#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3dgh s TYR 8 N 0.00 3.44 0.29 7.33 1.51 -1.26 -5.00 117.35 123.66 3dgh s TYR 8 Ca 0.00 0.68 0.00 0.00 -1.01 0.00 0.00 57.07 56.75 3dgh s TYR 8 Cb 0.00 -2.39 0.44 0.00 -0.11 0.00 0.00 41.96 39.90 3dgh s TYR 8 CO 0.00 -0.41 1.82 -0.44 -1.11 0.00 0.00 175.55 175.41 3dgh h ASP 9 N 0.16 0.68 -4.44 2.29 3.32 -1.84 -3.45 116.42 113.16 3dgh h ASP 9 Ca -0.47 -0.14 -0.33 0.00 0.02 0.00 0.00 57.03 56.12 3dgh h ASP 9 Cb 1.22 -0.18 -0.19 0.00 0.22 0.00 0.00 39.33 40.41 3dgh h ASP 9 CO 0.61 0.72 -0.74 -0.31 -1.72 0.00 0.00 179.24 177.80 3dgh s TYR 10 N -5.07 1.04 0.14 4.55 1.51 -0.72 -5.01 117.35 113.79 3dgh s TYR 10 Ca -0.09 -0.61 -0.12 0.00 -1.01 0.00 0.00 57.07 55.24 3dgh s TYR 10 Cb 0.15 -0.58 -0.02 0.00 -0.11 0.00 0.00 41.96 41.41 3dgh s TYR 10 CO 0.79 0.00 1.53 -0.44 -1.11 0.00 0.00 175.55 176.32 3dgh h ASP 11 N 3.78 0.91 -3.55 2.29 3.45 -1.43 -2.67 116.42 119.20 3dgh h ASP 11 Ca -0.38 -0.40 -0.29 0.00 0.43 0.00 0.00 57.03 56.39 3dgh h ASP 11 Cb 1.19 -0.25 -0.33 0.00 -0.56 0.00 0.00 39.33 39.38 3dgh h ASP 11 CO 0.49 1.10 -0.73 -0.22 -1.57 0.00 0.00 179.24 178.32 3dgh s LEU 12 N -9.13 1.22 -0.18 1.55 2.96 -0.96 -1.26 118.68 112.88 3dgh s LEU 12 Ca -0.12 0.03 -0.01 0.00 -0.22 0.00 0.00 54.13 53.81 3dgh s LEU 12 Cb 0.11 -0.07 -0.00 0.00 0.50 0.00 0.00 46.19 46.72 3dgh s LEU 12 CO 0.85 -0.11 -0.12 -0.63 -1.32 0.00 0.00 176.35 175.02 3dgh s ILE 13 N 0.91 2.88 -0.22 6.68 1.01 -0.78 -1.87 121.20 129.81 3dgh s ILE 13 Ca -0.08 -0.68 -0.12 0.00 0.00 0.00 0.00 60.65 59.77 3dgh s ILE 13 Cb -0.11 -2.25 -0.05 0.00 0.01 0.00 0.00 42.46 40.06 3dgh s ILE 13 CO -0.02 0.49 0.23 -0.69 0.00 0.00 0.00 174.94 174.95 3dgh s VAL 14 N 1.02 5.32 -0.47 2.92 1.01 0.18 -1.63 120.40 128.75 3dgh s VAL 14 Ca -0.01 0.35 -0.13 0.00 0.00 0.00 0.00 61.98 62.19 3dgh s VAL 14 Cb -0.15 -3.57 0.09 0.00 0.00 0.00 0.00 36.38 32.75 3dgh s VAL 14 CO -0.02 0.33 0.37 -0.63 0.00 0.00 0.00 175.10 175.15 3dgh s ILE 15 N 1.04 4.87 0.00 2.22 1.01 0.07 -0.81 121.20 129.60 3dgh s ILE 15 Ca 0.11 -1.28 0.00 0.00 0.00 0.00 0.00 60.65 59.48 3dgh s ILE 15 Cb -0.14 -3.98 0.00 0.00 0.01 0.00 0.00 42.46 38.35 3dgh s ILE 15 CO 0.05 -0.62 0.00 0.61 0.00 0.00 0.00 174.94 174.98 3dgh n GLY 16 N 5.11 3.86 2.32 6.18 0.00 0.12 -0.45 105.19 122.33 3dgh n GLY 16 Ca -0.12 -1.32 -0.27 0.00 0.00 0.00 0.00 46.02 44.31 3dgh n GLY 16 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dgh n GLY 17 N 0.12 6.13 0.00 -0.02 0.00 -1.15 -4.24 105.19 106.04 3dgh n GLY 17 Ca 0.00 -2.71 0.00 0.00 0.00 0.00 0.00 46.02 43.31 3dgh n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dgh n GLY 18 N -0.58 2.93 0.16 -0.02 0.00 -1.26 -2.59 105.19 103.83 3dgh n GLY 18 Ca 0.42 -1.97 -0.06 0.00 0.00 0.00 0.00 46.02 44.41 3dgh n GLY 18 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 3dgh h SER 19 N 0.00 -0.35 -0.08 1.61 0.02 -1.94 -1.23 113.55 111.58 3dgh h SER 19 Ca 0.00 0.10 -0.12 0.00 -0.84 0.00 0.00 61.79 60.93 3dgh h SER 19 Cb 0.00 0.21 0.01 0.00 0.14 0.00 0.00 62.40 62.76 3dgh h SER 19 CO 0.00 -0.13 -0.42 0.00 -1.14 0.00 0.00 176.83 175.15 3dgh h ALA 20 N 1.26 0.16 -0.18 3.77 0.00 -1.89 -2.96 119.26 119.41 3dgh h ALA 20 Ca 0.15 -0.48 -0.04 0.00 0.00 0.00 0.00 54.91 54.54 3dgh h ALA 20 Cb 0.26 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 3dgh h ALA 20 CO -0.33 0.29 -0.06 0.78 0.00 0.00 0.00 179.25 179.93 3dgh h GLY 21 N -0.02 0.39 1.03 0.00 0.00 -1.71 -0.37 103.07 102.40 3dgh h GLY 21 Ca -0.03 -0.33 -0.05 0.00 0.00 0.00 0.00 47.33 46.91 3dgh h GLY 21 CO 0.09 0.31 0.21 1.41 0.00 0.00 0.00 176.54 178.55 3dgh h LEU 22 N 0.07 0.98 -0.68 3.11 4.07 -1.36 0.48 115.31 121.99 3dgh h LEU 22 Ca 0.04 -0.21 -0.04 0.00 0.08 0.00 0.00 57.88 57.75 3dgh h LEU 22 Cb 0.51 -0.26 -0.03 0.00 1.08 0.00 0.00 40.66 41.97 3dgh h LEU 22 CO 0.02 0.93 0.25 0.00 -1.08 0.00 0.00 178.44 178.56 3dgh h ALA 23 N 1.09 0.88 -0.10 1.53 0.00 -1.34 -0.83 119.26 120.49 3dgh h ALA 23 Ca 0.22 -0.19 -0.02 0.00 0.00 0.00 0.00 54.91 54.92 3dgh h ALA 23 Cb 0.30 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.82 3dgh h ALA 23 CO -0.01 0.52 -0.01 0.00 0.00 0.00 0.00 179.25 179.75 3dgh h ALA 25 N 0.72 0.53 -0.64 0.00 0.00 -0.77 0.73 119.26 119.83 3dgh h ALA 25 Ca 0.03 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.75 3dgh h ALA 25 Cb 0.39 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 3dgh h ALA 25 CO 0.01 0.15 0.25 0.87 0.00 0.00 0.00 179.25 180.52 3dgh h LYS 26 N 0.52 0.96 -0.21 0.00 1.57 -1.19 -2.27 116.57 115.95 3dgh h LYS 26 Ca 0.14 -0.18 -0.16 0.00 -1.87 0.00 0.00 60.65 58.58 3dgh h LYS 26 Cb 0.21 -0.15 -0.01 0.00 0.08 0.00 0.00 32.23 32.36 3dgh h LYS 26 CO -0.01 0.81 -0.52 1.49 -0.57 0.00 0.00 179.45 180.65 3dgh h GLU 27 N 0.90 0.60 -0.60 3.15 4.57 -1.15 -2.29 114.58 119.76 3dgh h GLU 27 Ca 0.21 -0.37 0.01 0.00 -1.18 0.00 0.00 59.36 58.03 3dgh h GLU 27 Cb 0.22 0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.82 3dgh h GLU 27 CO -0.02 0.98 0.40 0.00 -1.18 0.00 0.00 179.01 179.19 3dgh h ALA 28 N 0.95 0.76 -0.57 2.92 0.00 -0.65 -1.94 119.26 120.74 3dgh h ALA 28 Ca 0.02 -0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 3dgh h ALA 28 Cb 1.07 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 18.59 3dgh h ALA 28 CO 0.10 0.20 0.06 0.28 0.00 0.00 0.00 179.25 179.89 3dgh h VAL 29 N 0.81 1.25 0.00 0.00 2.07 -1.29 -1.20 116.25 117.89 3dgh h VAL 29 Ca 0.22 -1.00 -0.01 0.00 0.82 0.00 0.00 66.70 66.73 3dgh h VAL 29 Cb -0.09 0.75 -0.00 0.00 -1.52 0.00 