00 0.00 178.00 178.39 1u3d h TRP 145 N 0.00 0.00 0.00 1.56 0.09 -1.99 -3.16 115.95 112.45 1u3d h TRP 145 Ca 0.11 0.00 0.00 0.00 0.09 0.00 0.00 58.89 59.09 1u3d h TRP 145 Cb 0.72 0.00 0.00 0.00 0.08 0.00 0.00 29.16 29.96 1u3d h TRP 145 CO 0.00 0.07 0.00 0.93 0.09 0.00 0.00 178.44 179.53 1u3d h GLU 146 N 0.00 0.00 -4.70 0.12 5.08 -1.50 -3.42 114.58 110.16 1u3d h GLU 146 Ca -0.00 0.00 -0.69 0.00 -1.00 0.00 0.00 59.36 57.67 1u3d h GLU 146 Cb 0.97 0.00 -0.32 0.00 0.50 0.00 0.00 28.75 29.90 1u3d h GLU 146 CO 0.01 0.00 -0.65 0.08 -1.00 0.00 0.00 179.01 177.45 1u3d s VAL 147 N -3.22 3.29 0.20 3.13 1.01 -1.19 -5.01 120.40 118.61 1u3d s VAL 147 Ca 0.08 -1.38 -0.16 0.00 0.00 0.00 0.00 61.98 60.51 1u3d s VAL 147 Cb 0.11 -2.92 0.02 0.00 0.00 0.00 0.00 36.38 33.58 1u3d s VAL 147 CO 0.53 -0.20 0.50 0.28 0.00 0.00 0.00 175.10 176.21 1u3d s THR 148 N 1.29 0.03 0.82 3.92 -1.32 -1.26 -4.74 115.64 114.37 1u3d s THR 148 Ca -0.02 -0.94 -0.12 0.00 -1.21 0.00 0.00 61.69 59.40 1u3d s THR 148 Cb -0.20 -1.71 0.08 0.00 -1.51 0.00 0.00 72.50 69.16 1u3d s THR 148 CO -0.00 -0.11 1.16 1.51 -2.21 0.00 0.00 174.62 174.97 1u3d s ASP 149 N -2.90 4.41 0.26 8.08 1.47 -0.87 -4.87 116.67 122.24 1u3d s ASP 149 Ca 0.12 0.85 -0.03 0.00 1.18 0.00 0.00 52.55 54.67 1u3d s ASP 149 Cb -0.01 -1.38 0.53 0.00 -0.34 0.00 0.00 42.92 41.72 1u3d s ASP 149 CO -0.00 -1.97 1.68 -0.33 0.68 0.00 0.00 175.17 175.22 1u3d h GLU 150 N -1.10 0.26 -0.54 2.11 5.08 -2.02 0.39 114.58 118.75 1u3d h GLU 150 Ca -0.47 -0.02 -0.04 0.00 -1.00 0.00 0.00 59.36 57.84 1u3d h GLU 150 Cb 1.32 -0.06 -0.03 0.00 0.50 0.00 0.00 28.75 30.49 1u3d h GLU 150 CO 0.65 0.18 0.18 -0.07 -1.00 0.00 0.00 179.01 178.95 1u3d h LEU 151 N 0.27 0.73 0.00 1.33 -0.00 -2.05 -3.46 115.31 112.14 1u3d h LEU 151 Ca 0.45 -0.11 0.00 0.00 -0.00 0.00 0.00 57.88 58.23 1u3d h LEU 151 Cb 0.81 -0.19 0.00 0.00 -0.00 0.00 0.00 40.66 41.28 1u3d h LEU 151 CO -0.54 0.69 0.00 0.61 -0.00 0.00 0.00 178.44 179.19 1u3d n GLY 152 N -0.99 1.36 3.90 0.83 0.00 0.14 -5.12 105.19 105.31 1u3d n GLY 152 Ca 0.04 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.76 1u3d n GLY 152 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1u3d s ARG 153 N -0.14 3.65 0.25 1.61 0.52 -1.26 -4.75 118.95 118.82 1u3d s ARG 153 Ca 0.00 -0.02 -0.30 0.00 -0.52 0.00 0.00 55.73 54.89 1u3d s ARG 153 Cb 0.00 -2.74 -0.10 0.00 0.52 0.00 0.00 34.95 32.63 1u3d s ARG 153 CO 0.00 0.35 1.43 -1.25 0.02 0.00 0.00 175.30 175.84 1u3d s PRO 154 N -3.07 4.28 0.73 3.54 0.04 -1.26 -2.06 135.00 137.21 1u3d s PRO 154 Ca 0.43 2.28 -0.14 0.00 0.04 0.00 0.00 61.00 63.60 1u3d s PRO 154 Cb -0.11 -3.12 0.04 0.00 0.04 0.00 0.00 34.50 31.35 1u3d s PRO 154 CO 0.26 -0.40 1.18 -0.06 0.04 0.00 0.00 177.00 178.02 1u3d s PHE 155 N -0.02 2.13 -1.35 0.56 0.40 -1.26 -4.92 117.98 113.51 1u3d s PHE 155 Ca 0.59 1.61 0.11 0.00 -0.60 0.00 0.00 56.93 58.64 1u3d s PHE 155 Cb -0.41 -3.40 0.11 0.00 0.51 0.00 0.00 43.02 39.83 1u3d s PHE 155 CO 0.43 -2.44 0.90 -1.13 0.70 0.00 0.00 175.22 173.68 1u3d n SER 156 N -2.80 2.04 -3.97 1.36 3.41 -1.26 -4.99 113.62 107.40 1u3d n SER 156 Ca 0.13 -1.53 -0.09 0.00 -0.26 0.00 0.00 58.87 57.12 1u3d n SER 156 Cb 0.51 -0.03 -0.11 0.00 -0.26 0.00 0.00 64.21 64.32 1u3d n SER 156 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1u3d s MET 157 N -0.94 0.32 0.09 4.33 -1.94 -1.26 -4.68 119.30 115.23 1u3d s MET 157 Ca 0.14 -0.60 -0.35 0.00 -1.71 0.00 0.00 55.69 53.18 1u3d s MET 157 Cb 0.10 0.12 -0.16 0.00 2.01 0.00 0.00 34.83 36.90 1u3d s MET 157 CO 0.14 -0.05 1.54 0.35 -0.01 0.00 0.00 175.02 176.99 1u3d h PHE 158 N 4.62 -1.44 -0.72 -0.03 3.57 -1.97 -2.58 116.94 118.40 1u3d h PHE 158 Ca -0.32 0.02 0.15 0.00 3.53 0.00 0.00 57.97 61.36 1u3d h PHE 158 Cb 1.21 0.59 -0.13 0.00 2.79 0.00 0.00 35.95 40.40 1u3d h PHE 158 CO 0.66 -0.63 -0.10 0.00 -2.23 0.00 0.00 178.31 176.01 1u3d h ALA 159 N -0.76 0.59 -0.48 2.41 0.00 -1.98 0.26 119.26 119.29 1u3d h ALA 159 Ca -0.04 0.26 -0.06 0.00 0.00 0.00 0.00 54.91 55.07 1u3d h ALA 159 Cb 0.81 0.48 -0.02 0.00 0.00 0.00 0.00 17.79 19.06 1u3d h ALA 159 CO -0.16 -0.42 0.05 0.00 0.00 0.00 0.00 179.25 178.72 1u3d h ALA 160 N 1.70 1.18 -0.24 0.00 0.00 -1.97 -0.55 119.26 119.38 1u3d h ALA 160 Ca 0.36 -0.23 -0.05 0.00 0.00 0.00 0.00 54.91 54.99 1u3d h ALA 160 Cb 0.59 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1u3d h ALA 160 CO -0.69 0.54 -0.05 0.35 0.00 0.00 0.00 179.25 179.39 1u3d h PHE 161 N 0.73 0.51 -0.27 0.00 3.57 -0.54 -2.43 116.94 118.51 1u3d h PHE 161 Ca 0.15 -0.11 -0.15 0.00 3.53 0.00 0.00 57.97 61.40 1u3d h PHE 161 Cb 0.37 -0.12 -0.01 0.00 2.79 0.00 0.00 35.95 38.98 1u3d h PHE 161 CO 0.02 0.68 -0.43 2.35 -2.23 0.00 0.00 178.31 178.69 1u3d h TRP 162 N 0.19 0.81 -0.67 0.41 -0.00 -0.41 -0.47 115.95 115.81 1u3d h TRP 162 Ca 0.06 -0.25 -0.04 0.00 -0.00 0.00 0.00 58.89 58.67 1u3d h TRP 162 Cb 0.51 -0.17 -0.03 0.00 -0.00 0.00 0.00 29.16 29.47 1u3d h TRP 162 CO 0.05 0.99 0.27 1.49 -0.00 0.00 0.00 178.44 181.24 1u3d h GLU 163 N 0.54 0.98 -0.13 2.65 4.81 -1.09 -0.95 114.58 121.39 1u3d h GLU 163 Ca 0.04 -0.16 -0.04 0.00 -0.13 0.00 0.00 59.36 59.06 1u3d h GLU 163 Cb 0.97 -0.17 -0.00 0.00 0.63 0.00 0.00 28.75 30.18 1u3d h GLU 163 CO 0.09 0.80 -0.09 -0.09 -0.73 0.00 0.00 179.01 178.99 1u3d h ARG 164 N 0.96 0.28 -0.99 1.92 1.12 -1.09 -2.42 114.38 114.17 1u3d h ARG 164 Ca 0.23 -0.14 0.19 0.00 -1.11 0.00 0.00 59.98 59.15 1u3d h ARG 164 Cb 0.18 -0.00 -0.10 0.00 -0.01 0.00 0.00 29.97 30.04 1u3d h ARG 164 CO -0.02 0.65 0.61 0.00 -3.11 0.00 0.00 179.97 178.11 1u3d n LEU 166 N -4.69 0.26 -2.01 0.00 4.77 -0.40 -3.91 117.00 111.01 1u3d n LEU 166 Ca 0.22 0.23 -0.15 0.00 -0.03 0.00 0.00 56.01 56.28 1u3d n LEU 166 Cb 0.61 -0.35 0.05 0.00 -2.33 0.00 0.00 43.42 41.39 1u3d n LEU 166 CO 0.24 0.06 0.16 -1.54 -1.33 0.00 0.00 177.39 174.98 1u3d n SER 167 N -1.38 3.81 -4.81 -1.43 3.41 -0.19 -5.08 113.62 107.96 1u3d n SER 167 Ca 0.08 -3.38 -0.33 0.00 -0.26 0.00 0.00 58.87 54.98 1u3d n SER 167 Cb 0.32 -0.39 -0.01 0.00 -0.26 0.00 0.00 64.21 63.87 1u3d n SER 167 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1u3d s MET 168 N -3.49 3.60 0.33 4.33 -1.94 -1.00 -4.94 119.30 116.18 1u3d s MET 168 Ca 0.44 1.24 0.25 0.00 -1.71 0.00 0.00 55.69 55.91 1u3d s MET 168 Cb 0.39 -2.07 1.16 0.00 2.01 0.00 0.00 34.83 36.32 1u3d s MET 168 CO 0.01 -0.59 1.75 -1.00 -0.01 0.00 0.00 175.02 175.18 1u3d h PRO 169 N 0.97 0.00 -4.17 2.03 0.13 -1.96 -3.44 132.00 125.57 1u3d h PRO 169 Ca -0.48 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.52 1u3d h PRO 169 Cb 1.22 0.00 -0.16 0.00 0.13 0.00 0.00 31.00 32.18 1u3d h PRO 169 CO 0.59 0.00 -0.68 1.52 -0.23 0.00 0.00 178.00 179.20 1u3d s TYR 170 N -3.48 0.45 0.49 1.56 -0.85 -1.26 -5.17 117.35 109.09 1u3d s TYR 170 Ca 0.01 -0.93 -0.09 0.00 -0.52 0.00 0.00 57.07 55.54 1u3d s TYR 170 Cb 0.08 -0.34 -0.05 0.00 0.38 0.00 0.00 41.96 42.04 1u3d s TYR 170 CO 0.33 -0.34 0.85 -0.51 -1.52 0.00 0.00 175.55 174.36 1u3d s ASP 171 N -2.57 6.37 0.56 -0.18 1.01 -1.26 -5.04 116.67 115.56 1u3d s ASP 171 Ca 0.01 1.15 -0.20 0.00 0.71 0.00 0.00 52.55 54.22 1u3d s ASP 171 Cb 0.04 -2.34 -0.05 0.00 1.01 0.00 0.00 42.92 41.58 1u3d s ASP 171 CO -0.08 -0.58 1.21 -2.84 0.21 0.00 0.00 175.17 173.09 1u3d s PRO 172 N -4.48 3.16 0.46 8.23 0.02 -1.26 -4.90 135.00 136.23 1u3d s PRO 172 Ca 0.51 1.84 -0.22 0.00 0.02 0.00 0.00 61.00 63.15 1u3d s PRO 172 Cb -0.10 -2.05 -0.10 0.00 0.02 0.00 0.00 34.50 32.26 1u3d s PRO 172 CO 0.41 -1.06 0.84 -0.85 -0.33 0.00 0.00 177.00 176.02 1u3d n GLU 173 N -1.31 1.01 -3.22 5.54 0.28 -1.26 -4.93 120.64 116.74 1u3d n GLU 173 Ca 0.12 0.37 -0.39 0.00 -0.16 0.00 0.00 57.16 57.10 1u3d n GLU 173 Cb 0.49 -1.90 -0.06 0.00 1.43 0.00 0.00 31.44 31.40 1u3d n GLU 173 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 177.13 177.42 1u3d s SER 174 N -0.91 7.12 -0.10 -1.84 0.15 -1.26 -4.92 113.70 111.93 1u3d s SER 174 Ca 0.66 1.33 -0.41 0.00 0.70 0.00 0.00 55.95 58.23 1u3d s SER 174 Cb -0.53 -2.38 -0.19 0.00 -1.71 0.00 0.00 66.02 61.20 1u3d s SER 174 CO 0.55 0.26 1.26 -2.65 1.20 0.00 0.00 173.24 173.86 1u3d n PRO 175 N 1.74 0.27 -3.38 5.44 -0.02 -1.26 -4.97 135.00 132.82 1u3d n PRO 175 Ca -0.09 0.10 -0.29 0.00 -2.02 0.00 0.00 63.50 61.19 1u3d n PRO 175 Cb 0.50 -1.63 -0.04 0.00 -0.02 0.00 0.00 33.50 32.31 1u3d n PRO 175 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 1u3d s LEU 176 N 0.89 4.10 0.59 2.45 1.43 -1.26 -4.91 118.68 121.97 1u3d s LEU 176 Ca 0.93 0.74 -0.15 0.00 -1.03 0.00 0.00 54.13 54.62 1u3d s LEU 176 Cb -1.25 -3.54 -0.04 0.00 0.03 0.00 0.00 46.19 41.39 1u3d s LEU 176 CO 0.61 -0.15 1.04 -0.76 0.23 0.00 0.00 176.35 177.32 1u3d s LEU 177 N -3.33 3.47 0.98 1.79 1.43 -1.26 -1.13 118.68 120.62 1u3d s LEU 177 Ca 0.44 1.73 -0.13 0.00 -1.03 0.00 0.00 54.13 55.15 1u3d s LEU 177 Cb -0.11 -4.52 0.17 0.00 0.03 0.00 0.00 46.19 41.76 1u3d s LEU 177 CO 0.28 -1.08 1.12 -2.16 0.23 0.00 0.00 176.35 174.73 1u3d s PRO 178 N -4.23 0.61 1.07 1.29 0.04 -1.25 -4.54 135.00 127.99 1u3d s PRO 178 Ca 0.62 0.36 -0.12 0.00 0.04 0.00 0.00 61.00 61.90 1u3d s PRO 178 Cb -0.14 -1.77 0.23 0.00 0.04 0.00 0.00 34.50 32.86 1u3d s PRO 178 CO 0.39 -2.57 1.07 -2.14 0.04 0.00 0.00 177.00 173.79 1u3d s PRO 179 N -5.13 -0.19 -0.10 0.56 0.02 -1.26 -4.92 135.00 123.97 1u3d s PRO 179 Ca 0.65 1.14 0.20 0.00 0.02 0.00 0.00 61.00 63.00 1u3d s PRO 179 Cb -0.16 -1.62 -0.27 0.00 0.02 0.00 0.00 34.50 32.47 1u3d s PRO 179 CO 0.56 -3.32 0.33 1.63 -0.33 0.00 0.00 177.00 175.86 1u3d n LYS 180 N -4.67 0.67 -3.71 5.54 5.02 -1.26 -4.97 118.16 114.78 1u3d n LYS 180 Ca 0.07 -0.06 -0.12 0.00 -2.02 0.00 0.00 58.31 56.17 1u3d n LYS 180 Cb 0.53 -1.56 -0.07 0.00 -0.02 0.00 0.00 35.03 33.92 1u3d n LYS 180 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 1u3d s LYS 181 N -2.96 0.87 0.00 1.97 -0.14 -1.26 -4.91 119.74 113.31 1u3d s LYS 181 Ca -0.08 -0.42 0.02 0.00 -1.36 0.00 0.00 55.97 54.12 1u3d s LYS 181 Cb 0.10 0.38 -0.01 0.00 -1.68 0.00 0.00 37.83 36.62 1u3d s LYS 181 CO 0.86 -0.29 -0.07 0.42 -0.76 0.00 0.00 175.35 175.51 1u3d s ILE 182 N -2.49 0.52 -0.16 2.17 1.01 0.62 -5.02 121.20 117.85 1u3d s ILE 182 Ca -0.05 -0.42 -0.04 0.00 0.00 0.00 0.00 60.65 60.13 1u3d s ILE 182 Cb -0.01 -0.47 -0.03 0.00 0.01 0.00 0.00 42.46 41.97 1u3d s ILE 182 CO -0.03 0.05 -0.02 -0.63 0.00 0.00 0.00 174.94 174.31 1u3d s ILE 183 N -0.37 4.00 -0.29 2.92 -1.09 -1.26 -4.35 121.20 120.76 1u3d s ILE 183 Ca 0.00 -0.32 -0.08 0.00 -2.23 0.00 0.00 60.65 58.03 1u3d s ILE 183 Cb -0.04 -2.76 -0.01 0.00 -1.58 0.00 0.00 42.46 38.07 1u3d s ILE 183 CO -0.00 0.49 0.11 -0.94 -1.23 0.00 0.00 174.94 173.36 1u3d s SER 184 N 0.40 5.31 0.00 3.58 1.04 -1.26 -0.23 113.70 122.54 1u3d s SER 184 Ca -0.03 -0.45 0.00 0.00 0.48 0.00 0.00 55.95 55.95 1u3d s SER 184 Cb -0.14 -1.95 0.00 0.00 0.10 0.00 0.00 66.02 64.03 1u3d s SER 184 CO 0.03 -0.14 0.86 0.61 0.98 0.00 0.00 173.24 175.58 1u3d n GLY 185 N 4.94 -3.27 2.85 7.32 0.00 -0.94 -4.05 105.19 112.03 1u3d n GLY 185 Ca -0.15 0.62 -0.30 0.00 0.00 0.00 0.00 46.02 46.20 1u3d n GLY 185 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1u3d s ASP 186 N -2.96 4.11 0.18 1.61 -1.08 -1.26 -4.93 116.67 112.33 1u3d s ASP 186 Ca 0.00 -2.56 0.20 0.00 -0.52 0.00 0.00 52.55 49.67 1u3d s ASP 186 Cb 0.00 -1.32 0.85 0.00 -1.46 0.00 0.00 42.92 40.99 1u3d s ASP 186 CO 0.00 -0.29 1.61 1.33 0.52 0.00 0.00 175.17 178.34 1u3d n VAL 187 N 3.67 0.93 0.57 1.11 0.24 -1.26 -1.68 118.33 121.92 1u3d n VAL 187 Ca 0.05 0.28 0.07 0.00 -2.04 0.00 0.00 64.34 62.70 1u3d n VAL 187 Cb 0.36 -1.16 0.34 0.00 -1.47 0.00 0.00 33.84 31.90 1u3d n VAL 187 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1u3d n SER 188 N -2.00 0.00 -0.42 -1.34 3.41 -1.26 -2.66 113.62 109.35 1u3d n SER 188 Ca 0.02 0.39 0.12 0.00 -0.26 0.00 0.00 58.87 59.14 1u3d n SER 188 Cb 0.19 -0.44 0.26 0.00 -0.26 0.00 0.00 64.21 63.96 1u3d n SER 188 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1u3d n LYS 189 N -1.44 1.20 -0.32 4.33 4.01 -0.68 -4.48 118.16 120.78 1u3d n LYS 189 Ca 0.05 -0.84 0.10 0.00 -0.51 0.00 0.00 58.31 57.10 1u3d n LYS 189 Cb 0.16 -1.48 0.27 0.00 -0.51 0.00 0.00 35.03 33.46 1u3d n LYS 189 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1u3d