0.00 31.29 30.43 3dgh h VAL 29 CO -0.05 0.37 -0.04 0.25 0.02 0.00 0.00 177.57 178.12 3dgh h LEU 30 N 0.87 0.00 -2.98 2.57 5.85 -1.01 -2.02 115.31 118.60 3dgh h LEU 30 Ca 0.17 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.89 3dgh h LEU 30 Cb 0.43 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.46 3dgh h LEU 30 CO 0.01 0.04 0.00 0.59 -0.34 0.00 0.00 178.44 178.75 3dgh n ASN 31 N -4.07 4.57 0.00 1.25 4.13 -0.76 -4.95 115.26 115.42 3dgh n ASN 31 Ca -0.03 -2.41 0.00 0.00 1.68 0.00 0.00 54.58 53.82 3dgh n ASN 31 Cb 0.13 -0.57 0.00 0.00 -1.54 0.00 0.00 39.78 37.80 3dgh n ASN 31 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 3dgh n GLY 32 N 1.14 0.69 3.79 7.41 0.00 -0.76 -4.69 105.19 112.77 3dgh n GLY 32 Ca 0.25 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.91 3dgh n GLY 32 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dgh s ALA 33 N -2.32 3.13 -0.32 4.61 0.00 -0.51 -4.99 121.76 121.36 3dgh s ALA 33 Ca 0.00 0.58 -0.20 0.00 0.00 0.00 0.00 51.96 52.33 3dgh s ALA 33 Cb 0.00 -3.21 -0.01 0.00 0.00 0.00 0.00 23.12 19.90 3dgh s ALA 33 CO 0.00 0.01 0.63 0.50 0.00 0.00 0.00 175.76 176.90 3dgh s ARG 34 N -2.41 3.82 0.01 0.00 3.52 -1.26 -4.18 118.95 118.45 3dgh s ARG 34 Ca 0.55 0.20 0.04 0.00 -0.13 0.00 0.00 55.73 56.39 3dgh s ARG 34 Cb -0.18 -3.76 -0.01 0.00 -1.56 0.00 0.00 34.95 29.43 3dgh s ARG 34 CO 0.24 -0.63 -0.11 0.54 -0.81 0.00 0.00 175.30 174.53 3dgh s VAL 35 N 2.63 0.85 0.01 7.11 0.11 -1.26 -1.13 120.40 128.73 3dgh s VAL 35 Ca 0.25 -0.69 0.05 0.00 -2.93 0.00 0.00 61.98 58.66 3dgh s VAL 35 Cb -0.15 -0.76 -0.03 0.00 -1.53 0.00 0.00 36.38 33.91 3dgh s VAL 35 CO 0.13 0.07 -0.14 0.00 -3.33 0.00 0.00 175.10 171.82 3dgh s ALA 36 N -0.58 2.71 -0.12 1.54 0.00 -0.78 -2.66 121.76 121.87 3dgh s ALA 36 Ca 0.01 -1.10 0.01 0.00 0.00 0.00 0.00 51.96 50.88 3dgh s ALA 36 Cb -0.06 -0.88 0.02 0.00 0.00 0.00 0.00 23.12 22.20 3dgh s ALA 36 CO 0.00 0.58 -0.12 0.00 0.00 0.00 0.00 175.76 176.22 3dgh s LEU 38 N 1.33 4.42 -0.05 0.00 1.02 0.01 -1.16 118.68 124.24 3dgh s LEU 38 Ca -0.00 0.83 -0.03 0.00 0.02 0.00 0.00 54.13 54.95 3dgh s LEU 38 Cb -0.14 -2.51 0.03 0.00 0.02 0.00 0.00 46.19 43.59 3dgh s LEU 38 CO -0.06 0.27 0.13 -0.62 0.02 0.00 0.00 176.35 176.09 3dgh s ASP 39 N -0.70 -0.10 -0.07 2.29 2.15 -0.52 0.16 116.67 119.88 3dgh s ASP 39 Ca 0.22 0.26 -0.05 0.00 0.43 0.00 0.00 52.55 53.40 3dgh s ASP 39 Cb -0.15 0.18 0.02 0.00 -0.30 0.00 0.00 42.92 42.67 3dgh s ASP 39 CO 0.11 -0.11 0.18 0.12 -0.17 0.00 0.00 175.17 175.29 3dgh s PHE 40 N 0.82 -0.20 -0.33 -5.34 5.36 -1.26 -3.12 117.98 113.91 3dgh s PHE 40 Ca -0.06 0.50 -0.07 0.00 -0.96 0.00 0.00 56.93 56.33 3dgh s PHE 40 Cb -0.08 0.04 0.03 0.00 -0.34 0.00 0.00 43.02 42.66 3dgh s PHE 40 CO -0.04 -0.12 0.12 0.08 -1.46 0.00 0.00 175.22 173.80 3dgh s VAL 41 N 0.39 4.00 0.04 3.12 1.01 -1.26 -4.99 120.40 122.70 3dgh s VAL 41 Ca -0.02 -0.95 -0.31 0.00 0.00 0.00 0.00 61.98 60.70 3dgh s VAL 41 Cb -0.04 -3.20 -0.06 0.00 0.00 0.00 0.00 36.38 33.08 3dgh s VAL 41 CO -0.02 -0.12 1.34 -0.75 0.00 0.00 0.00 175.10 175.56 3dgh s LYS 42 N 1.46 4.33 0.67 2.72 2.20 -1.26 -4.88 119.74 124.98 3dgh s LYS 42 Ca 0.00 1.93 -0.16 0.00 -0.36 0.00 0.00 55.97 57.38 3dgh s LYS 42 Cb -0.19 -3.43 0.01 0.00 -1.51 0.00 0.00 37.83 32.70 3dgh s LYS 42 CO 0.03 -0.46 1.19 -2.14 -0.36 0.00 0.00 175.35 173.61 3dgh s PRO 43 N 1.74 2.56 0.61 4.03 0.02 -1.26 -4.92 135.00 137.78 3dgh s PRO 43 Ca 0.62 1.70 -0.19 0.00 0.02 0.00 0.00 61.00 63.15 3dgh s PRO 43 Cb -0.32 -1.89 -0.03 0.00 0.02 0.00 0.00 34.50 32.28 3dgh s PRO 43 CO 0.28 -1.50 1.29 0.95 -0.33 0.00 0.00 177.00 177.69 3dgh s THR 44 N -1.93 2.19 0.09 0.99 -4.23 -0.22 -4.83 115.64 107.70 3dgh s THR 44 Ca 0.74 0.13 -0.30 0.00 -1.18 0.00 0.00 61.69 61.07 3dgh s THR 44 Cb -0.28 -3.05 -0.05 0.00 1.34 0.00 0.00 72.50 70.46 3dgh s THR 44 CO 0.40 -0.02 1.03 -2.16 -0.54 0.00 0.00 174.62 173.33 3dgh s PRO 45 N -3.25 4.60 0.55 3.99 0.04 -1.26 -2.02 135.00 137.64 3dgh s PRO 45 Ca 0.79 1.55 0.00 0.00 0.04 0.00 0.00 61.00 63.37 3dgh s PRO 45 Cb -0.36 -3.37 0.00 0.00 0.04 0.00 0.00 34.50 30.80 3dgh s PRO 45 CO 0.40 0.05 0.00 2.41 0.04 0.00 0.00 177.00 179.90 3dgh n THR 46 N 3.13 -4.36 0.00 1.26 -1.04 -1.26 -4.60 114.28 107.41 3dgh n THR 46 Ca 0.04 2.02 0.00 0.00 -2.04 0.00 0.00 64.05 64.07 3dgh n THR 46 Cb 0.49 -2.94 0.00 0.00 -1.82 0.00 0.00 70.33 66.05 3dgh n THR 46 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 3dgh n LEU 47 N -1.55 0.00 -1.46 -4.42 4.77 -1.26 -4.46 117.00 108.61 3dgh n LEU 47 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 3dgh n LEU 47 Cb 0.18 0.00 -0.01 0.00 -2.33 0.00 0.00 43.42 41.27 3dgh n LEU 47 CO 0.00 0.00 -0.16 0.61 -1.33 0.00 0.00 177.39 176.51 3dgh n GLY 48 N 0.00 -0.15 3.74 -0.72 0.00 -0.86 -4.96 105.19 102.24 3dgh n GLY 48 Ca 0.00 -0.35 -0.41 0.00 0.00 0.00 0.00 46.02 45.26 3dgh n GLY 48 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3dgh s THR 49 N -2.64 2.82 0.24 2.61 2.01 -1.26 -4.49 115.64 114.93 3dgh s THR 49 Ca 0.01 0.66 -0.02 0.00 0.31 0.00 0.00 61.69 62.65 3dgh s THR 49 Cb -0.00 -3.42 -0.03 0.00 0.01 0.00 0.00 72.50 69.05 3dgh s THR 49 CO 0.01 0.10 0.25 -1.59 -0.69 0.00 0.00 174.62 172.69 3dgh s LYS 50 N -0.06 1.41 0.35 4.92 -2.85 -1.26 -1.06 119.74 121.19 3dgh s LYS 50 Ca 0.60 -1.63 -0.18 0.00 -1.00 0.00 0.00 55.97 53.77 3dgh s LYS 50 Cb -0.41 0.33 0.04 0.00 -2.06 0.00 0.00 37.83 35.74 3dgh s LYS 50 CO 0.40 -0.51 0.76 1.67 0.10 0.00 0.00 175.35 177.77 3dgh s TRP 51 N -3.93 0.01 0.00 1.78 -2.14 -1.26 -5.10 118.94 108.30 3dgh s TRP 51 Ca 0.35 -0.60 0.00 0.00 2.66 0.00 0.00 56.10 58.51 3dgh s TRP 51 Cb 0.04 0.79 0.00 0.00 -3.10 0.00 0.00 33.47 31.20 3dgh s TRP 51 CO 0.15 -1.45 0.00 0.41 -2.66 0.00 0.00 176.95 173.40 3dgh n GLY 52 N -0.50 -0.01 3.81 3.67 0.00 -1.26 -4.80 105.19 106.09 3dgh n GLY 52 Ca -0.07 -1.77 -0.31 0.00 0.00 0.00 0.00 46.02 43.88 3dgh n GLY 52 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dgh s VAL 53 N 0.38 3.65 0.00 1.61 0.11 -1.26 -4.49 120.40 120.39 3dgh s VAL 53 Ca 0.00 0.54 0.00 0.00 -2.93 0.00 0.00 61.98 59.59 3dgh s VAL 53 Cb 0.00 -3.25 0.00 0.00 -1.53 0.00 0.00 36.38 31.60 3dgh s VAL 53 CO 0.00 -0.70 0.00 0.61 -3.33 0.00 0.00 175.10 171.68 3dgh n GLY 54 N -1.92 0.76 2.86 6.54 0.00 -1.07 -4.74 105.19 107.62 3dgh n GLY 54 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 3dgh n GLY 54 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dgh n GLY 55 N -0.98 -1.79 0.16 -0.02 0.00 -1.19 -3.94 105.19 97.43 3dgh n GLY 55 Ca 0.00 -1.76 -0.14 0.00 0.00 0.00 0.00 46.02 44.12 3dgh n GLY 55 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 3dgh h THR 56 N 0.00 1.36 0.19 2.61 2.02 -1.96 -3.08 112.91 114.05 3dgh h THR 56 Ca 0.00 -1.55 -0.01 0.00 0.77 0.00 0.00 66.41 65.63 3dgh h THR 56 Cb 0.00 1.99 -0.00 0.00 -1.74 0.00 0.00 68.15 68.40 3dgh h THR 56 CO 0.00 0.46 -0.12 0.00 0.37 0.00 0.00 175.52 176.23 3dgh h VAL 58 N -0.30 1.21 0.06 0.00 2.07 -1.79 -2.17 116.25 115.33 3dgh h VAL 58 Ca -0.02 -0.62 -0.37 0.00 0.82 0.00 0.00 66.70 66.52 3dgh h VAL 58 Cb 0.25 0.57 -0.04 0.00 -1.52 0.00 0.00 31.29 30.55 3dgh h VAL 58 CO 0.02 0.24 -2.19 0.59 0.02 0.00 0.00 177.57 176.26 3dgh n ASN 59 N -4.53 1.84 -1.15 0.57 3.02 -1.13 -4.43 115.26 109.45 3dgh n ASN 59 Ca 0.03 0.08 0.01 0.00 -0.03 0.00 0.00 54.58 54.67 3dgh n ASN 59 Cb 0.13 -0.51 0.00 0.00 -0.61 0.00 0.00 39.78 38.80 3dgh n ASN 59 CO 0.00 0.00 0.00 1.33 -2.62 0.00 0.00 177.26 175.97 3dgh n VAL 60 N -3.32 0.00 0.00 2.41 0.24 0.01 -4.83 118.33 112.85 3dgh n VAL 60 Ca -0.36 -0.58 0.00 0.00 -2.04 0.00 0.00 64.34 61.35 3dgh n VAL 60 Cb 1.03 0.77 0.00 0.00 -1.47 0.00 0.00 33.84 34.17 3dgh n VAL 60 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dgh n GLY 61 N 0.29 4.42 0.28 7.63 0.00 0.41 -4.70 105.19 113.51 3dgh n GLY 61 Ca -0.00 -0.58 0.06 0.00 0.00 0.00 0.00 46.02 45.50 3dgh n GLY 61 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dgh h ILE 63 N 0.43 0.00 -0.54 0.00 1.08 -1.67 0.47 117.51 117.28 3dgh h ILE 63 Ca 0.42 -0.37 0.02 0.00 -0.39 0.00 0.00 64.86 64.54 3dgh h ILE 63 Cb 0.66 0.00 -0.03 0.00 -3.07 0.00 0.00 36.82 34.38 3dgh h ILE 63 CO -0.42 0.00 0.36 1.55 -0.69 0.00 0.00 178.15 178.95 3dgh h PRO 64 N -1.02 0.66 -0.19 2.37 0.13 -1.76 -1.03 132.00 131.16 3dgh h PRO 64 Ca -0.07 -0.04 -0.00 0.00 -0.87 0.00 0.00 66.00 65.02 3dgh h PRO 64 Cb 0.50 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.47 3dgh h PRO 64 CO 0.11 0.44 0.12 -0.22 -0.23 0.00 0.00 178.00 178.21 3dgh h LYS 65 N 0.68 0.26 -0.92 0.86 3.11 -1.26 -0.93 116.57 118.37 3dgh h LYS 65 Ca 0.21 -0.02 -0.01 0.00 -2.81 0.00 0.00 60.65 58.01 3dgh h LYS 65 Cb 0.00 -0.05 -0.04 0.00 -1.00 0.00 0.00 32.23 31.14 3dgh h LYS 65 CO -0.05 0.22 0.54 -0.22 -2.81 0.00 0.00 179.45 177.13 3dgh h LYS 66 N 0.23 1.26 -0.29 1.90 1.63 -0.28 -0.89 116.57 120.12 3dgh h LYS 66 Ca 0.07 -0.13 -0.13 0.00 -0.85 0.00 0.00 60.65 59.62 3dgh h LYS 66 Cb 0.03 -0.26 -0.01 0.00 -0.60 0.00 0.00 32.23 31.39 3dgh h LYS 66 CO -0.01 0.90 -0.34 -0.07 -3.45 0.00 0.00 179.45 176.48 3dgh h LEU 67 N 1.28 0.67 -0.51 5.20 3.38 -0.92 0.41 115.31 124.83 3dgh h LEU 67 Ca 0.33 -0.28 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 3dgh h LEU 67 Cb -0.03 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 3dgh h LEU 67 CO -0.06 0.96 -0.21 0.24 0.09 0.00 0.00 178.44 179.45 3dgh h MET 68 N 0.54 0.99 -0.47 1.13 2.86 -0.89 -0.44 114.93 118.65 3dgh h MET 68 Ca 0.06 -0.42 0.04 0.00 -2.06 0.00 0.00 59.70 57.31 3dgh h MET 68 Cb 0.84 -0.03 -0.04 0.00 0.06 0.00 0.00 31.60 32.43 3dgh h MET 68 CO 0.07 1.10 0.25 1.25 1.06 0.00 0.00 176.91 180.64 3dgh h HIS 69 N 0.85 0.46 -0.71 -0.22 -0.00 -0.98 -1.20 115.15 113.35 3dgh h HIS 69 Ca 0.11 0.02 -0.03 0.00 -0.00 0.00 0.00 60.37 60.47 3dgh h HIS 69 Cb 0.79 -0.14 -0.03 0.00 -0.00 0.00 0.00 27.41 28.03 3dgh h HIS 69 CO 0.05 0.24 0.33 0.37 -0.00 0.00 0.00 177.93 178.92 3dgh h GLN 70 N 0.50 1.03 -0.68 5.26 5.75 -0.65 0.48 115.11 126.80 3dgh h GLN 70 Ca 0.20 -0.16 0.06 0.00 -0.15 0.00 0.00 58.65 58.60 3dgh h GLN 70 Cb 0.09 -0.18 -0.05 0.00 1.07 0.00 0.00 27.48 28.40 3dgh h GLN 70 CO -0.13 0.82 0.38 0.00 -2.65 0.00 0.00 178.83 177.25 3dgh h ALA 71 N 1.16 0.91 -0.08 3.38 0.00 -0.66 0.17 119.26 124.14 3dgh h ALA 71 Ca 0.24 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.16 3dgh h ALA 71 Cb 0.14 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.79 3dgh h ALA 71 CO -0.03 0.07 0.03 1.03 0.00 0.00 0.00 179.25 180.35 3dgh h SER 72 N 0.71 0.11 -0.69 0.00 0.87 -0.59 -2.43 113.55 111.53 3dgh h SER 72 Ca 0.30 -0.16 0.04 0.00 -1.23 0.00 0.00 61.79 60.74 3dgh h SER 72 Cb 0.18 -0.03 -0.04 0.00 -0.44 0.00 0.00 62.40 62.07 3dgh h SER 72 CO -0.18 0.23 0.45 -0.07 -0.53 0.00 0.00 176.83 176.74 3dgh h LEU 73 N -0.03 0.69 -1.03 2.23 3.38 -0.38 -1.79 115.31 118.38 3dgh h LEU 73 Ca 0.03 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 3dgh h LEU 73 Cb 0.16 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.74 3dgh h LEU 73 CO -0.00 0.47 -0.17 -0.07 0.09 0.00 0.00 178.44 178.75 3dgh h LEU 74 N 0.80 0.48 -0.63 1.67 3.38 -0.46 -0.38 115.31 120.16 3dgh h LEU 74 Ca 0.28 -0.14 0.02 0.00 0.09 0.00 0.00 57.88 58.13 3dgh h LEU 74 Cb 0.11 -0.13 -0.04 0.00 0.09 0.00 0.00 40.66 40.70 3dgh h LEU 74 CO -0.08 0.67 0.40 1.23 0.09 0.00 0.00 178.44 180.75 3dgh h GLY 75 N 0.96 0.90 0.99 0.83 0.00 -0.85 -1.89 103.07 104.01 3dgh h GLY 75 Ca 0.08 -0.31 -0.02 0.00 0.00 0.00 0.00 47.33 47.08 3dgh h GLY 75 CO 0.04 0.28 0.32 0.83 0.00 0.00 0.00 176.54 178.01 3dgh h GLU 76 N 0.80 0.87 -1.00 4.80 5.08 -1.02 -2.37 114.58 121.74 3dgh h GLU 76 Ca 0.24 -0.11 0.08 0.00 -1.00 0.00 0.00 59.36 58.57 3dgh h GLU 76 Cb -0.03 -0.17 -0.07 0.00 0.50 0.00 0.00 28.75 28.99 3dgh h GLU 76 CO -0.08 0.68 0.64 0.00 -1.00 0.00 0.00 179.01 179.25 3dgh h ALA 77 N 1.15 1.45 -0.37 3.43 0.00 -0.74 -0.04 119.26 124.14 3dgh h ALA 77 Ca 0.22 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 3dgh h ALA 77 Cb 0.07 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 3dgh h ALA 77 CO -0.03 0.38 0.20 0.28 0.00 0.00 0.00 179.25 180.07 3dgh h VAL 78 N 1.12 1.14 -0.51 0.00 2.07 -0.84 0.13 116.25 119.36 3dgh h VAL 78 Ca 0.45 -0.38 0.00 0.00 0.82 0.00 0.00 66.70 67.60 3dgh h VAL 78 Cb 0.26 0.73 -0.03 0.00 -1.52 0.00 0.00 31.29 30.74 3dgh h VAL 78 CO -0.20 0.15 0.34 0.45 0.02 0.00 0.00 177.57 178.33 3dgh h HIS 79 N 0.47 0.65 -0.51 1.57 -0.00 -1.06 -2.94 115.15 113.32 3dgh h HIS 79 Ca 0.13 0.01 -0.08 0.00 -0.00 0.00 0.00 60.37 60.43 3dgh h HIS 79 Cb 0.06 -0.22 -0.02 0.00 -0.00 0.00 0.00 27.41 27.23 3dgh h HIS 79 CO -0.03 0.41 0.00 0.93 -0.00 0.00 0.00 177.93 179.25 3dgh h GLU 80 N 0.69 0.86 -0.94 2.45 5.08 -0.61 -2.89 114.58 119.22 3dgh h GLU 80 Ca 0.19 -0.24 0.17 0.00 -1.00 0.00 0.00 59.36 58.47 3dgh h GLU 80 Cb -0.08 -0.10 -0.10 0.00 0.50 0.00 0.00 28.75 28.98 3dgh h GLU 80 CO -0.04 0.86 0.54 0.00 -1.00 0.00 0.00 179.01 179.37 3dgh h ALA 81 N 1.20 1.50 -0.90 3.43 0.00 -0.57 -1.83 119.26 122.08 3dgh h ALA 81 Ca 0.15 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.15 3dgh h ALA 81 Cb 0.48 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.15 3dgh h ALA 81 CO 0.02 -0.04 0.60 0.00 0.00 0.00 0.00 179.25 179.84 3dgh h ALA 82 N 1.60 1.36 0.00 0.00 0.00 -1.48 -1.94 119.26 118.80 3dgh h ALA 82 Ca 0.52 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.33 3dgh h ALA 82 Cb 0.76 -0.36 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 3dgh h ALA 82 CO -0.36 0.59 -0.23 0.00 0.00 0.00 0.00 179.25 179.25 3dgh h ALA 83 N 1.44 1.32 -0.24 0.00 0.00 -1.42 -2.39 119.26 117.97 3dgh h ALA 83 Ca 0.33 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 55.04 3dgh h ALA 83 Cb -0.13 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.62 3dgh h ALA 83 CO -0.07 0.28 0.00 0.66 0.00 0.00 0.00 179.25 180.12 3dgh n TYR 84 N -3.83 0.31 0.00 0.00 4.01 -0.77 -4.84 117.16 112.04 3dgh n TYR 84 Ca -0.02 -0.16 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 3dgh n TYR 84 Cb 0.32 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.35 3dgh n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3dgh n GLY 85 N 1.05 0.70 3.76 2.72 0.00 -0.90 -5.08 105.19 107.43 3dgh n GLY 85 Ca 0.13 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.75 3dgh n GLY 85 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 3dgh s TRP 86 N -2.00 3.63 -0.10 1.61 0.52 -0.95 -4.93 118.94 116.73 3dgh s TRP 86 Ca 0.00 1.73 0.00 0.00 0.02 0.00 0.00 56.10 57.85 3dgh s TRP 86 Cb 0.00 -3.24 0.12 0.00 -1.15 0.00 0.00 33.47 29.19 3dgh s TRP 86 CO 0.00 -0.42 1.38 0.27 0.02 0.00 0.00 176.95 178.20 3dgh n ASN 87 N 1.21 3.81 -4.76 2.95 6.94 -1.26 -4.25 115.26 119.89 3dgh n ASN 87 Ca -0.01 -2.40 -0.40 0.00 -0.02 0.00 0.00 54.58 51.75 3dgh n ASN 87 Cb 0.45 -0.70 -0.04 0.00 -2.36 0.00 0.00 39.78 37.14 3dgh n ASN 87 CO 0.00 0.00 0.00 0.68 -1.03 0.00 0.00 177.26 176.91 3dgh s VAL 88 N -0.70 3.34 -0.61 3.53 -7.23 -1.26 -4.97 120.40 112.50 3dgh s VAL 88 Ca 0.11 1.31 -0.26 0.00 -1.81 0.00 0.00 61.98 61.33 3dgh s VAL 88 Cb 0.09 -3.83 0.04 0.00 0.56 0.00 0.00 36.38 33.24 3dgh s VAL 88 CO 0.02 0.30 1.09 -0.62 -0.31 0.00 0.00 175.10 175.57 3dgh s ASP 89 N -0.65 6.31 0.62 4.85 3.68 -1.26 -4.87 116.67 125.35 3dgh s ASP 89 Ca 0.47 -0.33 0.39 0.00 2.13 0.00 0.00 52.55 55.21 3dgh s ASP 89 Cb -0.34 -2.49 2.14 0.00 -1.45 0.00 0.00 42.92 40.77 3dgh s ASP 89 CO 0.43 -1.46 2.20 -0.78 0.13 0.00 0.00 175.17 175.69 3dgh h ASP 90 N 9.57 0.00 -2.76 -0.34 1.82 -1.93 -3.42 116.42 119.35 3dgh h ASP 90 Ca -0.27 0.00 -0.69 0.00 -0.39 0.00 0.00 57.03 55.69 3dgh h ASP 90 Cb 1.06 0.00 -0.18 0.00 0.68 0.00 0.00 39.33 40.89 3dgh h ASP 90 CO 1.17 0.00 0.44 -0.75 -1.61 0.00 0.00 179.24 178.49 3dgh s LYS 91 N -4.05 3.27 0.12 0.28 2.47 -1.26 -4.83 119.74 115.74 3dgh s LYS 91 Ca -0.04 -1.40 0.03 0.00 -1.56 0.00 0.00 55.97 53.00 3dgh s LYS 91 Cb 0.11 -4.46 -0.04 0.00 -1.46 0.00 0.00 37.83 31.98 3dgh s LYS 91 CO 0.36 -1.67 -0.09 0.96 0.16 0.00 0.00 175.35 175.07 3dgh s ILE 92 N 2.87 0.98 -0.15 5.43 -4.36 -1.26 -5.16 121.20 119.56 3dgh s ILE 92 Ca 0.21 -1.96 -0.12 0.00 -0.26 0.00 0.00 60.65 58.52 3dgh s ILE 92 Cb -0.15 -1.72 0.04 0.00 1.25 0.00 0.00 42.46 41.88 3dgh s ILE 92 CO 0.02 -0.76 0.38 -0.75 0.24 0.00 0.00 174.94 174.07 3dgh s LYS 93 N -3.62 0.43 0.32 0.37 2.20 -1.26 -5.05 119.74 113.12 3dgh s LYS 93 Ca 0.13 0.57 -0.21 0.00 -0.36 0.00 0.00 55.97 56.11 3dgh s LYS 93 Cb 0.03 0.17 -0.09 0.00 -1.51 0.00 0.00 37.83 36.42 3dgh s LYS 93 CO -0.01 -0.07 0.83 -1.25 -0.36 0.00 0.00 175.35 174.49 3dgh s PRO 94 N 0.42 4.28 -0.60 4.03 0.04 -1.26 -5.03 135.00 136.88 3dgh s PRO 94 Ca -0.02 1.00 -0.23 0.00 0.04 0.00 0.00 61.00 61.80 3dgh s PRO 94 Cb -0.04 -2.61 0.06 0.00 0.04 0.00 0.00 34.50 31.95 3dgh s PRO 94 CO -0.02 0.22 0.92 0.34 0.04 0.00 0.00 177.00 178.50 3dgh s ASP 95 N -1.89 6.25 0.23 6.66 3.68 -1.26 -4.94 116.67 125.39 3dgh s ASP 95 Ca 0.52 -0.70 -0.07 0.00 2.13 0.00 0.00 52.55 54.42 3dgh s ASP 95 Cb -0.14 -2.41 0.20 0.00 -1.45 0.00 0.00 42.92 39.12 3dgh s ASP 95 CO 0.19 -1.29 1.86 -0.25 0.13 0.00 0.00 175.17 175.81 3dgh h TRP 96 N 9.40 1.20 -0.71 -5.34 2.91 -1.99 -0.95 115.95 120.47 3dgh h TRP 96 Ca -0.27 -0.02 -0.05 0.00 1.13 0.00 0.00 58.89 59.68 3dgh h TRP 96 Cb 1.07 -0.39 -0.03 0.00 -0.51 0.00 0.00 29.16 29.31 3dgh h TRP 96 CO 0.92 0.81 0.24 1.25 -1.03 0.00 0.00 178.44 180.63 3dgh h HIS 97 N 1.23 1.12 -0.49 2.65 2.76 -1.92 0.94 115.15 121.44 3dgh h HIS 97 Ca 0.32 -0.10 -0.09 0.00 -2.20 0.00 0.00 60.37 58.29 3dgh h HIS 97 Cb -0.01 -0.33 -0.02 0.00 1.55 0.00 0.00 27.41 28.61 3dgh h HIS 97 CO 0.01 0.88 -0.05 -0.22 -1.30 0.00 0.00 177.93 177.25 3dgh h LYS 98 N 1.03 0.90 0.03 5.26 3.64 -1.83 -0.39 116.57 125.21 3dgh h LYS 98 Ca 0.23 -0.31 -0.00 0.00 -1.27 0.00 0.00 60.65 59.30 3dgh h LYS 98 Cb 0.27 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 32.03 3dgh h LYS 98 CO -0.01 0.96 -0.01 1.25 -2.27 0.00 0.00 179.45 179.37 3dgh h LEU 99 N 0.76 -0.03 -0.60 5.20 5.85 -0.89 -0.75 115.31 124.84 3dgh h LEU 99 Ca 0.13 -0.25 0.03 0.00 0.84 0.00 0.00 57.88 58.64 3dgh h LEU 99 Cb 0.58 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.58 3dgh h LEU 99 CO 0.04 0.23 0.35 0.58 -0.34 0.00 0.00 178.44 179.30 3dgh h VAL 100 N -0.29 1.04 0.00 1.05 2.07 -0.70 -0.82 116.25 118.60 3dgh h VAL 100 Ca -0.00 -0.24 -0.07 0.00 0.82 0.00 0.00 66.70 67.21 3dgh h VAL 100 Cb 0.28 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.33 3dgh h VAL 100 CO 0.01 0.13 -0.32 1.56 0.02 0.00 0.00 177.57 178.96 3dgh h GLN 101 N 0.69 0.00 -0.17 1.57 1.08 -0.97 -0.06 115.11 117.25 3dgh h GLN 101 Ca 0.25 0.00 -0.13 0.00 -1.45 0.00 0.00 58.65 57.32 3dgh h GLN 101 Cb 0.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.50 3dgh h GLN 101 CO -0.12 0.32 -0.41 0.77 -0.95 0.00 0.00 178.83 178.43 3dgh h SER 102 N 0.00 0.65 -0.75 1.46 0.02 -0.42 -1.22 113.55 113.29 3dgh h SER 102 Ca -0.00 -0.57 -0.02 0.00 -0.84 0.00 0.00 61.79 60.35 3dgh h SER 102 Cb 0.80 -0.19 -0.03 0.00 0.14 0.00 0.00 62.40 63.12 3dgh h SER 102 CO 0.04 1.11 0.38 0.58 -1.14 0.00 0.00 176.83 177.81 3dgh h VAL 103 N 0.23 1.23 -0.92 2.27 2.07 -0.97 -1.80 116.25 118.36 3dgh h VAL 103 Ca -0.00 -0.62 -0.01 0.00 0.82 0.00 0.00 66.70 66.88 3dgh h VAL 103 Cb 1.03 0.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.02 3dgh h VAL 103 CO 0.09 0.27 0.52 1.56 0.02 0.00 0.00 177.57 180.03 3dgh h GLN 104 N 1.04 1.27 -0.72 1.57 1.08 -0.93 -0.77 115.11 117.65 3dgh h GLN 104 Ca 0.26 -0.14 -0.05 0.00 -1.45 0.00 0.00 58.65 57.28 3dgh h GLN 104 Cb 0.08 -0.25 -0.03 0.00 -0.05 0.00 0.00 27.48 27.22 3dgh h GLN 104 CO -0.04 0.91 0.26 -0.97 -0.95 0.00 0.00 178.83 178.04 3dgh h ASN 105 N 1.28 1.02 -0.11 1.46 -0.73 -0.91 0.18 115.58 117.77 3dgh h ASN 105 Ca 0.33 -0.19 0.02 0.00 1.87 0.00 0.00 56.30 58.33 3dgh h ASN 105 Cb -0.01 -0.27 -0.02 0.00 0.27 0.00 0.00 38.32 38.30 3dgh h ASN 105 CO -0.06 0.94 -0.02 -0.74 -0.37 0.00 0.00 177.43 177.18 3dgh h HIS 106 N 1.05 -0.05 -0.27 0.67 2.76 -0.87 -1.16 115.15 117.29 3dgh h HIS 106 Ca 0.24 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.39 3dgh h HIS 106 Cb 0.25 0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 3dgh h HIS 106 CO 0.02 -0.04 0.05 0.82 -1.30 0.00 0.00 177.93 177.47 3dgh h ILE 107 N 0.01 1.23 -0.20 6.26 2.04 -0.64 -2.54 117.51 123.66 3dgh h ILE 107 Ca 0.05 -0.77 -0.04 0.00 1.00 0.00 0.00 64.86 65.10 3dgh h ILE 107 Cb 0.08 1.22 -0.01 0.00 -0.74 0.00 0.00 36.82 37.37 3dgh h ILE 107 CO -0.11 0.25 -0.07 0.11 0.00 0.00 0.00 178.15 178.32 3dgh h LYS 108 N 0.25 0.31 -0.42 2.37 1.57 -0.54 0.17 116.57 120.27 3dgh h LYS 108 Ca 0.08 -0.06 -0.05 0.00 -1.87 0.00 0.00 60.65 58.75 3dgh h LYS 108 Cb 0.32 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.57 3dgh h LYS 108 CO 0.00 0.39 0.07 0.77 -0.57 0.00 0.00 179.45 180.11 3dgh h SER 109 N 0.29 0.67 -0.48 0.86 0.02 -1.04 -1.73 113.55 112.15 3dgh h SER 109 Ca 0.06 -0.26 -0.02 0.00 -0.84 0.00 0.00 61.79 60.73 3dgh h SER 109 Cb 0.32 -0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.65 3dgh h SER 109 CO 0.01 0.77 0.23 0.58 -1.14 0.00 0.00 176.83 177.28 3dgh h VAL 110 N 0.56 1.19 -0.76 2.27 2.07 -0.92 -2.01 116.25 118.64 3dgh h VAL 110 Ca 0.13 -0.52 0.11 0.00 0.82 0.00 0.00 66.70 67.24 3dgh h VAL 110 Cb 0.38 0.65 -0.08 0.00 -1.52 0.00 0.00 31.29 30.72 3dgh h VAL 110 CO 0.01 0.21 0.37 0.78 0.02 0.00 0.00 177.57 178.96 3dgh h ASN 111 N 0.63 0.47 -0.27 0.57 2.35 -0.49 -0.11 115.58 118.73 3dgh h ASN 111 Ca 0.16 0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.94 3dgh h ASN 111 Cb 0.11 -0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.47 3dgh h ASN 111 CO -0.02 0.24 -0.01 -0.25 -1.65 0.00 0.00 177.43 175.74 3dgh h TRP 112 N 0.60 0.53 -1.00 1.19 7.01 -1.04 -1.24 115.95 121.99 3dgh h TRP 112 Ca 0.39 -0.09 0.09 0.00 2.11 0.00 0.00 58.89 61.38 3dgh h TRP 112 Cb 0.47 -0.14 -0.07 0.00 -2.10 0.00 0.00 29.16 27.32 3dgh h TRP 112 CO -0.11 0.64 0.64 0.28 -2.79 0.00 0.00 178.44 177.10 3dgh h VAL 113 N 0.26 1.02 -0.56 2.65 2.07 -0.92 -0.89 116.25 119.88 3dgh h VAL 113 Ca 0.08 -0.38 -0.07 0.00 0.82 0.00 0.00 66.70 67.15 3dgh h VAL 