s VAL 191 N -5.92 4.07 0.00 0.00 1.01 -1.26 -4.80 120.40 113.50 1u3d s VAL 191 Ca -0.12 0.08 0.00 0.00 0.00 0.00 0.00 61.98 61.94 1u3d s VAL 191 Cb 0.23 -4.77 0.00 0.00 0.00 0.00 0.00 36.38 31.84 1u3d s VAL 191 CO 0.79 -1.58 0.00 0.00 0.00 0.00 0.00 175.10 174.31 1u3d n ALA 192 N 8.41 0.00 -2.67 5.51 0.00 -1.25 -5.10 120.51 125.40 1u3d n ALA 192 Ca 0.00 0.00 -0.40 0.00 0.00 0.00 0.00 53.44 53.04 1u3d n ALA 192 Cb 0.47 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.87 1u3d n ALA 192 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1u3d s ASP 193 N 1.00 6.77 0.34 0.00 1.01 -0.59 -5.02 116.67 120.18 1u3d s ASP 193 Ca 0.00 0.93 -0.26 0.00 0.71 0.00 0.00 52.55 53.93 1u3d s ASP 193 Cb 0.00 -2.37 -0.09 0.00 1.01 0.00 0.00 42.92 41.47 1u3d s ASP 193 CO 0.00 -0.24 1.05 -2.16 0.21 0.00 0.00 175.17 174.02 1u3d s PRO 194 N 1.67 4.40 -0.19 8.23 0.04 -1.26 -4.54 135.00 143.35 1u3d s PRO 194 Ca 0.31 1.58 -0.05 0.00 0.04 0.00 0.00 61.00 62.88 1u3d s PRO 194 Cb -0.16 -2.81 -0.03 0.00 0.04 0.00 0.00 34.50 31.54 1u3d s PRO 194 CO 0.12 0.05 0.00 -0.51 0.04 0.00 0.00 177.00 176.70 1u3d s LEU 195 N -2.12 3.35 -0.35 -3.56 1.02 -1.26 -4.86 118.68 110.90 1u3d s LEU 195 Ca 0.52 -0.14 -0.08 0.00 0.02 0.00 0.00 54.13 54.46 1u3d s LEU 195 Cb -0.25 -1.84 0.03 0.00 0.02 0.00 0.00 46.19 44.15 1u3d s LEU 195 CO 0.32 0.11 0.13 0.68 0.02 0.00 0.00 176.35 177.60 1u3d s VAL 196 N 0.76 4.00 -2.80 -1.59 -7.23 -1.26 -4.93 120.40 107.36 1u3d s VAL 196 Ca 0.00 -1.04 0.25 0.00 -1.81 0.00 0.00 61.98 59.39 1u3d s VAL 196 Cb -0.14 -3.25 0.31 0.00 0.56 0.00 0.00 36.38 33.87 1u3d s VAL 196 CO 0.02 -0.18 1.43 0.49 -0.31 0.00 0.00 175.10 176.55 1u3d n PHE 197 N 4.86 0.00 -3.77 2.82 3.72 -1.26 -4.96 117.46 118.88 1u3d n PHE 197 Ca -0.12 0.00 -0.13 0.00 -0.05 0.00 0.00 57.45 57.15 1u3d n PHE 197 Cb 0.45 -0.00 -0.12 0.00 -0.94 0.00 0.00 39.48 38.87 1u3d n PHE 197 CO 0.00 0.00 0.00 -1.21 -0.05 0.00 0.00 176.76 175.50 1u3d s GLU 198 N -2.01 0.27 0.52 -1.08 2.02 -1.26 -4.62 118.70 112.54 1u3d s GLU 198 Ca 0.31 0.41 0.04 0.00 0.02 0.00 0.00 54.97 55.75 1u3d s GLU 198 Cb 0.20 0.07 0.03 0.00 0.10 0.00 0.00 34.13 34.53 1u3d s GLU 198 CO 0.32 -0.07 0.72 0.16 0.02 0.00 0.00 175.26 176.40 1u3d s ASP 199 N 0.48 5.35 0.30 -0.19 1.47 -1.26 -4.91 116.67 117.91 1u3d s ASP 199 Ca -0.03 -0.19 0.00 0.00 1.18 0.00 0.00 52.55 53.51 1u3d s ASP 199 Cb -0.04 -0.72 0.51 0.00 -0.34 0.00 0.00 42.92 42.33 1u3d s ASP 199 CO -0.02 -1.06 1.92 0.44 0.68 0.00 0.00 175.17 177.13 1u3d h ASP 200 N 0.23 0.92 -0.22 2.11 3.32 -2.01 -1.77 116.42 119.00 1u3d h ASP 200 Ca -0.41 -0.00 0.04 0.00 0.02 0.00 0.00 57.03 56.69 1u3d h ASP 200 Cb 1.29 -0.20 -0.04 0.00 0.22 0.00 0.00 39.33 40.60 1u3d h ASP 200 CO 0.49 0.61 -0.06 -1.28 -1.72 0.00 0.00 179.24 177.28 1u3d h SER 201 N 1.05 -0.21 -0.02 6.45 0.87 -2.01 -2.89 113.55 116.80 1u3d h SER 201 Ca 0.37 0.07 -0.09 0.00 -1.23 0.00 0.00 61.79 60.91 1u3d h SER 201 Cb 0.12 0.14 -0.01 0.00 -0.44 0.00 0.00 62.40 62.21 1u3d h SER 201 CO -0.13 -0.07 -0.24 -0.33 -0.53 0.00 0.00 176.83 175.53 1u3d h GLU 202 N -0.00 0.42 -0.93 2.24 5.08 -1.82 -2.56 114.58 117.00 1u3d h GLU 202 Ca 0.10 -0.15 0.08 0.00 -1.00 0.00 0.00 59.36 58.40 1u3d h GLU 202 Cb 0.16 -0.03 -0.07 0.00 0.50 0.00 0.00 28.75 29.31 1u3d h GLU 202 CO -0.22 0.64 0.58 -0.22 -1.00 0.00 0.00 179.01 178.78 1u3d h LYS 203 N 0.37 0.97 0.77 2.33 3.64 -1.14 0.97 116.57 124.48 1u3d h LYS 203 Ca 0.06 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.35 1u3d h LYS 203 Cb 0.63 -0.22 -0.00 0.00 -0.41 0.00 0.00 32.23 32.23 1u3d h LYS 203 CO 0.05 0.64 -0.46 0.78 -2.27 0.00 0.00 179.45 178.19 1u3d h GLY 204 N 1.00 -1.25 2.00 5.01 0.00 -1.29 -2.61 103.07 105.93 1u3d h GLY 204 Ca 0.43 0.51 0.00 0.00 0.00 0.00 0.00 47.33 48.27 1u3d h GLY 204 CO -0.21 -0.43 0.00 1.76 0.00 0.00 0.00 176.54 177.65 1u3d h SER 205 N -1.14 0.00 0.41 0.19 0.02 -1.22 -2.89 113.55 108.93 1u3d h SER 205 Ca -0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.85 1u3d h SER 205 Cb 0.91 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.45 1u3d h SER 205 CO 0.11 0.00 -0.45 0.59 -1.14 0.00 0.00 176.83 175.94 1u3d n ASN 206 N -2.99 0.66 -0.22 3.07 3.02 0.28 -4.56 115.26 114.51 1u3d n ASN 206 Ca -0.03 -0.44 0.31 0.00 -0.03 0.00 0.00 54.58 54.39 1u3d n ASN 206 Cb 0.07 0.24 0.73 0.00 -0.61 0.00 0.00 39.78 40.21 1u3d n ASN 206 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1u3d h ALA 207 N 3.18 2.90 0.00 5.41 0.00 -1.34 -0.84 119.26 128.57 1u3d h ALA 207 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1u3d h ALA 207 Cb 0.50 0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1u3d h ALA 207 CO 0.00 -1.28 -0.89 1.28 0.00 0.00 0.00 179.25 178.37 1u3d n LEU 208 N -4.06 0.74 -0.17 0.00 4.77 -1.26 -4.41 117.00 112.61 1u3d n LEU 208 Ca 0.21 0.23 -0.02 0.00 -0.03 0.00 0.00 56.01 56.39 1u3d n LEU 208 Cb 1.10 -0.11 0.07 0.00 -2.33 0.00 0.00 43.42 42.16 1u3d n LEU 208 CO 0.37 -0.10 0.96 -0.07 -1.33 0.00 0.00 177.39 177.22 1u3d h LEU 209 N 0.00 0.15 -1.81 2.23 3.38 -1.47 -0.56 115.31 117.23 1u3d h LEU 209 Ca 0.00 0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.04 1u3d h LEU 209 Cb 0.86 0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.67 1u3d h LEU 209 CO 0.00 0.11 0.03 0.00 0.09 0.00 0.00 178.44 178.67 1u3d h ALA 210 N 1.36 1.02 0.00 1.53 0.00 -1.77 0.19 119.26 121.59 1u3d h ALA 210 Ca 0.26 0.00 -0.15 0.00 0.00 0.00 0.00 54.91 55.01 1u3d h ALA 210 Cb 0.30 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1u3d h ALA 210 CO -0.28 -0.02 -0.77 -0.09 0.00 0.00 0.00 179.25 178.09 1u3d h ARG 211 N 0.00 0.00 0.00 0.00 2.43 -1.36 -3.37 114.38 112.08 1u3d h ARG 211 Ca 0.00 0.00 -0.25 0.00 -0.81 0.00 0.00 59.98 58.92 1u3d h ARG 211 Cb 0.06 0.00 -0.05 0.00 -0.42 0.00 0.00 29.97 29.57 1u3d h ARG 211 CO 0.00 0.66 -1.94 0.00 -1.51 0.00 0.00 179.97 177.18 1u3d n ALA 212 N -2.29 1.66 -2.44 2.80 0.00 -0.13 -5.04 120.51 115.06 1u3d n ALA 212 Ca -0.00 -0.85 -0.26 0.00 0.00 0.00 0.00 53.44 52.33 1u3d n ALA 212 Cb 0.82 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.15 1u3d n ALA 212 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.50 175.92 1u3d s TRP 213 N -2.33 2.13 -0.45 0.00 0.52 0.48 -5.10 118.94 114.19 1u3d s TRP 213 Ca -0.11 -0.39 0.03 0.00 0.02 0.00 0.00 56.10 55.64 1u3d s TRP 213 Cb 0.05 -1.11 0.13 0.00 -1.15 0.00 0.00 33.47 31.38 1u3d s TRP 213 CO 0.51 0.35 0.22 -1.12 0.02 0.00 0.00 176.95 176.93 1u3d s SER 214 N -2.28 4.00 0.83 2.95 0.01 -1.26 -4.43 113.70 113.52 1u3d s SER 214 Ca 0.14 -2.63 -0.12 0.00 1.31 0.00 0.00 55.95 54.65 1u3d s SER 214 Cb -0.09 -1.27 0.10 0.00 0.21 0.00 0.00 66.02 64.97 1u3d s SER 214 CO 0.07 -0.28 1.19 -2.84 0.41 0.00 0.00 173.24 171.79 1u3d s PRO 215 N 0.30 1.50 0.00 12.44 0.02 -1.26 -4.60 135.00 143.39 1u3d s PRO 215 Ca 0.16 1.69 0.00 0.00 0.02 0.00 0.00 61.00 62.87 1u3d s PRO 215 Cb -0.24 -1.77 0.00 0.00 0.02 0.00 0.00 34.50 32.51 1u3d s PRO 215 CO -0.03 -2.30 0.00 0.41 -0.33 0.00 0.00 177.00 174.75 1u3d n GLY 216 N 0.37 2.96 0.17 0.52 0.00 -1.26 -4.59 105.19 103.36 1u3d n GLY 216 Ca 0.13 -1.96 -0.09 0.00 0.00 0.00 0.00 46.02 44.09 1u3d n GLY 216 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 1u3d h TRP 217 N 0.00 0.49 -0.35 1.61 5.08 -1.76 -1.86 115.95 119.16 1u3d h TRP 217 Ca 0.00 -0.22 0.01 0.00 1.08 0.00 0.00 58.89 59.75 1u3d h TRP 217 Cb 0.00 -0.07 -0.02 0.00 -3.00 0.00 0.00 29.16 26.07 1u3d h TRP 217 CO 0.00 0.98 0.23 1.03 -1.28 0.00 0.00 178.44 179.40 1u3d h SER 218 N 0.24 0.39 1.15 0.11 0.87 -1.90 -0.44 113.55 113.97 1u3d h SER 218 Ca -0.03 -0.01 -0.08 0.00 -1.23 0.00 0.00 61.79 60.44 1u3d h SER 218 Cb 1.32 -0.09 -0.01 0.00 -0.44 0.00 0.00 62.40 63.18 1u3d h SER 218 CO 0.12 0.28 -0.37 0.78 -0.53 0.00 0.00 176.83 177.12 1u3d h ASN 219 N 0.46 0.00 -0.14 6.23 2.35 -1.81 -2.68 115.58 119.99 1u3d h ASN 219 Ca 0.13 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.70 1u3d h ASN 219 Cb -0.05 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 38.32 1u3d h ASN 219 CO -0.03 0.37 -0.55 1.23 -1.65 0.00 0.00 177.43 176.79 1u3d h GLY 220 N 2.67 0.80 1.00 2.83 0.00 -0.79 -1.00 103.07 108.59 1u3d h GLY 220 Ca -0.00 -0.94 0.00 0.00 0.00 0.00 0.00 47.33 46.39 1u3d h GLY 220 CO 0.05 0.84 0.38 -0.55 0.00 0.00 0.00 176.54 177.26 1u3d h ASP 221 N 0.56 0.68 -0.63 0.19 3.32 -0.93 0.05 116.42 119.66 1u3d h ASP 221 Ca 0.01 -0.03 0.04 0.00 0.02 0.00 0.00 57.03 57.07 1u3d h ASP 221 Cb 1.13 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 40.47 1u3d h ASP 221 CO 0.11 0.51 0.38 0.50 -1.72 0.00 0.00 179.24 179.02 1u3d h LYS 222 N 0.79 0.71 -0.44 3.56 3.11 -1.27 -1.17 116.57 121.86 1u3d h LYS 222 Ca 0.21 -0.04 -0.10 0.00 -2.81 0.00 0.00 60.65 57.91 1u3d h LYS 222 Cb -0.07 -0.16 -0.01 0.00 -1.00 0.00 0.00 32.23 30.99 1u3d h LYS 222 CO -0.04 0.47 -0.13 0.00 -2.81 0.00 0.00 179.45 176.93 1u3d h ALA 223 N 1.29 0.61 -0.27 5.00 0.00 -0.34 -1.08 119.26 124.48 1u3d h ALA 223 Ca 0.26 -0.34 0.02 0.00 0.00 0.00 0.00 54.91 54.86 1u3d h ALA 223 Cb 0.07 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.68 1u3d h ALA 223 CO -0.13 0.52 0.11 1.25 0.00 0.00 0.00 179.25 181.00 1u3d h LEU 224 N 0.70 0.15 0.33 0.00 5.85 -0.71 -0.97 115.31 120.66 1u3d h LEU 224 Ca 0.11 0.02 -0.00 0.00 0.84 0.00 0.00 57.88 58.85 1u3d h LEU 224 Cb 0.67 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.68 1u3d h LEU 224 CO 0.05 0.12 -0.34 0.74 -0.34 0.00 0.00 178.44 178.67 1u3d h THR 225 N 0.25 0.29 -0.68 1.05 2.02 -0.84 -0.92 112.91 114.08 1u3d h THR 225 Ca 0.11 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.43 1u3d h THR 225 Cb 0.06 0.29 -0.13 0.00 -1.74 0.00 0.00 68.15 66.63 1u3d h THR 225 CO -0.10 0.00 -0.17 0.74 0.37 0.00 0.00 175.52 176.36 1u3d h THR 226 N -0.71 0.32 0.10 3.16 2.02 -1.13 -1.21 112.91 115.46 1u3d h THR 226 Ca -0.02 0.00 -0.01 0.00 0.77 0.00 0.00 66.41 67.16 1u3d h THR 226 Cb 0.64 0.32 0.00 0.00 -1.74 0.00 0.00 68.15 67.37 1u3d h THR 226 CO -0.07 0.00 -0.05 0.15 0.37 0.00 0.00 175.52 175.92 1u3d h PHE 227 N -0.00 -0.13 -0.26 3.16 3.57 -0.81 -1.64 116.94 120.82 1u3d h PHE 227 Ca 0.33 -0.00 -0.05 0.00 3.53 0.00 0.00 57.97 61.77 1u3d h PHE 227 Cb 0.50 0.04 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 1u3d h PHE 227 CO -0.55 0.07 -0.07 0.82 -2.23 0.00 0.00 178.31 176.35 1u3d h ILE 228 N -0.31 1.19 -0.29 1.41 2.04 -0.92 -1.31 117.51 119.33 1u3d h ILE 228 Ca -0.01 -0.82 0.00 0.00 1.00 0.00 0.00 64.86 65.03 1u3d h ILE 228 Cb 0.25 1.07 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1u3d h ILE 228 CO 0.02 0.27 0.00 0.59 0.00 0.00 0.00 178.15 179.03 1u3d n ASN 229 N -4.27 2.26 0.00 1.72 3.02 -0.48 -4.55 115.26 112.96 1u3d n ASN 229 Ca 0.01 -1.85 0.00 0.00 -0.03 0.00 0.00 54.58 52.70 1u3d n ASN 229 Cb 0.26 -0.19 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 1u3d n ASN 229 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1u3d n GLY 230 N 1.23 2.00 0.43 7.41 0.00 -0.63 -4.96 105.19 110.68 1u3d n GLY 230 Ca 0.16 -0.24 0.23 0.00 0.00 0.00 0.00 46.02 46.17 1u3d n GLY 230 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1u3d h PRO 231 N 0.00 0.00 -0.59 1.61 0.11 -1.74 -2.99 132.00 128.40 1u3d h PRO 231 Ca 0.00 0.00 0.09 0.00 0.11 0.00 0.00 66.00 66.20 1u3d h PRO 231 Cb 0.00 0.00 -0.04 0.00 0.11 0.00 0.00 31.00 31.07 1u3d h PRO 231 CO 0.00 0.00 0.40 1.25 -0.21 0.00 0.00 178.00 179.44 1u3d h LEU 232 N 0.00 0.41 -1.21 2.35 5.85 -1.50 -0.86 115.31 120.35 1u3d h LEU 232 Ca 0.28 0.01 0.10 0.00 0.84 0.00 0.00 57.88 59.11 1u3d h LEU 232 Cb 1.67 -0.08 -0.06 0.00 0.37 0.00 0.00 40.66 42.55 1u3d h LEU 232 CO -0.00 0.25 0.57 0.25 -0.34 0.00 0.00 178.44 179.17 1u3d h LEU 233 N 0.46 0.79 -3.39 2.25 5.85 -1.81 -1.72 115.31 117.74 1u3d h LEU 233 Ca 0.27 0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.98 1u3d h LEU 233 Cb 0.45 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 41.32 1u3d h LEU 233 CO -0.08 0.46 0.02 -0.62 -0.34 0.00 0.00 178.44 177.89 1u3d n GLU 234 N -4.53 3.42 -0.27 1.25 1.02 -0.44 -4.31 120.64 116.78 1u3d n GLU 234 Ca 0.15 -2.97 0.00 0.00 -0.02 0.00 0.00 57.16 54.32 1u3d n GLU 234 Cb 0.32 -1.99 0.13 0.00 -0.02 0.00 0.00 31.44 29.88 1u3d n GLU 234 CO 0.00 0.00 0.00 -0.92 1.18 0.00 0.00 177.13 177.39 1u3d h TYR 235 N 2.37 0.82 -0.04 -0.32 3.20 -0.30 -1.92 116.97 120.78 1u3d h TYR 235 Ca 0.04 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 61.92 1u3d h TYR 235 Cb 1.69 -0.25 -0.00 0.00 1.54 0.00 0.00 36.73 39.70 1u3d h TYR 235 CO 0.76 0.38 -0.04 1.03 -1.64 0.00 0.00 178.16 178.65 1u3d h SER 236 N 0.79 0.10 0.00 -2.11 0.87 -1.82 -3.13 113.55 108.25 1u3d h SER 236 Ca 0.35 -0.48 0.00 0.00 -1.23 0.00 0.00 61.79 60.43 1u3d h SER 236 Cb 0.24 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.17 1u3d h SER 236 CO -0.20 0.56 0.00 2.29 -0.53 0.00 0.00 176.83 178.95 1u3d n LYS 237 N -4.78 0.99 -0.01 2.24 2.85 -1.14 -3.54 118.16 114.76 1u3d n LYS 237 Ca -0.08 0.00 0.01 0.00 -1.05 0.00 0.00 58.31 57.20 1u3d n LYS 237 Cb 0.28 -1.13 0.02 0.00 -0.65 0.00 0.00 35.03 33.54 1u3d n LYS 237 CO 0.00 0.00 0.00 0.09 -0.05 0.00 0.00 177.40 177.44 1u3d n ASN 238 N -0.63 1.42 0.04 -5.58 3.02 -0.74 -4.75 115.26 108.05 1u3d n ASN 238 Ca 0.06 -1.28 0.11 0.00 -0.03 0.00 0.00 54.58 53.44 1u3d n ASN 238 Cb 0.03 -0.01 0.47 0.00 -0.61 0.00 0.00 39.78 39.65 1u3d n ASN 238 CO 0.00 0.00 0.00 -2.11 -2.62 0.00 0.00 177.26 172.53 1u3d n ARG 239 N 0.08 0.08 -0.08 3.52 1.85 -1.21 -1.74 116.66 119.16 1u3d n ARG 239 Ca 0.02 0.18 0.02 0.00 -1.00 0.00 0.00 57.85 57.07 1u3d n ARG 239 Cb 0.11 -1.62 0.06 0.00 -1.05 0.00 0.00 32.46 29.96 1u3d n ARG 239 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1u3d n ARG 240 N -1.76 1.37 -3.17 2.89 1.74 -1.26 -4.75 116.66 111.72 1u3d n ARG 240 Ca 0.05 -0.45 -0.40 0.00 -0.77 0.00 0.00 57.85 56.28 1u3d n ARG 240 Cb 0.29 -1.24 -0.07 0.00 -1.02 0.00 0.00 32.46 30.42 1u3d n ARG 240 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1u3d s LYS 241 N -1.69 4.09 0.08 5.56 -0.14 -0.71 -4.48 119.74 122.45 1u3d s LYS 241 Ca 0.08 0.44 -0.11 0.00 -1.36 0.00 0.00 55.97 55.02 1u3d s LYS 241 Cb 0.05 -3.65 -0.22 0.00 -1.68 0.00 0.00 37.83 32.33 1u3d s LYS 241 CO 0.05 -0.38 1.19 0.00 -0.76 0.00 0.00 175.35 175.45 1u3d h ALA 242 N 7.94 0.15 -1.32 5.17 0.00 -1.86 -3.40 119.26 125.94 1u3d h ALA 242 Ca -0.28 -0.73 -0.42 0.00 0.00 0.00 0.00 54.91 53.48 1u3d h ALA 242 Cb 1.13 0.05 -0.40 0.00 0.00 0.00 0.00 17.79 18.57 1u3d h ALA 242 CO 0.74 0.74 -1.12 -3.47 0.00 0.00 0.00 179.25 176.14 1u3d n ASP 243 N -3.79 1.83 -4.33 0.00 2.03 -1.26 -4.52 116.55 106.52 1u3d n ASP 243 Ca -0.11 -2.93 -0.23 0.00 0.52 0.00 0.00 54.79 52.04 1u3d n ASP 243 Cb 0.91 -0.54 -0.12 0.00 -0.72 0.00 0.00 41.12 40.65 1u3d n ASP 243 CO 0.00 0.00 0.00 -0.44 -1.92 0.00 0.00 177.20 174.84 1u3d s SER 244 N -3.04 2.74 -0.13 1.67 0.01 -1.26 -5.01 113.70 108.67 1u3d s SER 244 Ca 0.33 -0.79 -0.03 0.00 1.31 0.00 0.00 55.95 56.77 1u3d s SER 244 Cb 0.42 -0.16 -0.10 0.00 0.21 0.00 0.00 66.02 66.39 1u3d s SER 244 CO -0.02 0.03 1.81 0.00 0.41 0.00 0.00 173.24 175.46 1u3d n ALA 245 N 0.62 3.34 1.01 1.44 0.00 -1.26 -4.14 120.51 121.51 1u3d n ALA 245 Ca -0.16 -0.90 0.11 0.00 0.00 0.00 0.00 53.44 52.49 1u3d n ALA 245 Cb 0.55 -2.39 -0.03 0.00 0.00 0.00 0.00 19.45 17.59 1u3d n ALA 245 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1u3d n THR 246 N 3.10 0.00 -3.79 0.00 -2.24 -1.26 -4.89 114.28 105.19 1u3d n THR 246 Ca 0.21 -0.17 -0.15 0.00 -2.27 0.00 0.00 64.05 61.67 1u3d n THR 246 Cb 0.33 1.13 -0.00 0.00 -2.10 0.00 0.00 70.33 69.69 1u3d n THR 246 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1u3d n THR 247 N -0.55 0.00 0.06 4.28 -2.24 -1.26 -4.70 114.28 109.87 1u3d n THR 247 Ca 0.08 -1.22 -0.08 0.00 -2.27 0.00 0.00 64.05 60.56 1u3d n THR 247 Cb 0.42 -0.18 -0.12 0.00 -2.10 0.00 0.00 70.33 68.34 1u3d n THR 247 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 1u3d h SER 248 N 0.40 0.04 -1.35 3.42 4.64 -1.95 -3.48 113.55 115.27 1u3d h SER 248 Ca -0.20 -0.05 -0.32 0.00 -0.47 0.00 0.00 61.79 60.76 1u3d h SER 248 Cb 0.70 -0.01 -0.08 0.00 -0.31 0.00 0.00 62.40 62.70 1u3d h SER 248 CO 0.31 1.04 -0.34 0.49 -0.87 0.00 0.00 176.83 177.46 1u3d n PHE 249 N -3.36 -0.30 0.67 4.77 3.72 -1.26 -4.83 117.46 116.88 1u3d n PHE 249 Ca -0.02 0.00 0.12 0.00 -0.05 0.00 0.00 57.45 57.51 1u3d n PHE 249 Cb 0.95 -2.95 0.23 0.00 -0.94 0.00 0.00 39.48 36.77 1u3d n PHE 249 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 176.76 177.99 1u3d n LEU 250 N -1.98 0.64 -0.20 4.37 4.77 -1.26 -4.52 117.00 118.81 1u3d n LEU 250 Ca -0.17 0.24 0.00 0.00 -0.03 0.00 0.00 56.01 56.05 1u3d n LEU 250 Cb 0.57 -0.22 0.09 0.00 -2.33 0.00 0.00 43.42 41.52 1u3d n LEU 250 CO 0.23 -0.03 0.81 0.77 -1.33 0.00 0.00 177.39 177.83 1u3d h SER 251 N 0.00 -0.36 -0.60 -1.43 4.64 -1.98 0.63 113.55 114.45 1u3d h SER 251 Ca 0.00 0.16 -0.03 0.00 -0.47 0.00 0.00 61.79 61.45 1u3d h SER 251 Cb 0.69 0.30 -0.03 0.00 -0.31 0.00 0.00 62.40 63.05 1u3d h SER 251 CO 0.00 -0.14 0.26 -0.65 -0.87 0.00 0.00 176.83 175.43 1u3d h PRO 252 N 0.08 0.91 -0.17 4.77 0.11 -1.84 0.34 132.00 136.20 1u3d h PRO 252 Ca 0.31 -0.14 -0.04 0.00 0.11 0.00 0.00 66.00 66.24 1u3d h PRO 252 Cb 0.50 -0.16 -0.00 0.00 0.11 0.00 0.00 31.00 31.45 1u3d h PRO 252 CO -0.56 0.73 -0.07 0.45 -0.21 0.00 0.00 178.00 178.35 1u3d h HIS 253 N 0.90 0.39 -0.77 0.65 3.86 -1.37 -3.13 115.15 115.67 1u3d h HIS 253 Ca 0.21 -0.09 0.03 0.00 -1.16 0.00 0.00 60.37 59.36 1u3d h HIS 253 Cb 0.15 -0.09 -0.05 0.00 1.06 0.00 0.00 27.41 28.48 1u3d h HIS 253 CO 0.01 0.64 0.49 -0.07 0.86 0.00 0.00 177.93 179.86 1u3d h LEU 254 N 0.03 0.82 -1.36 2.43 3.38 0.10 -1.63 115.31 119.08 1u3d h LEU 254 Ca 0.04 -0.00 0.13 0.00 0.09 0.00 0.00 57.88 58.14 1u3d h LEU 254 Cb 0.53 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 41.03 1u3d h LEU 254 CO 0.02 0.57 0.55 -0.74 0.09 0.00 0.00 178.44 178.92 1u3d h HIS 255 N 0.96 0.74 -0.73 1.13 2.76 -0.30 -1.31 115.15 118.41 1u3d h HIS 255 Ca 0.31 0.02 -0.24 0.00 -2.20 0.00 0.00 60.37 58.26 1u3d h HIS 255 Cb -0.00 -0.24 -0.14 0.00 1.55 0.00 0.00 27.41 28.58 1u3d h HIS 255 CO -0.03 0.29 0.28 1.19 -1.30 0.00 0.00 177.93 178.37 1u3d n PHE 256 N -4.53 2.42 -2.05 5.26 3.72 -0.98 -4.89 117.46 116.41 1u3d n PHE 256 Ca 0.16 -1.27 -0.14 0.00 -0.05 0.00 0.00 57.45 56.15 1u3d n PHE 256 Cb 0.45 -0.69 -0.03 0.00 -0.94 0.00 0.00 39.48 38.26 1u3d n PHE 256 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1u3d n GLY 257 N -0.30 0.19 0.20 1.37 0.00 -0.49 -0.50 105.19 105.65 1u3d n GLY 257 Ca 0.42 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.58 1u3d n GLY 257 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1u3d h GLU 258 N 0.00 0.00 -4.04 1.61 5.08 -1.51 -3.25 114.58 112.47 1u3d h GLU 258 Ca -0.32 0.00 -0.33 0.00 -1.00 0.00 0.00 59.36 57.71 1u3d h GLU 258 Cb 1.12 0.00 -0.31 0.00 0.50 0.00 0.00 28.75 30.06 1u3d h GLU 258 CO 0.40 0.00 -0.75 0.08 -1.00 0.00 0.00 179.01 177.74 1u3d s VAL 259 N -3.43 0.32 -0.22 3.13 1.01 -1.26 -4.38 120.40 115.58 1u3d s VAL 259 Ca 0.04 -0.10 -0.28 0.00 0.00 0.00 0.00 61.98 61.64 1u3d s VAL 259 Cb 0.09 -0.32 0.01 0.00 0.00 0.00 0.00 36.38 36.16 1u3d s VAL 259 CO 0.52 0.13 1.01 -0.55 0.00 0.00 0.00 175.10 176.20 1u3d s SER 260 N 0.36 7.08 0.60 3.32 0.15 -1.26 -4.77 113.70 119.17 1u3d s SER 260 Ca -0.04 1.35 0.36 0.00 0.70 0.00 0.00 55.95 58.32 1u3d s SER 260 Cb -0.07 -2.53 1.91 0.00 -1.71 0.00 0.00 66.02 63.63 1u3d s SER 260 CO -0.01 -0.62 2.22 -0.37 1.20 0.00 0.00 173.24 175.66 1u3d h VAL 261 N 5.40 0.25 -0.17 4.45 -1.51 -1.88 0.47 116.25 123.28 1u3d h VAL 261 Ca -0.21 -0.21 -0.17 0.00 -1.23 0.00 0.00 66.70 64.88 1u3d h VAL 261 Cb 1.07 1.16 -0.00 0.00 -2.13 0.00 0.00 31.29 31.39 1u3d h VAL 261 CO 0.95 0.03 -0.59 0.03 -1.23 0.00 0.00 177.57 176.76 1u3d h ARG 262 N 0.00 0.55 -0.29 5.19 3.08 -1.91 0.20 114.38 121.20 1u3d h ARG 262 Ca -0.00 -0.37 -0.11 0.00 0.07 0.00 0.00 59.98 59.58 1u3d h ARG 262 Cb 0.16 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.25 1u3d h ARG 262 CO 0.00 0.98 -0.24 -0.22 -1.07 0.00 0.00 179.97 179.43 1u3d h LYS 263 N 0.41 0.67 -0.32 0.04 3.64 -1.34 -1.34 116.57 118.32 1u3d h LYS 263 Ca -0.00 -0.34 0.04 0.00 -1.27 0.00 0.00 60.65 59.08 1u3d h LYS 263 Cb 1.15 0.00 -0.04 0.00 -0.41 0.00 0.00 32.23 32.93 1u3d h LYS 263 CO 0.11 0.94 0.10 0.28 -2.27 0.00 0.00 179.45 178.61 1u3d h VAL 264 N 0.41 0.89 -0.70 2.00 2.07 -0.82 -0.81 116.25 119.29 1u3d h VAL 264 Ca 0.05 -0.08 -0.01 0.00 0.82 0.00 0.00 66.70 67.49 1u3d h VAL 264 Cb 0.79 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 31.17 1u3d h VAL 264 CO 0.06 0.04 0.42 0.15 0.02 0.00 0.00 177.57 178.26 1u3d h PHE 265 N 0.23 0.93 0.13 1.57 3.57 -0.54 -1.44 116.94 121.39 1u3d h PHE 265 Ca 0.15 -0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.64 1u3d h PHE 265 Cb 0.13 -0.30 0.00 0.00 2.79 0.00 0.00 35.95 38.57 1u3d h PHE 265 CO -0.15 0.63 -0.06 1.25 -2.23 0.00 0.00 178.31 177.75 1u3d h HIS 266 N 0.96 -0.16 -0.83 0.41 2.76 -0.74 0.20 115.15 117.75 1u3d h HIS 266 Ca 0.25 -0.00 0.03 0.00 -2.20 0.00 0.00 60.37 58.44 1u3d h HIS 266 Cb -0.02 0.05 -0.05 0.00 1.55 0.00 0.00 27.41 28.95 1u3d h HIS 266 CO -0.01 0.03 0.55 -0.07 -1.30 0.00 0.00 177.93 177.13 1u3d h LEU 267 N -0.32 0.91 -0.31 0.26 3.38 -1.07 -0.71 115.31 117.45 1u3d h LEU 267 Ca -0.02 -0.02 -0.20 0.00 0.09 0.00 0.00 57.88 57.74 1u3d h LEU 267 Cb 0.26 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.80 1u3d h LEU 267 CO 0.03 0.64 -0.72 0.58 0.09 0.00 0.00 178.44 179.06 1u3d h VAL 268 N 1.07 1.32 -0.25 1.22 2.07 -1.05 -2.09 116.25 118.54 1u3d h VAL 268 Ca 0.32 -2.01 -0.07 0.00 0.82 0.00 0.00 66.70 65.77 1u3d h VAL 268 Cb -0.02 1.99 -0.01 0.00 -1.52 0.00 0.00 31.29 31.72 1u3d h VAL 268 CO -0.09 0.62 -0.13 -0.09 0.02 0.00 0.00 177.57 177.91 1u3d h ARG 269 N 0.43 0.42 -0.31 1.57 9.65 -0.04 -0.63 114.38 125.47 1u3d h ARG 269 Ca -0.03 -0.12 -0.14 0.00 -1.10 0.00 0.00 59.98 58.59 1u3d h ARG 269 Cb 1.32 -0.05 -0.00 0.00 -1.39 0.00 0.00 29.97 29.84 1u3d h ARG 269 CO 0.14 0.55 -0.37 0.82 2.80 0.00 0.00 179.97 183.91 1u3d h ILE 270 N 0.39 1.29 -0.38 1.20 1.08 -0.82 -2.51 117.51 117.76 1u3d h ILE 270 Ca 0.07 -1.55 -0.02 0.00 -0.39 0.00 0.00 64.86 62.98 1u3d h ILE 270 Cb 0.47 1.55 -0.02 0.00 -3.07 0.00 0.00 36.82 35.75 1u3d h ILE 270 CO 0.03 0.50 0.15 0.50 -0.69 0.00 0.00 178.15 178.64 1u3d h LYS 271 N 0.57 0.57 -0.71 2.37 1.63 -1.17 -2.20 116.57 117.63 1u3d h LYS 271 Ca 0.04 -0.10 0.10 0.00 -0.85 0.00 0.00 60.65 59.84 1u3d h LYS 271 Cb 0.96 -0.09 -0.07 0.00 -0.60 0.00 0.00 32.23 32.42 1u3d h LYS 271 CO 0.09 0.55 0.34 0.37 -3.45 0.00 0.00 179.45 177.35 1u3d h GLN 272 N 0.47 0.56 -0.43 1.90 4.15 -1.04 0.11 115.11 120.83 1u3d h GLN 272 Ca 0.13 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.49 1u3d h GLN 272 Cb 0.19 -0.13 -0.02 0.00 0.21 0.00 0.00 27.48 27.73 1u3d h GLN 272 CO -0.01 0.37 0.19 0.28 -1.93 0.00 0.00 178.83 177.73 1u3d h VAL 273 N 0.58 1.19 -0.45 2.39 2.07 -1.14 0.12 116.25 121.00 1u3d h VAL 273 Ca 0.36 -0.56 -0.03 0.00 0.82 0.00 0.00 66.70 67.29 1u3d h VAL 273 Cb 0.40 0.76 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1u3d h VAL 273 CO -0.29 0.21 0.16 0.00 0.02 0.00 0.00 177.57 177.68 1u3d h ALA 274 N 1.04 1.45 0.00 1.67 0.00 -0.78 -1.72 119.26 120.92 1u3d h ALA 274 Ca 0.15 -0.13 -0.18 0.00 0.00 0.00 0.00 54.91 54.75 1u3d h ALA 274 Cb 0.15 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.73 1u3d h ALA 274 CO -0.02 0.41 -0.88 -1.49 0.00 0.00 0.00 179.25 177.28 1u3d h TRP 275 N 0.63 0.00 -0.05 0.00 6.55 -0.28 -2.28 115.95 120.53 1u3d h TRP 275 Ca 0.15 0.00 -0.01 0.00 0.95 0.00 0.00 58.89 59.98 1u3d h TRP 275 Cb 0.15 0.00 -0.00 0.00 -0.86 0.00 0.00 29.16 28.45 1u3d h TRP 275 CO 0.01 0.81 -0.01 0.00 -1.05 0.00 0.00 178.44 178.19 1u3d h ALA 276 N 1.19 0.07 -0.30 1.49 0.00 -0.51 -1.16 119.26 120.04 1u3d h ALA 276 Ca -0.03 -0.20 0.07 0.00 0.00 0.00 0.00 54.91 54.75 1u3d h ALA 276 Cb 1.64 -0.02 -0.08 0.00 0.00 0.00 0.00 17.79 19.34 1u3d h ALA 276 CO 0.10 -0.22 -0.24 -0.97 0.00 0.00 0.00 179.25 177.92 1u3d h ASN 277 N -0.24 -0.79 0.34 0.00 -1.24 -1.33 0.19 115.58 112.51 1u3d h ASN 277 Ca 0.01 0.15 0.00 0.00 0.71 0.00 0.00 56.30 57.17 1u3d h ASN 277 Cb 0.40 0.38 0.00 0.00 0.73 0.00 0.00 38.32 39.83 1u3d h ASN 277 CO 0.00 -0.27 0.00 -0.33 -1.29 0.00 0.00 177.43 175.54 1u3d h GLU 278 N -0.22 0.00 -2.68 6.67 5.08 -1.30 -3.46 114.58 118.68 1u3d h GLU 278 Ca 0.16 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.25 1u3d h GLU 278 Cb 0.46 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.73 1u3d h GLU 278 CO -0.43 0.00 -0.38 0.41 -1.00 0.00 0.00 179.01 177.61 1u3d n GLY 279 N -0.70 -0.12 3.45 -3.84 0.00 0.67 -4.95 105.19 99.68 1u3d n GLY 279 Ca 0.00 -0.24 -0.43 0.00 0.00 0.00 0.00 46.02 45.35 1u3d n GLY 279 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1u3d s ASN 280 N -2.67 6.17 0.28 1.61 3.84 -0.67 -4.92 114.94 118.57 1u3d s ASN 280 Ca 0.13 -1.02 0.00 0.00 0.21 0.00 0.00 52.86 52.18 1u3d s ASN 280 Cb -0.06 -2.41 0.40 0.00 -0.55 0.00 0.00 41.25 38.63 1u3d s ASN 280 CO 0.16 -1.42 1.76 -0.33 -2.79 0.00 0.00 177.10 174.48 1u3d h GLU 281 N 9.54 0.64 -0.13 0.43 5.08 -1.93 -2.66 114.58 125.55 1u3d h GLU 281 Ca -0.29 -0.19 -0.01 0.00 -1.00 0.00 0.00 59.36 57.87 1u3d h GLU 281 Cb 1.07 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 30.25 1u3d h GLU 281 CO 1.18 0.73 0.05 0.00 -1.00 0.00 0.00 179.01 179.97 1u3d h ALA 282 N 1.30 0.17 -0.32 3.43 0.00 -1.91 -2.26 119.26 119.67 1u3d h ALA 282 Ca 0.11 -0.10 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1u3d h ALA 282 Cb 0.52 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 18.20 1u3d h ALA 282 CO 0.03 -0.24 -0.10 0.78 0.00 0.00 0.00 179.25 179.72 1u3d h GLY 283 N 0.05 0.20 0.89 0.00 0.00 -1.71 0.45 103.07 102.95 1u3d h GLY 283 Ca 0.04 0.13 0.01 0.00 0.00 0.00 0.00 47.33 47.51 1u3d h GLY 283 CO -0.00 -0.13 0.01 0.83 0.00 0.00 0.00 176.54 177.25 1u3d h GLU 284 N -0.03 0.05 -0.48 4.80 5.08 -1.38 0.18 114.58 122.80 1u3d h GLU 284 Ca 0.16 -0.00 0.04 0.00 -1.00 0.00 0.00 59.36 58.55 1u3d h GLU 284 Cb 0.27 -0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.46 1u3d h GLU 284 CO -0.34 0.03 0.25 1.49 -1.00 0.00 0.00 179.01 179.44 1u3d h GLU 285 N 0.05 0.47 -0.76 2.33 4.81 -1.00 0.31 114.58 120.80 1u3d h GLU 285 Ca 0.04 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 1u3d h GLU 285 Cb 0.04 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.28 1u3d h GLU 285 CO -0.06 0.31 0.34 0.77 -0.73 0.00 0.00 179.01 179.65 1u3d h SER 286 N 0.49 1.00 -0.57 1.04 0.02 -0.54 -1.32 113.55 113.66 1u3d h SER 286 Ca 0.21 -0.13 -0.06 0.00 -0.84 0.00 0.00 61.79 60.98 1u3d h SER 286 Cb 0.11 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 1u3d h SER 286 CO -0.14 0.86 0.14 0.58 -1.14 0.00 0.00 176.83 177.13 1u3d h VAL 287 N 1.08 1.25 -0.38 2.27 2.07 0.49 -0.80 116.25 122.23 1u3d h VAL 287 Ca 0.26 -0.89 -0.02 0.00 0.82 0.00 0.00 66.70 66.87 1u3d h VAL 287 Cb 0.14 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.63 1u3d h VAL 287 CO -0.03 0.33 0.14 0.78 0.02 0.00 0.00 177.57 178.81 1u3d h ASN 288 N 0.82 0.53 -0.50 0.57 2.35 0.12 -0.93 115.58 118.54 1u3d h ASN 288 Ca 0.18 -0.18 -0.09 0.00 -0.55 0.00 0.00 56.30 55.66 1u3d h ASN 288 Cb 0.34 -0.14 -0.02 0.00 0.05 0.00 0.00 38.32 38.56 1u3d h ASN 288 CO 0.00 0.56 -0.05 0.25 -1.65 0.00 0.00 177.43 176.55 1u3d h LEU 289 N 0.47 0.91 -0.79 1.61 6.46 -1.11 -1.37 115.31 121.50 1u3d h LEU 289 Ca 0.13 -0.33 -0.05 0.00 -0.12 0.00 0.00 57.88 57.51 1u3d h LEU 289 Cb 0.20 -0.25 -0.03 0.00 -0.73 0.00 0.00 40.66 39.85 1u3d h LEU 289 CO -0.01 1.02 0.31 0.15 -0.62 0.00 0.00 178.44 179.30 1u3d h PHE 290 N 0.78 1.20 0.00 1.25 3.57 -1.04 -1.09 116.94 121.61 1u3d h PHE 290 Ca 0.14 -0.09 -0.07 0.00 3.53 0.00 0.00 57.97 61.48 1u3d h PHE 290 Cb 0.58 -0.36 -0.01 0.00 2.79 0.00 0.00 35.95 38.96 1u3d h PHE 290 CO 0.04 0.91 -0.33 -0.07 -2.23 0.00 0.00 178.31 176.63 1u3d h LEU 291 N 1.14 0.00 -1.27 0.59 3.38 -1.02 -0.16 115.31 117.98 1u3d h LEU 291 Ca 0.26 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.16 1u3d h LEU 291 Cb 0.22 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.96 1u3d h LEU 291 CO -0.02 0.33 -0.35 0.50 0.09 0.00 0.00 178.44 178.99 1u3d h LYS 292 N 0.00 0.00 -0.17 1.13 3.64 -0.27 0.26 116.57 121.16 1u3d h LYS 292 Ca -0.00 0.00 -0.07 0.00 -1.27 0.00 0.00 60.65 59.31 1u3d h LYS 292 Cb 0.58 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 32.40 1u3d h LYS 292 CO 0.04 0.35 -0.16 0.77 -2.27 0.00 0.00 179.45 178.18 1u3d h SER 293 N 0.00 0.43 -0.75 4.20 0.02 0.15 0.11 113.55 117.70 1u3d h SER 293 Ca -0.00 -0.47 -0.04 0.00 -0.84 0.00 0.00 61.79 60.43 1u3d h SER 293 Cb 0.68 -0.12 -0.03 0.00 0.14 0.00 0.00 62.40 63.07 1u3d h SER 293 CO 0.05 0.81 0.30 0.40 -1.14 0.00 0.00 176.83 177.25 1u3d h ILE 294 N 0.05 1.25 -0.62 3.27 1.08 -1.07 -2.62 117.51 118.85 1u3d h ILE 294 Ca 0.03 -0.80 0.06 0.00 -0.39 0.00 0.00 64.86 63.76 1u3d h ILE 294 Cb 0.69 0.35 -0.06 0.00 -3.07 0.00 0.00 36.82 34.73 1u3d h ILE 294 CO 0.04 0.33 0.32 1.23 -0.69 0.00 0.00 178.15 179.37 1u3d h GLY 295 N 1.13 0.90 1.45 5.37 0.00 -0.19 -1.41 103.07 110.32 1u3d h GLY 295 Ca 0.25 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.34 1u3d h GLY 295 CO -0.02 0.11 0.18 1.41 0.00 0.00 0.00 176.54 178.22 1u3d h LEU 296 N 0.59 0.64 -0.13 3.11 3.38 -0.62 0.14 115.31 122.43 1u3d h LEU 296 Ca 0.28 -0.08 -0.04 0.00 0.09 0.00 0.00 57.88 58.14 1u3d h LEU 296 Cb 0.22 -0.17 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1u3d h LEU 296 CO -0.20 0.60 -0.07 -0.09 0.09 0.00 0.00 178.44 178.76 1u3d h ARG 297 N 0.70 0.28 -0.92 1.13 2.43 -1.11 -1.52 114.38 115.36 1u3d h ARG 297 Ca 0.17 -0.12 0.10 0.00 -0.81 0.00 0.00 59.98 59.32 1u3d h ARG 297 Cb 0.17 -0.01 -0.08 0.00 -0.42 0.00 0.00 29.97 29.63 1u3d h ARG 297 CO -0.01 0.62 0.56 0.93 -1.51 0.00 0.00 179.97 180.56 1u3d h GLU 298 N -0.08 0.88 0.00 0.20 4.39 -0.81 -0.74 114.58 118.43 1u3d h GLU 298 Ca 0.03 -0.05 -0.05 0.00 0.34 0.00 0.00 59.36 59.63 1u3d h GLU 298 Cb 0.55 -0.20 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1u3d h GLU 298 CO 0.02 0.59 -0.22 -0.92 -1.16 0.00 0.00 179.01 177.32 1u3d h TYR 299 N 0.91 0.00 -0.09 4.33 3.20 -0.45 -2.30 116.97 122.57 1u3d h TYR 299 Ca 0.45 0.00 -0.13 0.00 3.14 0.00 0.00 58.73 62.19 1u3d h TYR 299 Cb 0.41 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.67 1u3d h TYR 299 CO -0.03 0.22 -0.52 0.66 -1.64 0.00 0.00 178.16 176.85 1u3d h SER 300 N 0.00 0.27 -0.24 -2.11 4.64 -0.08 -1.69 113.55 114.35 1u3d h SER 300 Ca -0.00 -0.14 -0.19 0.00 -0.47 0.00 0.00 61.79 60.99 1u3d h SER 300 Cb 0.55 -0.08 0.00 0.00 -0.31 0.00 0.00 62.40 62.56 1u3d h SER 300 CO 0.03 0.74 -0.57 0.03 -0.87 0.00 0.00 176.83 176.20 1u3d h ARG 301 N 0.20 0.83 -0.25 4.77 -0.00 -1.27 -2.54 114.38 116.12 1u3d h ARG 301 Ca 0.01 -0.54 0.04 0.00 -0.50 0.00 0.00 59.98 58.99 1u3d h ARG 301 Cb 0.98 0.07 -0.04 0.00 0.00 0.00 0.00 29.97 30.98 1u3d h ARG 301 CO 0.08 1.17 0.01 -0.92 0.00 0.00 0.00 179.97 180.31 1u3d h TYR 302 N 0.63 0.01 -0.60 3.04 3.20 -1.05 -1.60 116.97 120.60 1u3d h TYR 302 Ca 0.01 0.02 -0.08 0.00 3.14 0.00 0.00 58.73 61.82 1u3d h TYR 302 Cb 1.17 0.03 -0.02 0.00 1.54 0.00 0.00 36.73 39.45 1u3d h TYR 302 CO 0.07 -0.03 0.07 0.82 -1.64 0.00 0.00 178.16 177.45 1u3d h ILE 303 N 0.09 1.26 -0.10 1.81 2.04 -1.34 -1.72 117.51 119.55 1u3d h ILE 303 Ca 0.12 -1.03 -0.10 0.00 1.00 0.00 0.00 64.86 64.84 1u3d h ILE 303 Cb 0.15 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 36.94 1u3d h ILE 303 CO -0.19 0.38 -0.41 -1.28 0.00 0.00 0.00 178.15 176.65 1u3d h SER 304 N 0.93 0.22 0.23 1.72 0.87 -1.05 -2.00 113.55 114.47 1u3d h SER 304 Ca 0.18 -0.09 -0.31 0.00 -1.23 0.00 0.00 61.79 60.34 1u3d h SER 304 Cb 0.45 -0.06 0.03 0.00 -0.44 0.00 0.00 62.40 62.38 1u3d h SER 304 CO 0.02 0.61 -1.32 0.15 -0.53 0.00 0.00 176.83 175.76 1u3d h PHE 305 N 0.18 0.95 -0.29 2.24 3.57 -1.17 -3.23 116.94 119.18 1u3d h PHE 305 Ca 0.02 -0.63 0.00 0.00 3.53 0.00 0.00 57.97 60.88 1u3d h PHE 305 Cb 0.80 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.48 1u3d h PHE 305 CO 0.01 1.48 0.00 0.09 -2.23 0.00 0.00 178.31 177.66 1u3d n ASN 306 N -3.74 1.61 -2.77 0.41 3.02 -0.66 -4.22 115.26 108.90 1u3d n ASN 306 Ca -0.14 -2.01 -0.06 0.00 -0.03 0.00 0.00 54.58 52.34 1u3d n ASN 306 Cb 1.03 -0.21 0.02 0.00 -0.61 0.00 0.00 39.78 40.01 1u3d n ASN 306 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 1u3d n HIS 307 N 0.36 -3.61 0.00 3.10 8.25 -0.76 -5.03 115.22 117.53 1u3d n HIS 307 Ca 0.10 -1.54 0.00 0.00 -0.26 0.00 0.00 57.72 56.02 1u3d n HIS 307 Cb 0.26 1.49 0.00 0.00 1.12 0.00 0.00 29.99 32.86 1u3d n HIS 307 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1u3d n PRO 308 N 2.45 0.00 -0.24 -0.41 -0.02 -1.22 -1.48 135.00 134.07 1u3d n PRO 308 Ca 0.15 0.00 0.08 0.00 -2.02 0.00 0.00 63.50 61.71 1u3d n PRO 308 Cb 0.58 -1.47 0.15 0.00 -0.02 0.00 0.00 33.50 32.74 1u3d n PRO 308 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1u3d n TYR 309 N -0.90 0.00 0.02 6.00 4.01 -1.26 -4.68 117.16 120.35 1u3d n TYR 309 Ca 0.00 -1.08 0.22 0.00 -0.16 0.00 0.00 57.90 56.89 1u3d n TYR 309 Cb 0.00 -0.17 0.72 0.00 -0.31 0.00 0.00 39.34 39.58 1u3d n TYR 309 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1u3d h SER 310 N 0.26 0.00 0.38 7.72 4.64 -1.42 0.29 113.55 125.43 1u3d h SER 310 Ca -0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u3d h SER 310 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1u3d h SER 310 CO 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 1u3d n HIS 311 N -3.82 0.00 0.00 4.77 1.44 -1.26 -4.16 115.22 112.19 1u3d n HIS 311 Ca 0.10 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.81 1u3d n HIS 311 Cb 0.74 -0.27 0.00 0.00 0.12 0.00 0.00 29.99 30.58 1u3d n HIS 311 CO 0.00 0.00 0.00 0.39 -2.81 0.00 0.00 176.34 173.92 1u3d n GLU 312 N -1.27 0.00 -3.61 -1.40 1.02 -0.53 -4.99 120.64 109.87 1u3d n GLU 312 Ca 0.11 0.00 -0.36 0.00 -0.02 0.00 0.00 57.16 56.89 1u3d n GLU 312 Cb 0.17 -0.46 -0.07 0.00 -0.02 0.00 0.00 31.44 31.05 1u3d n GLU 312 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1u3d s ARG 313 N -1.00 4.23 0.39 3.49 1.81 0.92 -5.02 118.95 123.77 1u3d s ARG 313 Ca 0.00 -0.02 -0.19 0.00 -1.72 0.00 0.00 55.73 53.80 1u3d s ARG 313 Cb 0.00 -3.42 -0.10 0.00 -0.45 0.00 0.00 34.95 30.98 1u3d s ARG 313 CO 0.00 0.26 0.88 -1.25 -0.68 0.00 0.00 175.30 174.51 1u3d s PRO 314 N 0.42 4.17 0.01 3.54 0.04 -1.26 -4.15 135.00 137.76 1u3d s PRO 314 Ca 0.14 0.97 -0.25 0.00 0.04 0.00 0.00 61.00 61.90 1u3d s PRO 314 Cb -0.12 -2.30 -0.17 0.00 0.04 0.00 0.00 34.50 31.95 1u3d s PRO 314 CO 0.02 0.05 1.26 -0.07 0.04 0.00 0.00 177.00 178.30 1u3d h LEU 315 N 2.09 -0.27 -9.74 -3.56 3.38 -1.94 -3.43 115.31 101.85 1u3d h LEU 315 Ca -0.49 -0.22 -0.57 0.00 0.09 0.00 0.00 57.88 56.70 1u3d h LEU 315 Cb 1.18 0.07 -0.04 0.00 0.09 0.00 0.00 40.66 41.96 1u3d h LEU 315 CO 0.63 0.10 -0.03 -0.76 0.09 0.00 0.00 178.44 178.47 1u3d s LEU 316 N -9.49 4.48 -0.05 1.67 1.43 -0.46 -4.98 118.68 111.28 1u3d s LEU 316 Ca -0.14 1.25 0.12 0.00 -1.03 0.00 0.00 54.13 54.33 1u3d s LEU 316 Cb 0.02 -3.03 0.36 0.00 0.03 0.00 0.00 46.19 43.58 1u3d s LEU 316 CO 0.57 0.22 1.29 0.61 0.23 0.00 0.00 176.35 179.28 1u3d n GLY 317 N 1.47 3.14 0.17 -3.19 0.00 -1.26 -4.59 105.19 100.92 1u3d n GLY 317 Ca -0.09 -0.55 0.13 0.00 0.00 0.00 0.00 46.02 45.50 1u3d n GLY 317 CO 0.00 0.00 0.00 1.12 0.00 0.00 0.00 173.32 174.44 1u3d h HIS 318 N 1.90 0.00 -0.48 1.61 2.07 -1.95 -1.05 115.15 117.25 1u3d h HIS 318 Ca 0.00 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.44 1u3d h HIS 318 Cb 0.93 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.86 1u3d h HIS 318 CO 0.30 0.00 0.07 1.28 -3.07 0.00 0.00 177.93 176.51 1u3d n LEU 319 N -2.36 4.96 -0.00 6.12 4.77 -1.26 -4.74 117.00 124.48 1u3d n LEU 319 Ca 0.00 -3.15 -0.10 0.00 -0.03 0.00 0.00 56.01 52.73 1u3d n LEU 319 Cb 0.13 -0.64 -0.05 0.00 -2.33 0.00 0.00 43.42 40.53 1u3d n LEU 319 CO 0.16 0.77 0.86 0.50 -1.33 0.00 0.00 177.39 178.35 1u3d h LYS 320 N 2.42 0.03 -0.78 3.23 3.64 -1.52 -2.70 116.57 120.88 1u3d h LYS 320 Ca 0.10 -0.00 -0.11 0.00 -1.27 0.00 0.00 60.65 59.37 1u3d h LYS 320 Cb 1.85 -0.01 -0.07 0.00 -0.41 0.00 0.00 32.23 33.59 1u3d h LYS 320 CO 0.45 0.02 0.14 1.19 -2.27 0.00 0.00 179.45 178.98 1u3d n PHE 321 N -5.12 1.75 -2.22 1.91 3.72 -1.26 -4.94 117.46 111.30 1u3d n PHE 321 Ca -0.05 -0.81 -0.42 0.00 -0.05 0.00 0.00 57.45 56.12 1u3d n PHE 321 Cb 0.07 -0.51 -0.03 0.00 -0.94 0.00 0.00 39.48 38.07 1u3d n PHE 321 CO 0.00 