113 Cb 0.43 -0.18 -0.02 0.00 -1.52 0.00 0.00 31.29 30.00 3dgh h VAL 113 CO 0.01 0.20 0.07 0.74 0.02 0.00 0.00 177.57 178.62 3dgh h THR 114 N 1.10 1.26 -0.60 2.57 2.02 -0.69 0.19 112.91 118.75 3dgh h THR 114 Ca 0.46 -1.00 0.02 0.00 0.77 0.00 0.00 66.41 66.66 3dgh h THR 114 Cb 0.30 0.82 -0.04 0.00 -1.74 0.00 0.00 68.15 67.50 3dgh h THR 114 CO -0.21 0.36 0.38 0.03 0.37 0.00 0.00 175.52 176.45 3dgh h ARG 115 N 0.82 0.74 -0.08 6.66 2.47 -0.39 -1.01 114.38 123.60 3dgh h ARG 115 Ca 0.17 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.84 3dgh h ARG 115 Cb 0.44 -0.17 -0.00 0.00 -1.65 0.00 0.00 29.97 28.59 3dgh h ARG 115 CO 0.01 0.49 0.05 0.28 0.56 0.00 0.00 179.97 181.36 3dgh h VAL 116 N 0.77 1.06 -0.81 2.04 2.07 -0.73 -1.46 116.25 119.18 3dgh h VAL 116 Ca 0.23 -0.16 0.05 0.00 0.82 0.00 0.00 66.70 67.64 3dgh h VAL 116 Cb -0.03 1.03 -0.05 0.00 -1.52 0.00 0.00 31.29 30.71 3dgh h VAL 116 CO -0.08 0.05 0.51 -0.78 0.02 0.00 0.00 177.57 177.29 3dgh h ASP 117 N 0.06 0.82 0.03 0.57 3.58 -0.31 -0.51 116.42 120.65 3dgh h ASP 117 Ca 0.03 0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.48 3dgh h ASP 117 Cb 0.04 -0.16 0.00 0.00 1.72 0.00 0.00 39.33 40.93 3dgh h ASP 117 CO -0.01 0.54 -0.01 -0.07 -2.88 0.00 0.00 179.24 176.81 3dgh h LEU 118 N 0.96 -0.03 -0.84 2.28 3.38 -1.00 -2.56 115.31 117.49 3dgh h LEU 118 Ca 0.34 -0.31 0.07 0.00 0.09 0.00 0.00 57.88 58.07 3dgh h LEU 118 Cb 0.10 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 40.79 3dgh h LEU 118 CO -0.15 0.30 0.51 -0.09 0.09 0.00 0.00 178.44 179.10 3dgh h ARG 119 N -0.36 0.89 0.00 1.13 2.43 -0.95 -2.27 114.38 115.24 3dgh h ARG 119 Ca -0.00 -0.05 -0.02 0.00 -0.81 0.00 0.00 59.98 59.09 3dgh h ARG 119 Cb 0.34 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 3dgh h ARG 119 CO 0.01 0.59 -0.10 -0.44 -1.51 0.00 0.00 179.97 178.52 3dgh h ASP 120 N 0.92 0.00 -0.22 -3.80 3.45 -1.03 -3.31 116.42 112.43 3dgh h ASP 120 Ca 0.37 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.83 3dgh h ASP 120 Cb 0.21 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 38.98 3dgh h ASP 120 CO -0.19 0.10 0.00 0.29 -1.57 0.00 0.00 179.24 177.88 3dgh n LYS 121 N -3.34 2.79 -1.08 3.56 5.02 -0.87 -4.98 118.16 119.25 3dgh n LYS 121 Ca -0.01 -2.10 -0.03 0.00 -2.02 0.00 0.00 58.31 54.15 3dgh n LYS 121 Cb 0.30 -1.33 -0.01 0.00 -0.02 0.00 0.00 35.03 33.97 3dgh n LYS 121 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 3dgh n LYS 122 N -0.08 -0.69 -2.84 1.97 4.76 -1.15 -4.86 118.16 115.28 3dgh n LYS 122 Ca 0.11 0.40 -0.43 0.00 -2.87 0.00 0.00 58.31 55.52 3dgh n LYS 122 Cb 0.48 -4.07 -0.04 0.00 -1.84 0.00 0.00 35.03 29.57 3dgh n LYS 122 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 3dgh s VAL 123 N -1.86 4.55 -0.33 -0.18 1.01 -1.11 -4.68 120.40 117.81 3dgh s VAL 123 Ca 0.00 0.89 -0.29 0.00 0.00 0.00 0.00 61.98 62.58 3dgh s VAL 123 Cb 0.00 -4.37 -0.01 0.00 0.00 0.00 0.00 36.38 32.00 3dgh s VAL 123 CO 0.00 -0.68 1.60 -0.70 0.00 0.00 0.00 175.10 175.31 3dgh s GLU 124 N 3.56 3.57 -0.27 2.72 2.12 -1.09 -4.52 118.70 124.79 3dgh s GLU 124 Ca 0.36 1.32 -0.20 0.00 0.36 0.00 0.00 54.97 56.81 3dgh s GLU 124 Cb -0.11 -4.08 -0.02 0.00 0.26 0.00 0.00 34.13 30.18 3dgh s GLU 124 CO 0.22 -1.57 0.62 -0.47 -0.54 0.00 0.00 175.26 173.53 3dgh s TYR 125 N 5.83 3.26 -0.31 5.30 5.04 -1.26 -0.73 117.35 134.48 3dgh s TYR 125 Ca 0.70 0.73 -0.06 0.00 -2.44 0.00 0.00 57.07 56.00 3dgh s TYR 125 Cb -0.20 -2.88 0.02 0.00 0.35 0.00 0.00 41.96 39.25 3dgh s TYR 125 CO 0.32 -0.37 0.08 0.42 -1.34 0.00 0.00 175.55 174.65 3dgh s ILE 126 N 2.53 3.83 -1.32 3.14 1.01 -0.31 -4.98 121.20 125.11 3dgh s ILE 126 Ca 0.25 -0.85 -0.12 0.00 0.00 0.00 0.00 60.65 59.93 3dgh s ILE 126 Cb -0.15 -3.04 0.12 0.00 0.01 0.00 0.00 42.46 39.40 3dgh s ILE 126 CO 0.10 0.01 1.89 -3.20 0.00 0.00 0.00 174.94 173.73 3dgh n ASN 127 N 4.84 4.76 -3.77 3.58 4.05 -1.26 -1.43 115.26 126.02 3dgh n ASN 127 Ca -0.14 -2.99 -0.10 0.00 0.45 0.00 0.00 54.58 51.80 3dgh n ASN 127 Cb 0.47 -1.57 -0.06 0.00 1.23 0.00 0.00 39.78 39.85 3dgh n ASN 127 CO 0.00 0.00 0.00 -0.83 -3.05 0.00 0.00 177.26 173.38 3dgh s GLY 128 N 2.20 -0.03 -0.21 8.20 0.00 -1.18 -4.62 107.32 111.67 3dgh s GLY 128 Ca 0.44 -0.38 -0.24 0.00 0.00 0.00 0.00 44.72 44.54 3dgh s GLY 128 CO -0.01 -0.56 0.79 1.08 0.00 0.00 0.00 173.10 174.40 3dgh s LEU 129 N -2.85 4.12 -0.04 0.66 1.43 -0.11 -4.06 118.68 117.83 3dgh s LEU 129 Ca 0.06 1.03 -0.11 0.00 -1.03 0.00 0.00 54.13 54.07 3dgh s LEU 129 Cb 0.03 -3.14 -0.05 0.00 0.03 0.00 0.00 46.19 43.06 3dgh s LEU 129 CO -0.09 -0.43 0.31 -0.83 0.23 0.00 0.00 176.35 175.53 3dgh s GLY 130 N 1.27 2.35 -0.02 -3.19 0.00 -1.26 -0.84 107.32 105.64 3dgh s GLY 130 Ca 0.34 -0.39 -0.08 0.00 0.00 0.00 0.00 44.72 44.60 3dgh s GLY 130 CO 0.09 -0.08 0.16 -1.35 0.00 0.00 0.00 173.10 171.93 3dgh s SER 131 N -1.12 -0.04 0.22 1.64 1.04 -0.67 -4.41 113.70 110.35 3dgh s SER 131 Ca 0.21 -0.04 -0.30 0.00 0.48 0.00 0.00 55.95 56.31 3dgh s SER 131 Cb -0.15 0.26 -0.09 0.00 0.10 0.00 0.00 66.02 66.14 3dgh s SER 131 CO 0.10 -0.29 1.22 -0.36 0.98 0.00 0.00 173.24 174.89 3dgh s PHE 132 N -0.99 3.36 -0.26 5.02 0.08 0.12 -0.67 117.98 124.64 3dgh s PHE 132 Ca -0.11 1.41 -0.15 0.00 0.12 0.00 0.00 56.93 58.21 3dgh s PHE 132 Cb -0.06 -3.48 -0.14 0.00 -0.57 0.00 0.00 43.02 38.77 3dgh s PHE 132 CO 0.01 -1.35 -0.21 0.28 -0.10 0.00 0.00 175.22 173.85 3dgh n VAL 133 N 2.14 1.53 -3.60 -0.44 0.31 0.28 -4.78 118.33 113.78 3dgh n VAL 133 Ca 0.03 -0.32 -0.05 0.00 -0.01 0.00 0.00 64.34 63.99 3dgh n VAL 