0.00 0.00 0.12 -0.05 0.00 0.00 176.76 176.83 1u3d s PHE 322 N -2.33 3.05 -1.22 1.38 5.36 -1.02 -4.34 117.98 118.86 1u3d s PHE 322 Ca 0.41 0.91 -0.19 0.00 -0.96 0.00 0.00 56.93 57.09 1u3d s PHE 322 Cb 0.32 -3.65 -0.02 0.00 -0.34 0.00 0.00 43.02 39.33 1u3d s PHE 322 CO 0.11 -2.32 1.90 -0.35 -1.46 0.00 0.00 175.22 173.10 1u3d n PRO 323 N 4.70 2.42 -2.01 10.12 -0.04 -1.26 -4.98 135.00 143.95 1u3d n PRO 323 Ca 0.12 -2.72 -0.42 0.00 -0.04 0.00 0.00 63.50 60.44 1u3d n PRO 323 Cb 0.43 -3.46 -0.03 0.00 -0.04 0.00 0.00 33.50 30.41 1u3d n PRO 323 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 1u3d s TRP 324 N 6.26 3.08 0.29 0.54 0.52 -1.26 -4.96 118.94 123.41 1u3d s TRP 324 Ca 0.58 0.84 -0.30 0.00 0.02 0.00 0.00 56.10 57.24 1u3d s TRP 324 Cb 0.06 -3.84 -0.10 0.00 -1.15 0.00 0.00 33.47 28.43 1u3d s TRP 324 CO 0.08 -2.94 1.46 0.00 0.02 0.00 0.00 176.95 175.57 1u3d s ALA 325 N 0.69 3.63 -0.19 0.98 0.00 0.71 -4.89 121.76 122.68 1u3d s ALA 325 Ca 0.65 1.40 0.15 0.00 0.00 0.00 0.00 51.96 54.15 1u3d s ALA 325 Cb -0.42 -3.57 0.42 0.00 0.00 0.00 0.00 23.12 19.55 1u3d s ALA 325 CO 0.36 -0.82 1.30 1.55 0.00 0.00 0.00 175.76 178.15 1u3d n VAL 326 N 1.85 2.20 -1.72 0.00 3.14 -1.26 -3.95 118.33 118.59 1u3d n VAL 326 Ca 0.05 -2.47 -0.42 0.00 -2.96 0.00 0.00 64.34 58.53 1u3d n VAL 326 Cb 0.40 -0.26 -0.03 0.00 -1.06 0.00 0.00 33.84 32.89 1u3d n VAL 326 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 1u3d s ASP 327 N -2.65 5.50 0.32 6.55 -1.08 -1.26 -4.91 116.67 119.14 1u3d s ASP 327 Ca 0.38 1.64 0.01 0.00 -0.52 0.00 0.00 52.55 54.06 1u3d s ASP 327 Cb 0.34 -2.51 0.52 0.00 -1.46 0.00 0.00 42.92 39.81 1u3d s ASP 327 CO 0.02 -1.96 1.93 -0.33 0.52 0.00 0.00 175.17 175.34 1u3d h GLU 328 N 14.77 0.83 0.00 4.34 4.39 -2.00 -1.96 114.58 134.96 1u3d h GLU 328 Ca -0.38 -0.10 0.00 0.00 0.34 0.00 0.00 59.36 59.22 1u3d h GLU 328 Cb 1.22 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1u3d h GLU 328 CO 1.00 0.64 -0.20 0.27 -1.16 0.00 0.00 179.01 179.56 1u3d n ASN 329 N -4.36 0.28 -0.13 1.42 0.23 -1.26 -1.48 115.26 109.96 1u3d n ASN 329 Ca 0.05 0.25 -0.12 0.00 -0.53 0.00 0.00 54.58 54.23 1u3d n ASN 329 Cb 0.13 -0.25 -0.02 0.00 -2.08 0.00 0.00 39.78 37.56 1u3d n ASN 329 CO 0.00 0.00 0.00 1.88 -0.93 0.00 0.00 177.26 178.21 1u3d h TYR 330 N 0.00 0.94 0.32 -2.53 -1.99 -1.78 -0.42 116.97 111.51 1u3d h TYR 330 Ca 0.00 -0.24 -0.02 0.00 2.00 0.00 0.00 58.73 60.48 1u3d h TYR 330 Cb 0.54 -0.22 0.00 0.00 2.00 0.00 0.00 36.73 39.06 1u3d h TYR 330 CO 0.00 0.99 -0.15 0.35 -0.00 0.00 0.00 178.16 179.35 1u3d h PHE 331 N 0.61 -0.39 -0.60 4.88 3.57 -1.10 -1.44 116.94 122.47 1u3d h PHE 331 Ca 0.08 -0.01 0.07 0.00 3.53 0.00 0.00 57.97 61.65 1u3d h PHE 331 Cb 0.75 0.13 -0.06 0.00 2.79 0.00 0.00 35.95 39.56 1u3d h PHE 331 CO 0.06 -0.19 0.28 -0.22 -2.23 0.00 0.00 178.31 176.01 1u3d h LYS 332 N -0.51 0.50 -0.91 1.11 3.64 -1.18 -0.31 116.57 118.91 1u3d h LYS 332 Ca -0.04 -0.03 0.01 0.00 -1.27 0.00 0.00 60.65 59.32 1u3d h LYS 332 Cb 0.38 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.05 1u3d h LYS 332 CO 0.07 0.33 0.60 0.00 -2.27 0.00 0.00 179.45 178.18 1u3d h ALA 333 N 1.36 1.35 0.09 5.00 0.00 -0.77 0.06 119.26 126.34 1u3d h ALA 333 Ca 0.28 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.13 1u3d h ALA 333 Cb 0.26 -0.37 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1u3d h ALA 333 CO -0.23 0.60 -0.04 2.35 0.00 0.00 0.00 179.25 181.93 1u3d h TRP 334 N 1.23 -0.11 -0.76 0.00 7.01 -0.13 0.41 115.95 123.60 1u3d h TRP 334 Ca 0.33 -0.00 0.05 0.00 2.11 0.00 0.00 58.89 61.38 1u3d h TRP 334 Cb -0.14 0.04 -0.05 0.00 -2.10 0.00 0.00 29.16 26.91 1u3d h TRP 334 CO -0.00 0.10 0.50 0.00 -2.79 0.00 0.00 178.44 176.25 1u3d h ARG 335 N -0.31 0.84 0.00 2.65 3.08 -0.60 -2.23 114.38 117.82 1u3d h ARG 335 Ca -0.01 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 59.99 1u3d h ARG 335 Cb 0.26 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 30.12 1u3d h ARG 335 CO 0.02 0.56 -0.33 1.04 -1.07 0.00 0.00 179.97 180.19 1u3d n GLN 336 N -4.47 0.24 -2.44 0.04 6.02 -0.04 -4.81 117.38 111.93 1u3d n GLN 336 Ca 0.10 0.12 -0.06 0.00 -0.01 0.00 0.00 57.00 57.16 1u3d n GLN 336 Cb 0.17 -1.71 0.03 0.00 1.02 0.00 0.00 30.24 29.75 1u3d n GLN 336 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1u3d n GLY 337 N 1.35 0.17 2.57 1.08 0.00 -0.23 -4.79 105.19 105.34 1u3d n GLY 337 Ca 0.05 -0.25 -0.19 0.00 0.00 0.00 0.00 46.02 45.63 1u3d n GLY 337 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1u3d n ARG 338 N -2.06 2.19 -0.04 1.61 1.74 0.13 -4.75 116.66 115.47 1u3d n ARG 338 Ca -0.09 -3.91 0.03 0.00 -0.77 0.00 0.00 57.85 53.11 1u3d n ARG 338 Cb 0.56 -1.78 -0.16 0.00 -1.02 0.00 0.00 32.46 30.05 1u3d n ARG 338 CO 0.00 0.00 0.00 0.25 -1.52 0.00 0.00 177.63 176.36 1u3d n THR 339 N -0.19 0.55 0.00 0.55 -2.24 -1.26 -4.74 114.28 106.95 1u3d n THR 339 Ca 0.24 -0.64 0.00 0.00 -2.27 0.00 0.00 64.05 61.39 1u3d n THR 339 Cb 0.69 -0.19 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 1u3d n THR 339 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u3d n GLY 340 N 1.44 2.03 3.41 3.38 0.00 -1.26 -0.35 105.19 113.84 1u3d n GLY 340 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1u3d n GLY 340 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1u3d s TYR 341 N -2.45 3.25 0.22 1.61 1.51 -1.26 -4.48 117.35 115.74 1u3d s TYR 341 Ca 0.00 -0.83 -0.19 0.00 -1.01 0.00 0.00 57.07 55.04 1u3d s TYR 341 Cb 0.00 -2.62 0.19 0.00 -0.11 0.00 0.00 41.96 39.43 1u3d s TYR 341 CO 0.00 -0.65 1.56 -1.35 -1.11 0.00 0.00 175.55 174.00 1u3d h PRO 342 N 8.56 -0.03 -0.65 -1.71 0.11 -1.84 -0.93 132.00 135.50 1u3d h PRO 342 Ca -0.26 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.83 1u3d h PRO 342 Cb 1.11 0.01 -0.03 0.00 0.11 0.00 0.00 31.00 32.20 1u3d h PRO 342 CO 0.72 -0.02 0.31 1.25 -0.21 0.00 0.00 178.00 180.05 1u3d h LEU 343 N -0.04 0.83 -0.49 2.35 5.85 -1.90 0.20 115.31 122.12 1u3d h LEU 343 Ca 0.31 -0.09 -0.10 0.00 0.84 0.00 0.00 57.88 58.84 1u3d h LEU 343 Cb 0.58 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1u3d h LEU 343 CO -0.93 0.71 -0.10 0.58 -0.34 0.00 0.00 178.44 178.36 1u3d h VAL 344 N 0.92 1.27 -0.02 1.05 2.07 -1.61 -2.42 116.25 117.51 1u3d h VAL 344 Ca 0.23 -1.23 -0.16 0.00 0.82 0.00 0.00 66.70 66.36 1u3d h VAL 344 Cb 0.10 1.05 -0.02 0.00 -1.52 0.00 0.00 31.29 30.91 1u3d h VAL 344 CO -0.03 0.43 -0.72 0.44 0.02 0.00 0.00 177.57 177.71 1u3d h ASP 345 N 0.79 0.15 -0.38 0.57 3.32 -0.66 -2.38 116.42 117.82 1u3d h ASP 345 Ca 0.13 -0.10 -0.03 0.00 0.02 0.00 0.00 57.03 57.05 1u3d h ASP 345 Cb 0.65 -0.04 -0.02 0.00 0.22 0.00 0.00 39.33 40.14 1u3d h ASP 345 CO 0.04 0.81 0.12 0.00 -1.72 0.00 0.00 179.24 178.50 1u3d h ALA 346 N 1.18 0.50 -0.56 3.45 0.00 -0.52 -1.49 119.26 121.83 1u3d h ALA 346 Ca -0.02 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.73 1u3d h ALA 346 Cb 1.27 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.88 1u3d h ALA 346 CO 0.10 0.14 0.36 0.78 0.00 0.00 0.00 179.25 180.64 1u3d h GLY 347 N 0.47 0.80 1.75 0.00 0.00 -1.32 0.13 103.07 104.91 1u3d h GLY 347 Ca 0.12 -0.31 -0.06 0.00 0.00 0.00 0.00 47.33 47.08 1u3d h GLY 347 CO -0.00 0.30 -0.15 -0.33 0.00 0.00 0.00 176.54 176.36 1u3d h MET 348 N 0.76 0.30 -0.13 4.80 2.07 -1.29 0.76 114.93 122.21 1u3d h MET 348 Ca 0.20 -0.08 -0.08 0.00 -2.07 0.00 0.00 59.70 57.68 1u3d h MET 348 Cb -0.06 -0.04 0.00 0.00 -1.87 0.00 0.00 31.60 29.63 1u3d h MET 348 CO -0.04 0.45 -0.23 0.00 1.07 0.00 0.00 176.91 178.17 1u3d h ARG 349 N 0.28 0.38 -0.46 1.72 2.47 -0.46 -0.09 114.38 118.23 1u3d h ARG 349 Ca 0.05 -0.24 -0.05 0.00 -1.26 0.00 0.00 59.98 58.49 1u3d h ARG 349 Cb 0.44 0.03 -0.02 0.00 -1.65 0.00 0.00 29.97 28.76 1u3d h ARG 349 CO 0.03 0.83 0.10 1.49 0.56 0.00 0.00 179.97 182.97 1u3d h GLU 350 N -0.03 0.70 -0.28 0.04 4.81 -0.46 -0.06 114.58 119.30 1u3d h GLU 350 Ca 0.01 -0.14 -0.09 0.00 -0.13 0.00 0.00 59.36 59.01 1u3d h GLU 350 Cb 0.80 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 1u3d h GLU 350 CO 0.05 0.65 -0.17 1.25 -0.73 0.00 0.00 179.01 180.06 1u3d h LEU 351 N 0.68 0.64 -0.72 1.64 5.85 -0.71 0.16 115.31 122.84 1u3d h LEU 351 Ca 0.15 -0.43 -0.09 0.00 0.84 0.00 0.00 57.88 58.36 1u3d h LEU 351 Cb 0.28 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.11 1u3d h LEU 351 CO -0.00 0.93 0.03 -0.25 -0.34 0.00 0.00 178.44 178.81 1u3d h TRP 352 N 0.35 1.09 0.00 1.25 7.01 -0.50 0.67 115.95 125.82 1u3d h TRP 352 Ca 0.06 -0.17 -0.16 0.00 2.11 0.00 0.00 58.89 60.73 1u3d h TRP 352 Cb 0.70 -0.29 -0.02 0.00 -2.10 0.00 0.00 29.16 27.45 1u3d h TRP 352 CO 0.06 0.96 -0.83 0.00 -2.79 0.00 0.00 178.44 175.84 1u3d h ALA 353 N 1.08 0.53 0.00 2.65 0.00 -0.96 -3.40 119.26 119.16 1u3d h ALA 353 Ca 0.17 -0.73 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1u3d h ALA 353 Cb 0.50 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1u3d h ALA 353 CO 0.02 0.96 -0.13 0.25 0.00 0.00 0.00 179.25 180.35 1u3d n THR 354 N -3.25 0.00 -0.96 0.00 -2.24 0.04 -5.00 114.28 102.86 1u3d n THR 354 Ca -0.00 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.47 1u3d n THR 354 Cb 0.85 0.89 0.00 0.00 -2.10 0.00 0.00 70.33 69.96 1u3d n THR 354 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1u3d n GLY 355 N 0.93 0.50 3.24 3.38 0.00 0.22 -4.86 105.19 108.60 1u3d n GLY 355 Ca 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.75 1u3d n GLY 355 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1u3d s TRP 356 N -2.24 1.85 -0.13 1.61 -0.11 -1.26 -0.95 118.94 117.71 1u3d s TRP 356 Ca 0.00 -0.36 -0.07 0.00 1.22 0.00 0.00 56.10 56.89 1u3d s TRP 356 Cb 0.00 -1.15 0.05 0.00 -1.50 0.00 0.00 33.47 30.87 1u3d s TRP 356 CO 0.00 0.03 0.31 -0.51 -4.62 0.00 0.00 176.95 172.16 1u3d s LEU 357 N -0.82 0.25 0.62 5.86 1.43 -1.26 -4.07 118.68 120.69 1u3d s LEU 357 Ca 0.08 0.67 -0.18 0.00 -1.03 0.00 0.00 54.13 53.67 1u3d s LEU 357 Cb -0.08 1.00 -0.03 0.00 0.03 0.00 0.00 46.19 47.11 1u3d s LEU 357 CO 0.00 -0.17 1.24 -2.28 0.23 0.00 0.00 176.35 175.38 1u3d s HIS 358 N 1.23 2.26 0.28 0.29 5.65 -1.26 -4.82 115.29 118.92 1u3d s HIS 358 Ca -0.09 1.50 0.01 0.00 0.25 0.00 0.00 55.06 56.74 1u3d s HIS 358 Cb -0.09 -3.57 0.57 0.00 -1.18 0.00 0.00 32.58 28.31 1u3d s HIS 358 CO -0.09 -2.51 1.81 0.22 -0.65 0.00 0.00 174.74 173.52 1u3d h ASP 359 N 0.74 0.84 -0.63 9.88 3.58 -1.95 -2.14 116.42 126.74 1u3d h ASP 359 Ca -0.51 0.06 -0.02 0.00 0.42 0.00 0.00 57.03 56.99 1u3d h ASP 359 Cb 1.31 -0.10 -0.03 0.00 1.72 0.00 0.00 39.33 42.23 1u3d h ASP 359 CO 0.54 0.41 0.34 0.03 -2.88 0.00 0.00 179.24 177.69 1u3d h ARG 360 N 0.90 0.90 0.00 0.28 2.47 -1.91 -1.34 114.38 115.69 1u3d h ARG 360 Ca 0.50 -0.10 -0.13 0.00 -1.26 0.00 0.00 59.98 58.99 1u3d h ARG 360 Cb 0.58 -0.18 -0.02 0.00 -1.65 0.00 0.00 29.97 28.70 1u3d h ARG 360 CO -0.30 0.68 -0.62 0.82 0.56 0.00 0.00 179.97 181.12 1u3d h ILE 361 N 0.91 1.44 -0.65 2.04 1.08 -1.76 -0.18 117.51 120.38 1u3d h ILE 361 Ca 0.23 -2.12 -0.05 0.00 -0.39 0.00 0.00 64.86 62.53 1u3d h ILE 361 Cb 0.05 2.14 -0.03 0.00 -3.07 0.00 0.00 36.82 35.92 1u3d h ILE 361 CO -0.03 0.60 0.20 0.03 -0.69 0.00 0.00 178.15 178.26 1u3d h ARG 362 N 0.00 1.02 0.06 2.37 3.08 -0.81 0.28 114.38 120.38 1u3d h ARG 362 Ca -0.01 -0.22 -0.00 0.00 0.07 0.00 0.00 59.98 59.82 1u3d h ARG 362 Cb 1.10 -0.15 0.00 0.00 0.08 0.00 0.00 29.97 31.00 1u3d h ARG 362 CO 0.08 0.90 -0.03 0.28 -1.07 0.00 0.00 179.97 180.13 1u3d h VAL 363 N 0.95 1.14 -0.50 2.04 2.07 -0.89 -1.16 116.25 119.91 1u3d h VAL 363 Ca 0.21 -0.68 0.09 0.00 0.82 0.00 0.00 66.70 67.13 1u3d h VAL 363 Cb 0.30 1.59 -0.07 0.00 -1.52 0.00 0.00 31.29 31.59 1u3d h VAL 363 CO -0.01 0.17 0.09 0.58 0.02 0.00 0.00 177.57 178.42 1u3d h VAL 364 N -0.38 0.71 0.01 2.57 2.07 -0.72 0.25 116.25 120.76 1u3d h VAL 364 Ca -0.01 -0.08 -0.20 0.00 0.82 0.00 0.00 66.70 67.23 1u3d h VAL 364 Cb 0.34 0.47 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 1u3d h VAL 364 CO 0.01 0.04 -0.91 -0.37 0.02 0.00 0.00 177.57 176.36 1u3d h VAL 365 N 0.22 1.51 0.00 2.57 -1.51 -0.40 -2.64 116.25 115.99 1u3d h VAL 365 Ca 0.25 -2.71 -0.16 0.00 -1.23 0.00 0.00 66.70 62.86 1u3d h VAL 365 Cb 0.34 2.53 -0.02 0.00 -2.13 0.00 0.00 31.29 32.01 1u3d h VAL 365 CO -0.34 0.79 -0.76 0.77 -1.23 0.00 0.00 177.57 176.80 1u3d h SER 366 N 0.10 0.00 -0.24 4.19 4.64 -1.03 -2.51 113.55 118.70 1u3d h SER 366 Ca -0.05 0.00 -0.15 0.00 -0.47 0.00 0.00 61.79 61.12 1u3d h SER 366 Cb 1.56 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.65 1u3d h SER 366 CO 0.14 0.76 -0.43 -1.28 -0.87 0.00 0.00 176.83 175.15 1u3d h SER 367 N 0.00 0.79 -0.24 4.97 0.87 -0.48 -2.39 113.55 117.06 1u3d h SER 367 Ca -0.01 -0.54 -0.02 0.00 -1.23 0.00 0.00 61.79 60.00 1u3d h SER 367 Cb 1.36 -0.23 -0.02 0.00 -0.44 0.00 0.00 62.40 63.08 1u3d h SER 367 CO 0.10 1.17 0.11 0.15 -0.53 0.00 0.00 176.83 177.83 1u3d h PHE 368 N 0.43 0.41 -0.62 2.24 3.57 -1.47 -1.05 116.94 120.45 1u3d h PHE 368 Ca 0.01 -0.01 -0.07 0.00 3.53 0.00 0.00 57.97 61.43 1u3d h PHE 368 Cb 1.03 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.61 1u3d h PHE 368 CO 0.08 0.34 0.10 0.35 -2.23 0.00 0.00 178.31 176.95 1u3d h PHE 369 N 0.42 1.09 0.00 0.41 3.57 -0.99 -1.37 116.94 120.07 1u3d h PHE 369 Ca 0.10 -0.15 -0.30 0.00 3.53 0.00 0.00 57.97 61.15 1u3d h PHE 369 Cb 0.11 -0.30 -0.05 0.00 2.79 0.00 0.00 35.95 38.50 1u3d h PHE 369 CO 0.00 0.94 -1.85 1.33 -2.23 0.00 0.00 178.31 176.50 1u3d n VAL 370 N -4.27 1.51 -0.05 1.41 0.24 -0.94 -1.78 118.33 114.45 1u3d n VAL 370 Ca 0.03 -0.80 -0.16 0.00 -2.04 0.00 0.00 64.34 61.37 1u3d n VAL 370 Cb 0.28 -0.87 -0.14 0.00 -1.47 0.00 0.00 33.84 31.64 1u3d n VAL 370 CO 0.00 0.00 0.00 0.29 -2.14 0.00 0.00 176.83 174.98 1u3d n LYS 371 N -2.96 0.70 -0.10 7.34 4.01 -0.44 -3.35 118.16 123.36 1u3d n LYS 371 Ca -0.20 0.21 -0.18 0.00 -0.51 0.00 0.00 58.31 57.62 1u3d n LYS 371 Cb 1.06 -1.66 -0.09 0.00 -0.51 0.00 0.00 35.03 33.83 1u3d n LYS 371 CO 0.00 0.00 0.00 0.28 -1.11 0.00 0.00 177.40 176.57 1u3d n VAL 372 N -3.24 1.51 0.11 -0.18 0.31 -0.56 -4.47 118.33 111.80 1u3d n VAL 372 Ca -0.32 0.01 -0.00 0.00 -0.01 0.00 0.00 64.34 64.01 1u3d n VAL 372 Cb 1.05 -2.11 -0.02 0.00 -0.91 0.00 0.00 33.84 31.84 1u3d n VAL 372 CO 0.00 0.00 0.00 -0.07 -1.32 0.00 0.00 176.83 175.44 1u3d h LEU 373 N -1.00 0.00 -1.37 7.52 3.38 -1.53 -3.47 115.31 118.84 1u3d h LEU 373 Ca -0.29 0.00 -0.41 0.00 0.09 0.00 0.00 57.88 57.27 1u3d h LEU 373 Cb 1.14 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.97 1u3d h LEU 373 CO -0.18 0.64 -0.77 0.00 0.09 0.00 0.00 178.44 178.22 1u3d n GLN 374 N -3.22 -6.11 -2.79 1.13 6.02 -0.74 -4.63 117.38 107.05 1u3d n GLN 374 Ca -0.00 0.71 -0.26 0.00 -0.01 0.00 0.00 57.00 57.44 1u3d n GLN 374 Cb 0.80 -5.56 -0.00 0.00 1.02 0.00 0.00 30.24 26.50 1u3d n GLN 374 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1u3d s LEU 375 N -6.87 3.68 0.14 1.08 1.43 -0.91 -0.21 118.68 117.02 1u3d s LEU 375 Ca 0.27 0.79 -0.31 0.00 -1.03 0.00 0.00 54.13 53.85 1u3d s LEU 375 Cb -0.13 -3.71 -0.10 0.00 0.03 0.00 0.00 46.19 42.28 1u3d s LEU 375 CO 0.78 -0.55 1.60 -2.84 0.23 0.00 0.00 176.35 175.56 1u3d s PRO 376 N -4.66 4.21 0.59 1.29 0.02 -1.25 -4.66 135.00 130.53 1u3d s PRO 376 Ca 0.46 2.36 0.30 0.00 0.02 0.00 0.00 61.00 64.14 1u3d s PRO 376 Cb -0.10 -3.29 1.82 0.00 0.02 0.00 0.00 34.50 32.95 1u3d s PRO 376 CO 0.43 -0.65 2.26 0.11 -0.33 0.00 0.00 177.00 178.82 1u3d h TRP 377 N 7.27 0.00 0.00 6.54 5.08 -1.95 -0.52 115.95 132.36 1u3d h TRP 377 Ca -0.43 0.00 -0.03 0.00 1.08 0.00 0.00 58.89 59.51 1u3d h TRP 377 Cb 1.20 0.00 -0.00 0.00 -3.00 0.00 0.00 29.16 27.36 1u3d h TRP 377 CO 0.69 0.00 -0.17 0.00 -1.28 0.00 0.00 178.44 177.68 1u3d h ARG 378 N 0.00 0.00 -0.39 0.12 2.47 -1.95 -0.29 114.38 114.34 1u3d h ARG 378 Ca -0.00 0.00 -0.15 0.00 -1.26 0.00 0.00 59.98 58.57 1u3d h ARG 378 Cb 0.00 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 28.31 1u3d h ARG 378 CO 0.00 0.17 -0.34 -1.49 0.56 0.00 0.00 179.97 178.86 1u3d h TRP 379 N 0.00 1.06 -0.08 3.04 4.06 -1.46 -0.93 115.95 121.63 1u3d h TRP 379 Ca -0.00 -0.30 -0.16 0.00 2.06 0.00 0.00 58.89 60.49 1u3d h TRP 379 Cb 0.30 -0.23 -0.01 0.00 -1.00 0.00 0.00 29.16 28.22 1u3d h TRP 379 CO 0.00 1.11 -0.64 0.78 -3.56 0.00 0.00 178.44 176.12 1u3d h GLY 380 N 0.85 0.35 0.85 1.49 0.00 -1.50 -1.84 103.07 103.26 1u3d h GLY 380 Ca 0.07 -0.46 -0.00 0.00 0.00 0.00 0.00 47.33 46.94 1u3d h GLY 380 CO 0.09 0.41 0.02 1.98 0.00 0.00 0.00 176.54 179.04 1u3d h MET 381 N 0.23 0.09 -0.53 4.80 -1.53 -0.84 -1.94 114.93 115.21 1u3d h MET 381 Ca -0.01 -0.02 -0.01 0.00 -3.44 0.00 0.00 59.70 56.22 1u3d h MET 381 Cb 1.18 -0.01 -0.03 0.00 -0.55 0.00 0.00 31.60 32.19 1u3d h MET 381 CO 0.10 0.23 0.30 -0.22 0.14 0.00 0.00 176.91 177.47 1u3d h LYS 382 N -0.06 0.73 -0.12 0.39 1.63 -1.14 -0.46 116.57 117.54 1u3d h LYS 382 Ca 0.02 -0.08 0.02 0.00 -0.85 0.00 0.00 60.65 59.76 1u3d h LYS 382 Cb 0.17 -0.15 -0.02 0.00 -0.60 0.00 0.00 32.23 31.64 1u3d h LYS 382 CO -0.00 0.55 0.00 -0.92 -3.45 0.00 0.00 179.45 175.63 1u3d h TYR 383 N 0.71 0.00 -0.39 1.91 3.20 -1.24 -0.98 116.97 120.18 1u3d h TYR 383 Ca 0.19 0.01 0.07 0.00 3.14 0.00 0.00 58.73 62.13 1u3d h TYR 383 Cb 0.02 0.02 -0.06 0.00 1.54 0.00 0.00 36.73 38.24 1u3d h TYR 383 CO -0.02 -0.01 0.03 0.74 -1.64 0.00 0.00 178.16 177.26 1u3d h PHE 384 N 0.05 0.03 -0.63 -3.82 -1.00 -1.19 -0.66 116.94 109.72 1u3d h PHE 384 Ca 0.05 0.03 0.03 0.00 2.81 0.00 0.00 57.97 60.89 1u3d h PHE 384 Cb 0.06 0.05 -0.03 0.00 3.61 0.00 0.00 35.95 39.63 1u3d h PHE 384 CO -0.13 -0.05 0.42 2.35 -1.61 0.00 0.00 178.31 179.29 1u3d h TRP 385 N 0.14 0.74 0.00 -0.55 2.91 -0.53 0.14 115.95 118.79 1u3d h TRP 385 Ca 0.19 0.02 -0.07 0.00 1.13 0.00 0.00 58.89 60.16 1u3d h TRP 385 Cb 0.26 -0.25 -0.01 0.00 -0.51 0.00 0.00 29.16 28.65 1u3d h TRP 385 CO -0.24 0.44 -0.32 -0.44 -1.03 0.00 0.00 178.44 176.85 1u3d h ASP 386 N 0.77 0.00 0.00 2.65 3.32 -0.51 -3.38 116.42 119.27 1u3d h ASP 386 Ca 0.25 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.30 1u3d h ASP 386 Cb 0.04 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1u3d h ASP 386 CO -0.06 0.32 -1.31 0.35 -1.72 0.00 0.00 179.24 176.82 1u3d n THR 387 N -3.20 0.00 -2.72 0.35 -2.24 -0.32 -4.08 114.28 102.06 1u3d n THR 387 Ca 0.02 -0.24 -0.40 0.00 -2.27 0.00 0.00 64.05 61.16 1u3d n THR 387 Cb 0.64 0.38 -0.06 0.00 -2.10 0.00 0.00 70.33 69.20 1u3d n THR 387 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1u3d s LEU 388 N -3.51 4.62 0.43 3.22 1.43 0.41 -4.24 118.68 121.04 1u3d s LEU 388 Ca -0.03 1.95 0.21 0.00 -1.03 0.00 0.00 54.13 55.23 1u3d s LEU 388 Cb 0.07 -3.61 0.97 0.00 0.03 0.00 0.00 46.19 43.65 1u3d s LEU 388 CO 0.42 0.10 1.88 0.25 0.23 0.00 0.00 176.35 179.24 1u3d h LEU 389 N 4.32 0.00 -3.34 1.79 5.85 -1.38 -2.51 115.31 120.04 1u3d h LEU 389 Ca -0.45 0.00 -0.10 0.00 0.84 0.00 0.00 57.88 58.17 1u3d h LEU 389 Cb 1.20 0.00 -0.06 0.00 0.37 0.00 0.00 40.66 42.17 1u3d h LEU 389 CO 0.68 0.27 0.01 -0.90 -0.34 0.00 0.00 178.44 178.17 1u3d n ASP 390 N -3.70 3.33 -4.67 1.25 5.68 -1.26 -4.61 116.55 112.56 1u3d n ASP 390 Ca -0.01 -3.36 -0.64 0.00 -0.50 0.00 0.00 54.79 50.28 1u3d n ASP 390 Cb 0.38 -0.60 -0.09 0.00 -1.14 0.00 0.00 41.12 39.67 1u3d n ASP 390 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1u3d n ALA 391 N -0.79 -1.86 -3.66 2.12 0.00 -0.95 -4.84 120.51 110.54 1u3d n ALA 391 Ca 0.29 0.52 -0.16 0.00 0.00 0.00 0.00 53.44 54.08 1u3d n ALA 391 Cb 1.00 -1.91 -0.15 0.00 0.00 0.00 0.00 19.45 18.39 1u3d n ALA 391 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1u3d s ASP 392 N 2.10 0.66 0.14 0.00 -1.08 -1.26 -5.02 116.67 112.20 1u3d s ASP 392 Ca 0.99 0.39 -0.23 0.00 -0.52 0.00 0.00 52.55 53.19 1u3d s ASP 392 Cb -1.37 0.41 -0.00 0.00 -1.46 0.00 0.00 42.92 40.50 1u3d s ASP 392 CO 0.72 -0.25 1.65 -0.07 0.52 0.00 0.00 175.17 177.74 1u3d h LEU 393 N 8.34 -0.61 -0.38 -1.34 -0.00 -1.98 0.63 115.31 119.97 1u3d h LEU 393 Ca -0.14 0.11 -0.03 0.00 -0.00 0.00 0.00 57.88 57.82 1u3d h LEU 393 Cb 1.12 0.29 -0.02 0.00 -0.00 0.00 0.00 40.66 42.05 1u3d h LEU 393 CO 0.14 -0.24 0.10 -0.33 -0.00 0.00 0.00 178.44 178.12 1u3d h GLU 394 N -0.23 0.61 0.00 1.13 3.07 -1.97 0.31 114.58 117.49 1u3d h GLU 394 Ca 0.11 -0.14 -0.12 0.00 -0.50 0.00 0.00 59.36 58.71 1u3d h GLU 394 Cb 0.39 -0.08 -0.02 0.00 -0.84 0.00 0.00 28.75 28.20 1u3d h GLU 394 CO -0.30 0.63 -0.59 0.77 -1.40 0.00 0.00 179.01 178.12 1u3d h SER 395 N 0.47 0.00 -0.08 1.42 0.02 -1.78 -1.84 113.55 111.77 1u3d h SER 395 Ca 0.12 0.00 -0.10 0.00 -0.84 0.00 0.00 61.79 60.97 1u3d h SER 395 Cb 0.29 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1u3d h SER 395 CO -0.00 0.59 -0.33 -0.78 -1.14 0.00 0.00 176.83 175.17 1u3d h ASP 396 N 0.00 0.43 -0.10 3.07 3.58 0.46 -2.14 116.42 121.73 1u3d h ASP 396 Ca -0.01 -0.63 -0.00 0.00 0.42 0.00 0.00 57.03 56.81 1u3d h ASP 396 Cb 1.09 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 42.01 1u3d h ASP 396 CO 0.08 0.99 0.06 0.00 -2.88 0.00 0.00 179.24 177.48 1u3d h ALA 397 N 0.45 0.13 -0.47 -0.78 0.00 -0.90 -1.12 119.26 116.58 1u3d h ALA 397 Ca -0.02 -0.05 0.05 0.00 0.00 0.00 0.00 54.91 54.90 1u3d h ALA 397 Cb 0.97 -0.04 -0.05 0.00 0.00 0.00 0.00 17.79 18.67 1u3d h ALA 397 CO 0.07 -0.34 0.19 1.25 0.00 0.00 0.00 179.25 180.42 1u3d h LEU 398 N 0.08 0.23 -0.33 0.00 5.85 -1.40 0.25 115.31 119.99 1u3d h LEU 398 Ca 0.04 0.04 -0.02 0.00 0.84 0.00 0.00 57.88 58.78 1u3d h LEU 398 Cb 0.07 0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.09 1u3d h LEU 398 CO -0.01 0.17 0.14 1.23 -0.34 0.00 0.00 178.44 179.63 1u3d h GLY 399 N 0.38 0.52 1.03 3.75 0.00 -1.09 -1.64 103.07 106.04 1u3d h GLY 399 Ca 0.22 -0.27 -0.09 0.00 0.00 0.00 0.00 47.33 47.18 1u3d h GLY 399 CO -0.20 0.26 -0.00 1.49 0.00 0.00 0.00 176.54 178.09 1u3d h TRP 400 N 0.39 1.03 -0.71 5.60 4.06 -0.75 -1.37 115.95 124.19 1u3d h TRP 400 Ca 0.11 -0.18 -0.03 0.00 2.06 0.00 0.00 58.89 60.85 1u3d h TRP 400 Cb 0.16 -0.27 -0.03 0.00 -1.00 0.00 0.00 29.16 28.02 1u3d h TRP 400 CO -0.01 0.94 0.34 1.96 -3.56 0.00 0.00 178.44 178.11 1u3d h GLN 401 N 0.81 1.03 -0.58 0.49 4.20 -0.41 -1.30 115.11 119.35 1u3d h GLN 401 Ca 0.15 -0.15 -0.03 0.00 0.06 0.00 0.00 58.65 58.68 1u3d h GLN 401 Cb 0.54 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.11 1u3d h GLN 401 CO 0.03 0.81 0.26 -0.92 -0.67 0.00 0.00 178.83 178.35 1u3d h TYR 402 N 1.00 0.86 -0.45 2.96 3.20 -1.11 -1.63 116.97 121.80 1u3d h TYR 402 Ca 0.24 -0.05 -0.14 0.00 3.14 0.00 0.00 58.73 61.92 1u3d h TYR 402 Cb 0.13 -0.26 -0.01 0.00 1.54 0.00 0.00 36.73 38.12 1u3d h TYR 402 CO 0.01 0.67 -0.28 0.82 -1.64 0.00 0.00 178.16 177.73 1u3d h ILE 403 N 0.80 1.27 0.00 1.81 1.08 -0.94 -3.09 117.51 118.44 1u3d h ILE 403 Ca 0.20 -1.45 -0.10 0.00 -0.39 0.00 0.00 64.86 63.12 1u3d h ILE 403 Cb 0.15 1.22 -0.01 0.00 -3.07 0.00 0.00 36.82 35.10 1u3d h ILE 403 CO -0.02 0.50 -0.47 0.74 -0.69 0.00 0.00 178.15 178.20 1u3d h THR 404 N 0.83 1.26 0.00 -0.27 2.02 -1.17 -3.48 112.91 112.10 1u3d h THR 404 Ca 0.09 -1.67 0.00 0.00 0.77 0.00 0.00 66.41 65.60 1u3d h THR 404 Cb 0.87 1.92 0.00 0.00 -1.74 0.00 0.00 68.15 69.20 1u3d h THR 404 CO 0.08 0.46 0.00 0.61 0.37 0.00 0.00 175.52 177.04 1u3d n GLY 405 N -0.04 1.08 1.56 2.16 0.00 -0.66 -4.91 105.19 104.39 1u3d n GLY 405 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.09 1u3d n GLY 405 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1u3d n THR 406 N -1.83 1.89 -4.53 2.61 -2.24 -0.94 -4.88 114.28 104.37 1u3d n THR 406 Ca 0.00 -1.12 -0.31 0.00 -2.27 0.00 0.00 64.05 60.35 1u3d n THR 406 Cb 0.00 -0.03 -0.11 0.00 -2.10 0.00 0.00 70.33 68.08 1u3d n THR 406 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1u3d s LEU 407 N -1.93 2.89 0.34 3.22 1.43 -1.25 -1.36 118.68 122.02 1u3d s LEU 407 Ca 0.47 -0.30 0.14 0.00 -1.03 0.00 0.00 54.13 53.41 1u3d s LEU 407 Cb 0.32 -1.68 1.05 0.00 0.03 0.00 0.00 46.19 45.91 1u3d s LEU 407 CO 0.20 0.26 1.68 -0.65 0.23 0.00 0.00 176.35 178.07 1u3d h PRO 408 N 4.43 0.38 -0.69 1.29 0.11 -1.91 -1.14 132.00 134.46 1u3d h PRO 408 Ca -0.48 -0.02 -0.40 0.00 0.11 0.00 0.00 66.00 65.21 1u3d h PRO 408 Cb 1.16 -0.08 -0.23 0.00 0.11 0.00 0.00 31.00 31.96 1u3d h PRO 408 CO 0.51 0.25 0.23 -0.40 -0.21 0.00 0.00 178.00 178.38 1u3d n ASP 409 N -4.97 3.85 -4.87 -2.05 5.75 -1.26 -5.02 116.55 107.97 1u3d n ASP 409 Ca 0.30 -3.73 -0.31 0.00 -0.01 0.00 0.00 54.79 51.04 1u3d n ASP 409 Cb 0.94 -0.73 0.02 0.00 -1.03 0.00 0.00 41.12 40.31 1u3d n