133 Cb 0.44 -1.89 -0.00 0.00 -0.91 0.00 0.00 33.84 31.47 3dgh n VAL 133 CO 0.00 0.00 0.00 -0.90 -1.32 0.00 0.00 176.83 174.61 3dgh n ASP 134 N -4.23 -0.67 0.00 4.52 3.85 -1.06 -4.73 116.55 114.23 3dgh n ASP 134 Ca -0.49 -1.70 0.06 0.00 -0.71 0.00 0.00 54.79 51.94 3dgh n ASP 134 Cb 0.85 1.18 0.28 0.00 -1.35 0.00 0.00 41.12 42.08 3dgh n ASP 134 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 3dgh n SER 135 N -1.67 0.00 0.00 -1.12 3.41 -1.26 -1.95 113.62 111.03 3dgh n SER 135 Ca -0.01 0.22 0.00 0.00 -0.26 0.00 0.00 58.87 58.82 3dgh n SER 135 Cb 0.23 -0.34 0.00 0.00 -0.26 0.00 0.00 64.21 63.84 3dgh n SER 135 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 3dgh n HIS 136 N -1.34 0.00 -3.91 7.33 8.25 -1.26 -4.88 115.22 119.41 3dgh n HIS 136 Ca 0.05 -0.31 -0.18 0.00 -0.26 0.00 0.00 57.72 57.02 3dgh n HIS 136 Cb 0.10 -0.03 -0.16 0.00 1.12 0.00 0.00 29.99 31.02 3dgh n HIS 136 CO 0.00 0.00 0.00 0.99 0.64 0.00 0.00 176.34 177.97 3dgh s THR 137 N -0.62 0.18 -0.05 1.59 2.01 -0.82 -1.70 115.64 116.23 3dgh s THR 137 Ca 0.00 0.11 0.06 0.00 0.31 0.00 0.00 61.69 62.17 3dgh s THR 137 Cb 0.00 -0.29 -0.01 0.00 0.01 0.00 0.00 72.50 72.21 3dgh s THR 137 CO 0.00 0.16 -0.25 -0.22 -0.69 0.00 0.00 174.62 173.62 3dgh s LEU 138 N 1.15 2.06 -0.16 4.42 2.96 0.76 -0.56 118.68 129.30 3dgh s LEU 138 Ca -0.08 -0.50 -0.21 0.00 -0.22 0.00 0.00 54.13 53.12 3dgh s LEU 138 Cb -0.13 -1.34 -0.03 0.00 0.50 0.00 0.00 46.19 45.18 3dgh s LEU 138 CO -0.02 0.25 0.62 -0.22 -1.32 0.00 0.00 176.35 175.66 3dgh s LEU 139 N -0.19 4.19 -0.24 -0.68 2.96 0.15 -0.80 118.68 124.08 3dgh s LEU 139 Ca -0.03 0.90 -0.01 0.00 -0.22 0.00 0.00 54.13 54.77 3dgh s LEU 139 Cb -0.13 -2.90 0.03 0.00 0.50 0.00 0.00 46.19 43.68 3dgh s LEU 139 CO 0.03 -0.21 -0.08 0.00 -1.32 0.00 0.00 176.35 174.78 3dgh s ALA 140 N 1.54 2.66 -0.34 5.97 0.00 0.13 -1.67 121.76 130.05 3dgh s ALA 140 Ca 0.30 -1.44 -0.17 0.00 0.00 0.00 0.00 51.96 50.65 3dgh s ALA 140 Cb -0.16 -1.63 -0.01 0.00 0.00 0.00 0.00 23.12 21.32 3dgh s ALA 140 CO 0.12 -0.77 0.45 0.15 0.00 0.00 0.00 175.76 175.71 3dgh s LYS 141 N 1.32 3.63 0.14 0.00 1.02 -0.02 -0.98 119.74 124.85 3dgh s LYS 141 Ca 0.00 -0.24 0.09 0.00 0.02 0.00 0.00 55.97 55.84 3dgh s LYS 141 Cb -0.16 -3.80 -0.04 0.00 -0.52 0.00 0.00 37.83 33.31 3dgh s LYS 141 CO -0.05 -0.57 -0.17 -0.51 -0.92 0.00 0.00 175.35 173.13 3dgh s LEU 142 N 2.22 2.73 0.35 3.17 2.01 -1.24 -0.93 118.68 126.99 3dgh s LEU 142 Ca 0.16 -0.61 0.10 0.00 0.01 0.00 0.00 54.13 53.79 3dgh s LEU 142 Cb -0.16 -1.52 0.86 0.00 0.01 0.00 0.00 46.19 45.38 3dgh s LEU 142 CO 0.12 0.15 1.83 0.11 1.01 0.00 0.00 176.35 179.57 3dgh h LYS 143 N 3.44 0.63 0.00 1.70 6.56 -1.97 -1.13 116.57 125.79 3dgh h LYS 143 Ca -0.49 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.07 3dgh h LYS 143 Cb 1.18 -0.14 0.00 0.00 -0.57 0.00 0.00 32.23 32.70 3dgh h LYS 143 CO 0.48 0.42 0.00 -1.13 -2.06 0.00 0.00 179.45 177.16 3dgh n SER 144 N -4.62 0.00 0.00 0.86 3.41 -1.26 -4.98 113.62 107.03 3dgh n SER 144 Ca 0.20 -0.41 0.00 0.00 -0.26 0.00 0.00 58.87 58.41 3dgh n SER 144 Cb 0.58 -0.19 0.00 0.00 -0.26 0.00 0.00 64.21 64.34 3dgh n SER 144 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3dgh n GLY 145 N 1.07 3.74 3.82 5.00 0.00 -0.43 -5.11 105.19 113.29 3dgh n GLY 145 Ca 0.17 -1.65 -0.32 0.00 0.00 0.00 0.00 46.02 44.21 3dgh n GLY 145 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 3dgh s GLU 146 N -3.72 3.72 0.09 1.61 1.03 -1.26 -3.63 118.70 116.53 3dgh s GLU 146 Ca 0.00 1.07 0.08 0.00 0.03 0.00 0.00 54.97 56.15 3dgh s GLU 146 Cb 0.00 -2.10 -0.03 0.00 -0.80 0.00 0.00 34.13 31.20 3dgh s GLU 146 CO 0.00 -0.47 -0.20 0.50 -1.33 0.00 0.00 175.26 173.76 3dgh s ARG 147 N -4.00 1.16 -0.22 -4.83 3.52 -0.16 -4.97 118.95 109.45 3dgh s ARG 147 Ca 0.61 -1.09 -0.02 0.00 -0.13 0.00 0.00 55.73 55.10 3dgh s ARG 147 Cb -0.12 -1.38 0.01 0.00 -1.56 0.00 0.00 34.95 31.90 3dgh s ARG 147 CO 0.32 0.33 -0.08 0.99 -0.81 0.00 0.00 175.30 176.05 3dgh s THR 148 N -1.07 2.89 0.07 4.11 2.01 -1.26 0.22 115.64 122.61 3dgh s THR 148 Ca 0.06 -0.81 0.07 0.00 0.31 0.00 0.00 61.69 61.32 3dgh s THR 148 Cb -0.10 -2.36 -0.03 0.00 0.01 0.00 0.00 72.50 70.02 3dgh s THR 148 CO 0.03 0.35 -0.19 0.27 -0.69 0.00 0.00 174.62 174.40 3dgh s ILE 149 N 1.37 1.50 0.16 1.82 -4.36 0.02 -4.96 121.20 116.75 3dgh s ILE 149 Ca 0.03 -1.32 0.09 0.00 -0.26 0.00 0.00 60.65 59.20 3dgh s ILE 149 Cb -0.15 -1.36 -0.04 0.00 1.25 0.00 0.00 42.46 42.16 3dgh s ILE 149 CO -0.06 -0.00 -0.16 0.42 0.24 0.00 0.00 174.94 175.38 3dgh s THR 150 N -1.03 2.89 0.06 8.37 -4.23 -1.26 -0.17 115.64 120.27 3dgh s THR 150 Ca 0.05 -1.66 -0.14 0.00 -1.18 0.00 0.00 61.69 58.75 3dgh s THR 150 Cb -0.09 -2.38 0.02 0.00 1.34 0.00 0.00 72.50 71.39 3dgh s THR 150 CO 0.03 -0.02 0.32 0.00 -0.54 0.00 0.00 174.62 174.41 3dgh s ALA 151 N -1.47 -0.73 0.06 3.99 0.00 -0.69 -1.76 121.76 121.16 3dgh s ALA 151 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 51.96 51.96 3dgh s ALA 151 Cb -0.09 0.38 -0.13 0.00 0.00 0.00 0.00 23.12 23.27 3dgh s ALA 151 CO 0.12 -0.45 1.52 0.37 0.00 0.00 0.00 175.76 177.32 3dgh h GLN 152 N 3.06 0.21 -4.96 0.00 5.75 -1.36 -3.43 115.11 114.38 3dgh h GLN 152 Ca -0.32 -0.06 -0.34 0.00 -0.15 0.00 0.00 58.65 57.78 3dgh h GLN 152 Cb 1.21 -0.02 -0.21 0.00 1.07 0.00 0.00 27.48 29.52 3dgh h GLN 152 CO 0.46 0.40 -0.76 0.95 -2.65 0.00 0.00 178.83 177.24 3dgh s THR 153 N -5.16 0.83 0.01 2.39 -4.23 -0.39 -4.86 115.64 104.22 3dgh s THR 153 Ca -0.14 -1.19 0.08 0.00 -1.18 0.00 0.00 61.69 59.26 