ASP 409 CO 0.00 0.00 0.00 -0.44 -0.11 0.00 0.00 177.20 176.65 1u3d s SER 410 N -2.13 6.08 0.96 -1.12 0.01 -0.43 -5.06 113.70 112.01 1u3d s SER 410 Ca 0.52 1.35 -0.13 0.00 1.31 0.00 0.00 55.95 58.99 1u3d s SER 410 Cb 0.45 -2.35 0.17 0.00 0.21 0.00 0.00 66.02 64.49 1u3d s SER 410 CO 0.04 -0.95 1.15 -0.13 0.41 0.00 0.00 173.24 173.75 1u3d s ARG 411 N -5.20 0.70 0.23 12.44 3.00 -1.26 -4.91 118.95 123.96 1u3d s ARG 411 Ca 0.55 0.21 -0.32 0.00 0.00 0.00 0.00 55.73 56.17 1u3d s ARG 411 Cb -0.11 -1.80 -0.13 0.00 0.00 0.00 0.00 34.95 32.92 1u3d s ARG 411 CO 0.53 -2.48 1.59 -0.85 0.00 0.00 0.00 175.30 174.09 1u3d n GLU 412 N -3.94 2.47 0.11 3.54 0.28 -1.26 -4.81 120.64 117.03 1u3d n GLU 412 Ca 0.08 0.88 -0.13 0.00 -0.16 0.00 0.00 57.16 57.83 1u3d n GLU 412 Cb 0.59 -2.66 -0.08 0.00 1.43 0.00 0.00 31.44 30.72 1u3d n GLU 412 CO 0.00 0.00 0.00 0.35 -0.16 0.00 0.00 177.13 177.32 1u3d h PHE 413 N 5.45 -0.25 0.00 -1.84 3.57 -1.90 -3.32 116.94 118.65 1u3d h PHE 413 Ca -0.45 -0.01 -0.53 0.00 3.53 0.00 0.00 57.97 60.52 1u3d h PHE 413 Cb 1.23 0.08 0.03 0.00 2.79 0.00 0.00 35.95 40.09 1u3d h PHE 413 CO 0.60 0.03 2.49 -3.47 -2.23 0.00 0.00 178.31 175.73 1u3d n ASP 414 N -5.10 3.72 -3.68 0.41 2.03 -1.26 -4.69 116.55 107.98 1u3d n ASP 414 Ca -0.09 -2.52 -0.11 0.00 0.52 0.00 0.00 54.79 52.59 1u3d n ASP 414 Cb 0.21 -1.13 -0.11 0.00 -0.72 0.00 0.00 41.12 39.37 1u3d n ASP 414 CO 0.00 0.00 0.00 -0.60 -1.92 0.00 0.00 177.20 174.68 1u3d s ARG 415 N 4.17 0.27 -0.22 -0.67 3.52 -1.25 -5.14 118.95 119.63 1u3d s ARG 415 Ca 0.49 0.83 -0.04 0.00 -0.13 0.00 0.00 55.73 56.87 1u3d s ARG 415 Cb 0.12 0.08 -0.01 0.00 -1.56 0.00 0.00 34.95 33.58 1u3d s ARG 415 CO 0.04 -0.23 -0.03 0.42 -0.81 0.00 0.00 175.30 174.69 1u3d s ILE 416 N 2.12 3.53 0.34 4.11 1.01 -1.26 -4.96 121.20 126.09 1u3d s ILE 416 Ca -0.03 -0.44 -0.26 0.00 0.00 0.00 0.00 60.65 59.91 1u3d s ILE 416 Cb -0.11 -2.61 -0.10 0.00 0.01 0.00 0.00 42.46 39.66 1u3d s ILE 416 CO -0.11 0.42 0.98 -1.81 0.00 0.00 0.00 174.94 174.42 1u3d s ASP 417 N 1.39 7.20 -0.44 3.58 1.01 -1.26 -5.01 116.67 123.14 1u3d s ASP 417 Ca 0.05 1.91 -0.20 0.00 0.71 0.00 0.00 52.55 55.02 1u3d s ASP 417 Cb -0.14 -2.58 0.03 0.00 1.01 0.00 0.00 42.92 41.23 1u3d s ASP 417 CO -0.02 -0.17 0.60 0.21 0.21 0.00 0.00 175.17 176.01 1u3d s ASN 418 N -1.56 6.29 0.61 0.27 3.84 -1.26 -4.93 114.94 118.20 1u3d s ASN 418 Ca 0.52 -0.46 0.32 0.00 0.21 0.00 0.00 52.86 53.45 1u3d s ASN 418 Cb -0.20 -2.30 1.87 0.00 -0.55 0.00 0.00 41.25 40.07 1u3d s ASN 418 CO 0.26 -0.75 2.20 -0.65 -2.79 0.00 0.00 177.10 175.37 1u3d h PRO 419 N 8.86 0.00 -0.30 0.43 0.11 -1.95 0.16 132.00 139.32 1u3d h PRO 419 Ca -0.26 0.00 -0.07 0.00 0.11 0.00 0.00 66.00 65.78 1u3d h PRO 419 Cb 1.10 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.20 1u3d h PRO 419 CO 0.88 0.00 -0.09 0.37 -0.21 0.00 0.00 178.00 178.95 1u3d h GLN 420 N 0.00 0.59 -0.09 1.05 4.15 -1.92 0.42 115.11 119.30 1u3d h GLN 420 Ca 0.03 -0.24 -0.18 0.00 0.77 0.00 0.00 58.65 59.04 1u3d h GLN 420 Cb 0.23 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.88 1u3d h GLN 420 CO -0.00 0.79 -0.69 0.74 -1.93 0.00 0.00 178.83 177.74 1u3d h PHE 421 N 0.35 0.56 -0.50 3.99 0.04 -1.37 -1.97 116.94 118.04 1u3d h PHE 421 Ca 0.07 -0.24 -0.03 0.00 2.80 0.00 0.00 57.97 60.57 1u3d h PHE 421 Cb 0.59 -0.09 -0.02 0.00 2.20 0.00 0.00 35.95 38.63 1u3d h PHE 421 CO 0.05 0.98 0.17 0.93 -0.60 0.00 0.00 178.31 179.85 1u3d h GLU 422 N 0.30 0.73 -0.06 1.51 4.39 -1.11 0.11 114.58 120.44 1u3d h GLU 422 Ca -0.02 -0.12 0.01 0.00 0.34 0.00 0.00 59.36 59.57 1u3d h GLU 422 Cb 1.26 -0.13 -0.01 0.00 -0.10 0.00 0.00 28.75 29.77 1u3d h GLU 422 CO 0.12 0.62 -0.01 0.78 -1.16 0.00 0.00 179.01 179.37 1u3d h GLY 423 N 0.88 0.05 1.02 -3.84 0.00 -0.48 0.28 103.07 100.98 1u3d h GLY 423 Ca 0.17 0.01 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 1u3d h GLY 423 CO -0.01 -0.02 0.55 -0.97 0.00 0.00 0.00 176.54 176.09 1u3d h TYR 424 N 0.01 1.23 0.59 5.60 0.05 -0.58 0.31 116.97 124.18 1u3d h TYR 424 Ca 0.03 -0.01 -0.03 0.00 0.05 0.00 0.00 58.73 58.77 1u3d h TYR 424 Cb 0.04 -0.40 0.01 0.00 1.01 0.00 0.00 36.73 37.38 1u3d h TYR 424 CO -0.12 0.82 -0.28 0.87 -1.05 0.00 0.00 178.16 178.41 1u3d h LYS 425 N 1.28 -0.76 0.00 4.88 1.57 -0.03 -3.29 116.57 120.22 1u3d h LYS 425 Ca 0.33 0.05 -0.04 0.00 -1.87 0.00 0.00 60.65 59.12 1u3d h LYS 425 Cb -0.04 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 32.44 1u3d h LYS 425 CO -0.06 -0.51 -0.57 0.74 -0.57 0.00 0.00 179.45 178.48 1u3d h PHE 426 N -1.11 0.00 -2.01 -1.35 0.04 -0.49 -3.40 116.94 108.62 1u3d h PHE 426 Ca -0.08 0.00 -0.50 0.00 2.80 0.00 0.00 57.97 60.19 1u3d h PHE 426 Cb 0.61 0.00 -0.40 0.00 2.20 0.00 0.00 35.95 38.36 1u3d h PHE 426 CO 0.02 0.16 -1.16 -3.47 -0.60 0.00 0.00 178.31 173.25 1u3d n ASP 427 N -2.97 0.89 -0.30 2.17 2.03 0.11 -3.91 116.55 114.58 1u3d n ASP 427 Ca 0.01 -2.99 0.24 0.00 0.52 0.00 0.00 54.79 52.57 1u3d n ASP 427 Cb 0.61 -0.62 0.56 0.00 -0.72 0.00 0.00 41.12 40.95 1u3d n ASP 427 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1u3d h PRO 428 N 3.15 0.30 -0.29 -0.67 0.13 -1.60 -1.44 132.00 131.58 1u3d h PRO 428 Ca 0.10 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.21 1u3d h PRO 428 Cb 0.94 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1u3d h PRO 428 CO 0.51 0.20 0.00 0.09 -0.23 0.00 0.00 178.00 178.57 1u3d n ASN 429 N -4.51 3.48 0.00 1.44 3.02 -1.26 -4.96 115.26 112.47 1u3d n ASN 429 Ca 0.24 -2.61 0.00 0.00 -0.03 0.00 0.00 54.58 52.17 1u3d n ASN 429 Cb 0.91 -0.42 0.00 0.00 -0.61 0.00 0.00 39.78 39.66 1u3d n ASN 429 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1u3d n GLY 430 N -0.12 0.15 0.34 7.41 0.00 -0.54 -4.82 105.19 107.60 1u3d n GLY 430 Ca 0.17 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.17 1u3d n GLY 430 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1u3d h GLU 431 N 0.32 1.07 0.16 1.61 5.08 -1.93 -1.48 114.58 119.41 1u3d h GLU 431 Ca 0.00 -0.13 -0.01 0.00 -1.00 0.00 0.00 59.36 58.22 1u3d h GLU 431 Cb 0.67 -0.21 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1u3d h GLU 431 CO 0.00 0.80 -0.08 -0.92 -1.00 0.00 0.00 179.01 177.81 1u3d h TYR 432 N 1.07 -0.20 -0.77 4.33 3.20 -1.90 -1.63 116.97 121.08 1u3d h TYR 432 Ca 0.27 -0.00 0.11 0.00 3.14 0.00 0.00 58.73 62.24 1u3d h TYR 432 Cb 0.05 0.07 -0.08 0.00 1.54 0.00 0.00 36.73 38.31 1u3d h TYR 432 CO 0.01 0.17 0.39 0.28 -1.64 0.00 0.00 178.16 177.37 1u3d h VAL 433 N -0.61 0.81 -0.17 1.81 2.07 -1.89 -2.27 116.25 116.00 1u3d h VAL 433 Ca -0.02 -0.21 -0.12 0.00 0.82 0.00 0.00 66.70 67.16 1u3d h VAL 433 Cb 0.46 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.35 1u3d h VAL 433 CO 0.04 0.11 -0.41 0.03 0.02 0.00 0.00 177.57 177.36 1u3d h ARG 434 N 0.62 0.39 -0.77 1.57 3.08 -1.23 -0.33 114.38 117.72 1u3d h ARG 434 Ca 0.39 -0.19 -0.02 0.00 0.07 0.00 0.00 59.98 60.22 1u3d h ARG 434 Cb 0.46 0.00 -0.04 0.00 0.08 0.00 0.00 29.97 30.47 1u3d h ARG 434 CO -0.30 0.74 0.39 -0.09 -1.07 0.00 0.00 179.97 179.63 1u3d h ARG 435 N 0.32 1.10 -0.00 0.04 2.43 -0.73 -3.26 114.38 114.28 1u3d h ARG 435 Ca 0.03 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 1u3d h ARG 435 Cb 0.86 -0.20 0.00 0.00 -0.42 0.00 0.00 29.97 30.21 1u3d h ARG 435 CO 0.07 0.84 -0.71 0.91 -1.51 0.00 0.00 179.97 179.57 1u3d n TRP 436 N -4.40 0.00 -3.86 2.20 7.02 -0.98 -4.60 117.44 112.82 1u3d n TRP 436 Ca 0.07 0.00 -0.29 0.00 -1.02 0.00 0.00 57.50 56.26 1u3d n TRP 436 Cb 0.12 -0.11 -0.13 0.00 -2.42 0.00 0.00 31.31 28.77 1u3d n TRP 436 CO 0.00 0.00 0.00 -0.51 -2.02 0.00 0.00 177.69 175.16 1u3d s LEU 437 N -2.93 3.99 0.55 -0.99 1.43 -0.15 -4.82 118.68 115.76 1u3d s LEU 437 Ca 0.11 -3.17 0.26 0.00 -1.03 0.00 0.00 54.13 50.30 1u3d s LEU 437 Cb 0.17 -1.46 1.60 0.00 0.03 0.00 0.00 46.19 46.53 1u3d s LEU 437 CO 0.76 -0.19 2.17 1.55 0.23 0.00 0.00 176.35 180.87 1u3d h PRO 438 N 6.20 0.00 -0.05 1.29 0.14 -1.82 0.22 132.00 137.98 1u3d h PRO 438 Ca 0.01 0.00 0.01 0.00 0.14 0.00 0.00 66.00 66.17 1u3d h PRO 438 Cb 0.86 0.00 -0.00 0.00 0.14 0.00 0.00 31.00 32.00 1u3d h PRO 438 CO 0.64 0.05 0.07 1.05 0.14 0.00 0.00 178.00 179.95 1u3d h GLU 439 N 0.00 0.00 -0.35 0.86 9.09 -1.92 0.01 114.58 122.27 1u3d h GLU 439 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1u3d h GLU 439 Cb 0.12 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.22 1u3d h GLU 439 CO 0.01 0.00 0.00 1.28 0.05 0.00 0.00 179.01 180.35 1u3d n LEU 440 N -3.64 3.00 0.18 3.06 4.77 0.04 -4.62 117.00 119.78 1u3d n LEU 440 Ca -0.02 -1.69 0.10 0.00 -0.03 0.00 0.00 56.01 54.38 1u3d n LEU 440 Cb 0.16 -0.23 0.55 0.00 -2.33 0.00 0.00 43.42 41.57 1u3d n LEU 440 CO 0.25 0.70 0.84 0.77 -1.33 0.00 0.00 177.39 178.63 1u3d h SER 441 N 2.95 0.00 -0.03 -1.43 4.64 -0.66 -2.04 113.55 116.98 1u3d h SER 441 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1u3d h SER 441 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 1u3d h SER 441 CO 0.00 0.00 0.00 0.54 -0.87 0.00 0.00 176.83 176.50 1u3d n ARG 442 N -2.24 1.09 -2.65 4.77 1.74 -1.26 -5.00 116.66 113.10 1u3d n ARG 442 Ca -0.01 -1.40 -0.42 0.00 -0.77 0.00 0.00 57.85 55.25 1u3d n ARG 442 Cb 0.14 -1.28 -0.03 0.00 -1.02 0.00 0.00 32.46 30.27 1u3d n ARG 442 CO 0.00 0.00 0.00 -1.17 -1.52 0.00 0.00 177.63 174.94 1u3d s LEU 443 N -1.22 4.34 0.62 0.55 2.96 -0.77 -4.69 118.68 120.47 1u3d s LEU 443 Ca 0.18 1.70 -0.17 0.00 -0.22 0.00 0.00 54.13 55.62 1u3d s LEU 443 Cb 0.12 -3.57 -0.02 0.00 0.50 0.00 0.00 46.19 43.22 1u3d s LEU 443 CO 0.18 -0.34 1.12 -2.84 -1.32 0.00 0.00 176.35 173.15 1u3d s PRO 444 N 1.25 3.01 0.44 0.98 0.02 -1.26 -4.69 135.00 134.75 1u3d s PRO 444 Ca 0.53 1.47 0.25 0.00 0.02 0.00 0.00 61.00 63.26 1u3d s PRO 444 Cb -0.22 -1.97 1.26 0.00 0.02 0.00 0.00 34.50 33.59 1u3d s PRO 444 CO 0.26 -1.10 1.76 1.15 -0.33 0.00 0.00 177.00 178.74 1u3d h THR 445 N 0.45 0.43 -0.06 0.99 2.02 -1.96 0.12 112.91 114.92 1u3d h THR 445 Ca -0.48 -0.09 0.02 0.00 0.77 0.00 0.00 66.41 66.63 1u3d h THR 445 Cb 1.25 0.16 -0.00 0.00 -1.74 0.00 0.00 68.15 67.82 1u3d h THR 445 CO 0.55 0.05 0.06 0.44 0.37 0.00 0.00 175.52 176.99 1u3d h ASP 446 N 0.25 0.00 0.00 4.18 5.19 -1.97 -2.90 116.42 121.17 1u3d h ASP 446 Ca 0.62 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.03 1u3d h ASP 446 Cb 1.86 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.37 1u3d h ASP 446 CO -0.24 0.00 0.00 0.79 -3.12 0.00 0.00 179.24 176.67 1u3d n TRP 447 N -3.93 0.00 -0.29 4.55 8.01 0.37 -4.78 117.44 121.37 1u3d n TRP 447 Ca -0.02 -0.07 0.14 0.00 -1.31 0.00 0.00 57.50 56.25 1u3d n TRP 447 Cb 0.15 -0.01 0.39 0.00 -2.01 0.00 0.00 31.31 29.84 1u3d n TRP 447 CO 0.00 0.00 0.00 0.97 -1.01 0.00 0.00 177.69 177.65 1u3d h ILE 448 N 0.12 0.77 -0.58 -0.99 6.09 -1.15 -0.95 117.51 120.83 1u3d h ILE 448 Ca 0.00 -0.22 0.00 0.00 -1.37 0.00 0.00 64.86 63.27 1u3d h ILE 448 Cb 0.12 0.06 0.00 0.00 0.47 0.00 0.00 36.82 37.47 1u3d h ILE 448 CO 0.00 0.12 0.00 1.41 -3.07 0.00 0.00 178.15 176.61 1u3d n HIS 449 N -4.60 0.76 -2.73 2.19 8.25 -1.26 -4.50 115.22 113.34 1u3d n HIS 449 Ca 0.19 -0.38 -0.07 0.00 -0.26 0.00 0.00 57.72 57.20 1u3d n HIS 449 Cb 0.54 0.00 0.06 0.00 1.12 0.00 0.00 29.99 31.72 1u3d n HIS 449 CO 0.00 0.00 0.00 -2.39 0.64 0.00 0.00 176.34 174.59 1u3d n HIS 450 N 1.30 -2.74 0.25 4.41 1.44 -0.44 -4.30 115.22 115.13 1u3d n HIS 450 Ca 0.20 -1.60 0.11 0.00 -2.01 0.00 0.00 57.72 54.43 1u3d n HIS 450 Cb 0.53 1.49 0.63 0.00 0.12 0.00 0.00 29.99 32.76 1u3d n HIS 450 CO 0.00 0.00 0.00 -1.00 -2.81 0.00 0.00 176.34 172.53 1u3d h PRO 451 N 3.67 0.00 0.00 -1.40 0.13 -1.56 -3.15 132.00 129.69 1u3d h PRO 451 Ca -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.97 1u3d h PRO 451 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1u3d h PRO 451 CO 0.21 0.17 0.00 -2.67 -0.23 0.00 0.00 178.00 175.47 1u3d n TRP 452 N -3.60 0.69 -0.04 1.56 2.14 -1.26 -2.48 117.44 114.46 1u3d n TRP 452 Ca -0.01 0.32 -0.21 0.00 2.07 0.00 0.00 57.50 59.67 1u3d n TRP 452 Cb 0.30 -1.01 -0.13 0.00 -0.81 0.00 0.00 31.31 29.66 1u3d n TRP 452 CO 0.00 0.00 0.00 -0.91 2.07 0.00 0.00 177.69 178.85 1u3d h ASN 453 N 0.00 0.20 -0.65 -0.67 -0.26 -1.94 -3.49 115.58 108.77 1u3d h ASN 453 Ca 0.00 -0.75 -0.41 0.00 -0.56 0.00 0.00 56.30 54.59 1u3d h ASN 453 Cb 0.17 -0.07 0.07 0.00 -1.06 0.00 0.00 38.32 37.43 1u3d h ASN 453 CO 0.00 1.54 -0.35 0.00 -1.06 0.00 0.00 177.43 177.56 1u3d n ALA 454 N -3.11 -2.17 -1.80 -0.83 0.00 -1.03 -4.91 120.51 106.65 1u3d n ALA 454 Ca -0.27 0.25 -0.41 0.00 0.00 0.00 0.00 53.44 53.00 1u3d n ALA 454 Cb 0.80 -0.97 -0.02 0.00 0.00 0.00 0.00 19.45 19.25 1u3d n ALA 454 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1u3d s PRO 455 N -0.61 4.17 0.38 0.00 0.04 -1.26 -4.84 135.00 132.88 1u3d s PRO 455 Ca 0.39 2.48 0.20 0.00 0.04 0.00 0.00 61.00 64.11 1u3d s PRO 455 Cb -0.55 -3.05 1.19 0.00 0.04 0.00 0.00 34.50 32.12 1u3d s PRO 455 CO 0.35 -0.56 1.68 0.93 0.04 0.00 0.00 177.00 179.43 1u3d h GLU 456 N 4.94 0.27 -0.19 4.56 4.39 -1.99 0.12 114.58 126.68 1u3d h GLU 456 Ca -0.47 -0.02 -0.08 0.00 0.34 0.00 0.00 59.36 59.14 1u3d h GLU 456 Cb 1.22 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.80 1u3d h GLU 456 CO 0.79 0.18 -0.23 0.66 -1.16 0.00 0.00 179.01 179.25 1u3d h SER 457 N 0.28 0.33 -0.16 1.42 4.64 -1.99 0.10 113.55 118.16 1u3d h SER 457 Ca 0.73 -0.10 -0.16 0.00 -0.47 0.00 0.00 61.79 61.79 1u3d h SER 457 Cb 1.89 -0.09 0.01 0.00 -0.31 0.00 0.00 62.40 63.89 1u3d h SER 457 CO -0.48 0.57 -0.53 -0.37 -0.87 0.00 0.00 176.83 175.14 1u3d h VAL 458 N 0.30 1.33 0.51 0.95 -1.51 -1.12 -1.62 116.25 115.08 1u3d h VAL 458 Ca 0.05 -1.78 -0.02 0.00 -1.23 0.00 0.00 66.70 63.72 1u3d h VAL 458 Cb 0.58 1.99 -0.00 0.00 -2.13 0.00 0.00 31.29 31.72 1u3d h VAL 458 CO 0.04 0.55 -0.30 -0.07 -1.23 0.00 0.00 177.57 176.56 1u3d h LEU 459 N 0.32 -0.75 -0.65 4.19 3.38 -1.28 -0.16 115.31 120.36 1u3d h LEU 459 Ca -0.02 0.04 0.13 0.00 0.09 0.00 0.00 57.88 58.12 1u3d h LEU 459 Cb 1.16 0.22 -0.09 0.00 0.09 0.00 0.00 40.66 42.03 1u3d h LEU 459 CO 0.11 -0.48 0.15 1.56 0.09 0.00 0.00 178.44 179.87 1u3d h GLN 460 N -0.77 0.27 -0.03 1.13 4.20 -0.81 0.11 115.11 119.21 1u3d h GLN 460 Ca -0.06 -0.02 -0.04 0.00 0.06 0.00 0.00 58.65 58.59 1u3d h GLN 460 Cb 0.62 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.33 1u3d h GLN 460 CO 0.07 0.18 -0.19 0.00 -0.67 0.00 0.00 178.83 178.22 1u3d h ALA 461 N 1.52 1.63 -0.00 3.87 0.00 -1.00 -2.63 119.26 122.64 1u3d h ALA 461 Ca 0.35 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 55.07 1u3d h ALA 461 Cb 0.53 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1u3d h ALA 461 CO -0.43 0.28 -0.32 0.00 0.00 0.00 0.00 179.25 178.78 1u3d n ALA 462 N -2.50 3.15 -0.84 0.00 0.00 0.21 -4.94 120.51 115.60 1u3d n ALA 462 Ca -0.02 -0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.11 1u3d n ALA 462 Cb 0.26 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.51 1u3d n ALA 462 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1u3d n GLY 463 N 1.44 0.48 3.69 0.00 0.00 -0.19 -4.56 105.19 106.04 1u3d n GLY 463 Ca 0.08 -0.92 -0.36 0.00 0.00 0.00 0.00 46.02 44.83 1u3d n GLY 463 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1u3d s ILE 464 N -2.00 5.29 -0.39 -0.61 1.01 -0.89 -4.97 121.20 118.63 1u3d s ILE 464 Ca 0.00 0.15 0.03 0.00 0.00 0.00 0.00 60.65 60.83 1u3d s ILE 464 Cb 0.00 -3.43 0.11 0.00 0.01 0.00 0.00 42.46 39.15 1u3d s ILE 464 CO 0.00 0.40 0.12 -0.70 0.00 0.00 0.00 174.94 174.76 1u3d s GLU 465 N 0.65 1.65 0.07 2.79 2.12 -1.26 -4.34 118.70 120.38 1u3d s GLU 465 Ca 0.07 -2.06 -0.36 0.00 0.36 0.00 0.00 54.97 52.98 1u3d s GLU 465 Cb -0.12 -3.27 -0.16 0.00 0.26 0.00 0.00 34.13 30.83 1u3d s GLU 465 CO 0.01 -0.99 1.42 1.28 -0.54 0.00 0.00 175.26 176.43 1u3d n LEU 466 N 4.00 1.96 0.00 2.70 4.77 -1.26 0.14 117.00 129.31 1u3d n LEU 466 Ca 0.04 1.11 0.00 0.00 -0.03 0.00 0.00 56.01 57.13 1u3d n LEU 466 Cb 0.40 -1.23 0.00 0.00 -2.33 0.00 0.00 43.42 40.26 1u3d n LEU 466 CO 0.26 -0.86 0.00 0.61 -1.33 0.00 0.00 177.39 176.07 1u3d n GLY 467 N 2.82 2.47 0.00 -0.72 0.00 0.15 -4.90 105.19 105.01 1u3d n GLY 467 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 1u3d n GLY 467 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1u3d n SER 468 N 0.00 0.00 -0.01 1.61 7.64 0.12 -4.76 113.62 118.23 1u3d n SER 468 Ca 0.00 0.00 0.15 0.00 1.01 0.00 0.00 58.87 60.03 1u3d n SER 468 Cb 0.00 0.00 0.84 0.00 -1.01 0.00 0.00 64.21 64.04 1u3d n SER 468 CO 0.00 0.00 0.00 -0.46 -3.01 0.00 0.00 175.04 171.57 1u3d n ASN 469 N -0.29 0.03 -3.66 6.43 6.94 -1.18 -4.56 115.26 118.97 1u3d n ASN 469 Ca 0.00 -0.56 -0.05 0.00 -0.02 0.00 0.00 54.58 53.95 1u3d n ASN 469 Cb 0.00 -0.15 -0.07 0.00 -2.36 0.00 0.00 39.78 37.20 1u3d n ASN 469 CO 0.00 0.00 0.00 -0.47 -1.03 0.00 0.00 177.26 175.76 1u3d s TYR 470 N -2.30 -1.05 0.79 -2.53 5.04 -1.26 -4.85 117.35 111.19 1u3d s TYR 470 Ca 0.38 1.92 -0.11 0.00 -2.44 0.00 0.00 57.07 56.82 1u3d s TYR 470 Cb 0.21 0.56 0.06 0.00 0.35 0.00 0.00 41.96 43.14 1u3d s TYR 470 CO 0.42 -0.56 1.09 -1.25 -1.34 0.00 0.00 175.55 173.91 1u3d s PRO 471 N 2.53 2.19 0.47 4.97 0.04 -1.26 0.30 135.00 144.24 1u3d s PRO 471 Ca -0.05 0.76 -0.06 0.00 0.04 0.00 0.00 61.00 61.69 1u3d s PRO 471 Cb -0.11 -1.92 -0.04 0.00 0.04 0.00 0.00 34.50 32.47 1u3d s PRO 471 CO -0.16 -1.58 0.79 -0.51 0.04 0.00 0.00 177.00 175.58 1u3d s LEU 472 N -5.79 3.65 -0.38 -3.56 1.43 -1.26 -4.48 118.68 108.29 1u3d s LEU 472 Ca 0.60 0.97 -0.43 0.00 -1.03 0.00 0.00 54.13 54.24 1u3d s LEU 472 Cb -0.15 -3.92 -0.17 0.00 0.03 0.00 0.00 46.19 41.98 1u3d s LEU 472 CO 0.55 -0.56 1.69 -2.65 0.23 0.00 0.00 176.35 175.61 1u3d n PRO 473 N -2.13 0.66 0.28 1.29 -0.02 -1.26 -4.41 135.00 129.41 1u3d n PRO 473 Ca 0.01 0.24 0.14 0.00 -2.02 0.00 0.00 63.50 61.87 1u3d n PRO 473 Cb 0.55 -1.85 0.81 0.00 -0.02 0.00 0.00 33.50 32.99 1u3d n PRO 473 CO 0.00 0.00 0.00 0.97 1.98 0.00 0.00 175.50 178.45 1u3d h ILE 474 N 5.17 0.50 -2.68 4.25 2.10 -0.99 -3.40 117.51 122.45 1u3d h ILE 474 Ca -0.45 -0.35 -0.13 0.00 1.08 0.00 0.00 64.86 65.01 1u3d h ILE 474 Cb 1.34 1.23 -0.27 0.00 -1.09 0.00 0.00 36.82 38.03 1u3d h ILE 474 CO 0.97 0.07 -0.34 -0.69 -1.08 0.00 0.00 178.15 177.09 1u3d s VAL 475 N -4.29 -0.11 0.61 2.19 1.01 -1.26 -5.15 120.40 113.39 1u3d s VAL 475 Ca -0.03 0.12 -0.16 0.00 0.00 0.00 0.00 61.98 61.90 1u3d s VAL 475 Cb 0.14 -0.58 -0.03 0.00 0.00 0.00 0.00 36.38 35.91 1u3d s VAL 475 CO 0.56 0.05 1.09 -0.83 0.00 0.00 0.00 175.10 175.97 1u3d s GLY 476 N 1.56 2.22 0.07 4.51 0.00 -1.26 -4.90 107.32 109.53 1u3d s GLY 476 Ca -0.08 0.52 -0.22 0.00 0.00 0.00 0.00 44.72 44.94 1u3d s GLY 476 CO -0.12 0.86 1.59 1.41 0.00 0.00 0.00 173.10 176.84 1u3d h LEU 477 N 0.42 0.16 -0.58 0.66 3.38 -1.98 0.75 115.31 118.13 1u3d h LEU 477 Ca -0.47 -0.19 0.08 0.00 0.09 0.00 0.00 57.88 57.39 1u3d h LEU 477 Cb 1.24 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.88 1u3d h LEU 477 CO 0.56 0.31 0.23 0.44 0.09 0.00 0.00 178.44 180.07 1u3d h ASP 478 N 0.01 0.25 0.42 -0.43 3.32 -2.00 0.90 116.42 118.89 1u3d h ASP 478 Ca 0.04 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.08 1u3d h ASP 478 Cb 0.20 0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.77 1u3d h ASP 478 CO -0.00 0.16 -0.36 -0.08 -1.72 0.00 0.00 179.24 177.24 1u3d h GLU 479 N 0.42 0.00 -0.02 3.56 4.81 -1.92 -2.49 114.58 118.95 1u3d h GLU 479 Ca 0.28 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.51 1u3d h GLU 479 Cb 0.31 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.69 1u3d h GLU 479 CO -0.27 0.36 -0.00 0.00 -0.73 0.00 0.00 179.01 178.37 1u3d h ALA 480 N 1.64 0.03 -0.66 2.92 0.00 0.14 -2.13 119.26 121.21 1u3d h ALA 480 Ca -0.00 -0.18 0.05 0.00 0.00 0.00 0.00 54.91 54.77 1u3d h ALA 480 Cb 0.66 -0.01 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 1u3d h ALA 480 CO 0.05 -0.29 0.44 -0.22 0.00 0.00 0.00 179.25 179.23 1u3d h LYS 481 N -0.30 0.70 -0.37 0.00 1.63 -0.80 -0.83 116.57 116.59 1u3d h LYS 481 Ca 0.01 -0.04 -0.16 0.00 -0.85 0.00 0.00 60.65 59.60 1u3d h LYS 481 Cb 0.36 -0.16 -0.01 0.00 -0.60 0.00 0.00 32.23 31.83 1u3d h LYS 481 CO 0.00 0.46 -0.39 0.00 -3.45 0.00 0.00 179.45 176.07 1u3d h ALA 482 N 1.63 0.54 -0.01 5.00 0.00 -1.35 -1.02 119.26 124.06 1u3d h ALA 482 Ca 0.27 -0.46 -0.14 0.00 0.00 0.00 0.00 54.91 54.58 1u3d h ALA 482 Cb 0.17 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.83 1u3d h ALA 482 CO -0.08 0.65 -0.67 -0.09 0.00 0.00 0.00 179.25 179.06 1u3d h ARG 483 N 0.73 0.03 -0.39 0.00 2.43 -0.90 0.22 114.38 116.49 1u3d h ARG 483 Ca 0.06 -0.02 0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1u3d h ARG 483 Cb 0.99 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.52 1u3d h ARG 483 CO 0.10 0.69 0.25 1.25 -1.51 0.00 0.00 179.97 180.74 1u3d h LEU 484 N 0.02 0.42 0.21 3.80 5.85 -0.93 0.72 115.31 125.40 1u3d h LEU 484 Ca -0.01 -0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.70 1u3d h LEU 484 Cb 1.20 -0.10 0.00 0.00 0.37 0.00 0.00 40.66 42.13 1u3d h LEU 484 CO 0.09 0.30 -0.10 0.45 -0.34 0.00 0.00 178.44 178.84 1u3d h HIS 485 N 0.51 -0.26 -0.87 1.25 3.86 -0.97 -1.02 115.15 117.65 1u3d h HIS 485 Ca 0.15 -0.01 0.14 0.00 -1.16 0.00 0.00 60.37 59.49 1u3d h HIS 485 Cb -0.03 0.09 -0.07 0.00 1.06 0.00 0.00 27.41 28.46 1u3d h HIS 485 CO -0.06 0.06 0.56 1.49 0.86 0.00 0.00 177.93 180.84 1u3d h GLU 486 N -0.59 0.64 -0.44 2.45 4.57 -0.74 0.11 114.58 120.57 1u3d h GLU 486 Ca -0.03 -0.04 -0.11 0.00 -1.18 0.00 0.00 59.36 58.00 1u3d h GLU 486 Cb 0.43 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.86 1u3d h GLU 486 CO 0.05 0.42 -0.17 0.00 -1.18 0.00 0.00 179.01 178.13 1u3d h ALA 487 N 1.60 0.86 0.07 2.92 0.00 0.89 -2.54 119.26 123.06 1u3d h ALA 487 Ca 0.43 -0.36 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1u3d h ALA 487 Cb 0.72 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.34 1u3d h ALA 487 CO -0.19 0.64 -0.03 -0.07 0.00 0.00 0.00 179.25 179.60 1u3d h LEU 488 N 0.76 -0.08 -1.15 0.00 3.38 0.29 -0.84 115.31 117.67 1u3d h LEU 488 Ca 0.11 -0.28 0.29 0.00 0.09 0.00 0.00 57.88 58.09 1u3d h LEU 488 Cb 0.70 0.02 -0.12 0.00 0.09 0.00 0.00 40.66 41.35 1u3d h LEU 488 CO 0.05 0.24 0.64 0.28 0.09 0.00 0.00 178.44 179.74 1u3d h SER 489 N -0.40 0.53 -0.06 -0.43 0.02 -0.81 0.16 113.55 112.56 1u3d h SER 489 Ca -0.01 0.13 -0.05 0.00 -0.84 0.00 0.00 61.79 61.02 1u3d h SER 489 Cb 0.35 0.06 0.00 0.00 0.14 0.00 0.00 62.40 62.95 1u3d h SER 489 CO 0.02 0.02 -0.16 -0.61 -1.14 0.00 0.00 176.83 174.96 1u3d h GLN 490 N 0.42 0.21 -0.31 3.45 4.15 -1.22 -2.36 115.11 119.45 1u3d h GLN 490 Ca 0.66 -0.15 -0.06 0.00 0.77 0.00 0.00 58.65 59.87 1u3d h GLN 490 Cb 1.53 0.02 -0.02 0.00 0.21 0.00 0.00 27.48 29.23 1u3d h GLN 490 CO -0.44 0.77 -0.06 0.00 -1.93 0.00 0.00 178.83 177.16 1u3d h MET 491 N -0.31 0.51 -0.67 1.69 -0.00 0.60 0.40 114.93 117.15 1u3d h MET 491 Ca -0.00 -0.13 -0.04 0.00 -0.00 0.00 0.00 59.70 59.53 1u3d h MET 491 Cb 0.78 -0.06 -0.03 0.00 -0.00 0.00 0.00 31.60 32.29 1u3d h MET 491 CO 0.04 0.58 0.26 -1.49 -0.00 0.00 0.00 176.91 176.30 1u3d h TRP 492 N 0.48 1.03 -0.48 -0.10 6.55 -0.83 0.77 115.95 123.37 1u3d h TRP 492 Ca 0.10 -0.08 -0.07 0.00 0.95 0.00 0.00 58.89 59.79 1u3d h TRP 492 Cb 0.41 -0.31 -0.02 0.00 -0.86 0.00 0.00 29.16 28.38 1u3d h TRP 492 CO 0.01 0.81 0.02 1.96 -1.05 0.00 0.00 178.44 180.19 1u3d h GLN 493 N 0.96 0.79 -0.03 0.49 4.20 -0.82 -2.02 115.11 118.68 1u3d h GLN 493 Ca 0.22 -0.20 -0.10 0.00 0.06 0.00 0.00 58.65 58.64 1u3d h GLN 493 Cb 0.22 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.89 1u3d h GLN 493 CO -0.02 0.78 -0.43 -0.07 -0.67 0.00 0.00 178.83 178.42 1u3d h LEU 494 N 0.74 0.06 -1.19 1.46 -0.00 -0.18 -2.72 115.31 113.47 1u3d h LEU 494 Ca 0.15 -0.02 0.05 0.00 -0.00 0.00 0.00 57.88 58.05 1u3d h LEU 494 Cb 0.42 -0.02 -0.05 0.00 -0.00 0.00 0.00 40.66 41.01 1u3d h LEU 494 CO 0.02 0.48 0.56 -0.33 -0.00 0.00 0.00 178.44 179.17 1u3d h GLU 495 N 0.05 1.00 -4.93 1.13 5.08 -0.11 -3.23 114.58 113.57 1u3d h GLU 495 Ca 0.00 -0.06 -0.47 0.00 -1.00 0.00 0.00 59.36 57.83 1u3d h GLU 495 Cb 0.79 -0.23 0.04 0.00 0.50 0.00 0.00 28.75 29.85 1u3d h GLU 495 CO 0.06 0.66 1.46 0.00 -1.00 0.00 0.00 179.01 180.19 1u3d n ALA 496 N -2.41 1.94 0.00 3.43 0.00 -1.03 -5.11 120.51 117.33 1u3d n ALA 496 Ca 0.12 -2.95 0.00 0.00 0.00 0.00 0.00 53.44 50.61 1u3d n ALA 496 Cb 0.14 -3.58 0.00 0.00 0.00 0.00 0.00 19.45 16.01 1u3d n ALA 496 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50