3dgh s THR 153 Cb 0.06 -0.84 -0.02 0.00 1.34 0.00 0.00 72.50 73.03 3dgh s THR 153 CO 0.70 -0.30 -0.24 -0.36 -0.54 0.00 0.00 174.62 173.88 3dgh s PHE 154 N -1.32 2.14 -0.17 3.99 0.08 -0.53 -1.87 117.98 120.31 3dgh s PHE 154 Ca -0.06 -0.40 0.01 0.00 0.12 0.00 0.00 56.93 56.60 3dgh s PHE 154 Cb -0.10 -1.34 0.02 0.00 -0.57 0.00 0.00 43.02 41.03 3dgh s PHE 154 CO 0.01 0.02 -0.18 0.08 -0.10 0.00 0.00 175.22 175.06 3dgh s VAL 155 N -0.65 1.85 -0.29 -0.44 1.01 -0.65 -0.89 120.40 120.34 3dgh s VAL 155 Ca 0.10 -0.81 -0.18 0.00 0.00 0.00 0.00 61.98 61.08 3dgh s VAL 155 Cb -0.09 -1.69 -0.02 0.00 0.00 0.00 0.00 36.38 34.57 3dgh s VAL 155 CO 0.00 0.51 0.54 -0.63 0.00 0.00 0.00 175.10 175.51 3dgh s ILE 156 N 1.36 5.03 -0.32 2.22 1.01 0.10 -0.75 121.20 129.85 3dgh s ILE 156 Ca 0.05 0.75 0.17 0.00 0.00 0.00 0.00 60.65 61.62 3dgh s ILE 156 Cb -0.13 -3.89 0.46 0.00 0.01 0.00 0.00 42.46 38.91 3dgh s ILE 156 CO -0.12 -0.03 0.98 0.00 0.00 0.00 0.00 174.94 175.77 3dgh n ALA 157 N 5.65 3.48 0.95 9.38 0.00 0.41 -1.50 120.51 138.88 3dgh n ALA 157 Ca -0.04 -3.19 0.13 0.00 0.00 0.00 0.00 53.44 50.35 3dgh n ALA 157 Cb 0.49 -0.90 0.49 0.00 0.00 0.00 0.00 19.45 19.53 3dgh n ALA 157 CO 0.00 0.00 0.00 1.33 0.00 0.00 0.00 177.50 178.83 3dgh n VAL 158 N -0.14 0.07 -4.07 0.00 0.24 -1.17 -4.35 118.33 108.91 3dgh n VAL 158 Ca 0.11 -0.04 0.00 0.00 -2.04 0.00 0.00 64.34 62.37 3dgh n VAL 158 Cb 0.81 -0.31 0.00 0.00 -1.47 0.00 0.00 33.84 32.87 3dgh n VAL 158 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3dgh n GLY 159 N 1.48 0.99 0.57 7.63 0.00 -1.26 -4.68 105.19 109.90 3dgh n GLY 159 Ca 0.06 -0.63 -0.04 0.00 0.00 0.00 0.00 46.02 45.42 3dgh n GLY 159 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dgh n GLY 160 N 0.00 3.87 3.15 -0.02 0.00 -1.26 -1.90 105.19 109.03 3dgh n GLY 160 Ca 0.00 -1.77 -0.08 0.00 0.00 0.00 0.00 46.02 44.17 3dgh n GLY 160 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dgh s ARG 161 N -2.25 0.75 0.44 1.61 1.81 -0.15 -4.88 118.95 116.29 3dgh s ARG 161 Ca 0.06 -1.14 -0.26 0.00 -1.72 0.00 0.00 55.73 52.68 3dgh s ARG 161 Cb 0.00 0.27 -0.09 0.00 -0.45 0.00 0.00 34.95 34.69 3dgh s ARG 161 CO 0.04 -0.20 1.41 -2.14 -0.68 0.00 0.00 175.30 173.74 3dgh s PRO 162 N -3.91 3.76 0.30 3.54 0.02 -1.26 -0.30 135.00 137.15 3dgh s PRO 162 Ca 0.08 2.39 -0.11 0.00 0.02 0.00 0.00 61.00 63.38 3dgh s PRO 162 Cb 0.07 -2.70 -0.08 0.00 0.02 0.00 0.00 34.50 31.81 3dgh s PRO 162 CO -0.09 -0.75 0.66 1.03 -0.33 0.00 0.00 177.00 177.52 3dgh s ARG 163 N -2.39 3.86 -0.01 5.54 0.52 -0.27 -4.73 118.95 121.47 3dgh s ARG 163 Ca 0.60 0.43 0.03 0.00 -0.52 0.00 0.00 55.73 56.26 3dgh s ARG 163 Cb -0.43 -2.52 -0.03 0.00 0.52 0.00 0.00 34.95 32.48 3dgh s ARG 163 CO 0.56 0.18 -0.06 0.71 0.02 0.00 0.00 175.30 176.71 3dgh s TYR 164 N -2.00 2.92 0.51 -0.53 1.51 -1.26 -4.60 117.35 113.90 3dgh s TYR 164 Ca 0.50 -0.01 -0.21 0.00 -1.01 0.00 0.00 57.07 56.34 3dgh s TYR 164 Cb -0.11 -1.63 -0.06 0.00 -0.11 0.00 0.00 41.96 40.05 3dgh s TYR 164 CO 0.22 0.38 1.16 -1.25 -1.11 0.00 0.00 175.55 174.96 3dgh s PRO 165 N -1.37 3.50 -1.34 -1.71 0.04 -1.26 -4.92 135.00 127.95 3dgh s PRO 165 Ca 0.17 1.73 -0.13 0.00 0.04 0.00 0.00 61.00 62.81 3dgh s PRO 165 Cb -0.11 -2.19 0.11 0.00 0.04 0.00 0.00 34.50 32.34 3dgh s PRO 165 CO 0.07 -0.75 1.93 -3.47 0.04 0.00 0.00 177.00 174.82 3dgh n ASP 166 N -0.94 4.64 -3.97 6.66 2.03 -1.26 -4.78 116.55 118.94 3dgh n ASP 166 Ca 0.10 -2.97 -0.09 0.00 0.52 0.00 0.00 54.79 52.34 3dgh n ASP 166 Cb 0.49 -1.59 -0.11 0.00 -0.72 0.00 0.00 41.12 39.19 3dgh n ASP 166 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 3dgh s ILE 167 N 2.04 0.10 0.23 5.18 1.09 -1.26 -5.12 121.20 123.47 3dgh s ILE 167 Ca 0.45 -0.85 -0.32 0.00 -1.10 0.00 0.00 60.65 58.83 3dgh s ILE 167 Cb 0.09 -0.26 -0.12 0.00 -1.06 0.00 0.00 42.46 41.11 3dgh s ILE 167 CO -0.02 -0.47 1.69 -2.65 -0.10 0.00 0.00 174.94 173.39 3dgh n PRO 168 N 1.65 2.75 -0.06 2.79 -0.02 -1.26 -2.49 135.00 138.37 3dgh n PRO 168 Ca -0.23 0.99 0.00 0.00 -2.02 0.00 0.00 63.50 62.24 3dgh n PRO 168 Cb 0.55 -2.82 0.00 0.00 -0.02 0.00 0.00 33.50 31.21 3dgh n PRO 168 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3dgh n GLY 169 N 3.46 1.20 0.10 -1.23 0.00 -1.25 -0.85 105.19 106.62 3dgh n GLY 169 Ca 0.14 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.07 3dgh n GLY 169 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dgh h ALA 170 N 0.00 0.09 0.16 4.61 0.00 -1.77 -0.49 119.26 121.86 3dgh h ALA 170 Ca 0.00 0.06 -0.32 0.00 0.00 0.00 0.00 54.91 54.66 3dgh h ALA 170 Cb 0.00 0.14 0.01 0.00 0.00 0.00 0.00 17.79 17.94 3dgh h ALA 170 CO 0.00 -0.49 -1.53 -0.39 0.00 0.00 0.00 179.25 176.84 3dgh h VAL 171 N -0.02 1.18 -0.36 0.00 -1.51 -1.87 -1.96 116.25 111.71 3dgh h VAL 171 Ca 0.08 -2.76 -0.07 0.00 -1.23 0.00 0.00 66.70 62.72 3dgh h VAL 171 Cb 0.14 2.83 -0.01 0.00 -2.13 0.00 0.00 31.29 32.12 3dgh h VAL 171 CO -0.18 0.84 -0.05 -0.08 -1.23 0.00 0.00 177.57 176.87 3dgh h GLU 172 N 0.09 0.68 0.00 5.19 4.81 -1.92 -3.38 114.58 120.05 3dgh h GLU 172 Ca -0.25 -0.24 -0.09 0.00 -0.13 0.00 0.00 59.36 58.65 3dgh h GLU 172 Cb 2.05 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 31.37 3dgh h GLU 172 CO 0.19 0.81 -1.64 0.66 -0.73 0.00 0.00 179.01 178.31 3dgh n TYR 173 N -4.43 0.00 -2.40 0.92 4.01 -0.20 -5.00 117.16 110.07 3dgh n TYR 173 Ca -0.02 0.00 -0.26 0.00 -0.16 0.00 0.00 57.90 57.46 3dgh n TYR 173 Cb 0.32 -0.39 0.04 0.00 -0.31 0.00 0.00 39.34 38.99 3dgh n TYR 173 CO 0.00 0.00 0.00 0.20 -0.46 0.00 0.00 176.86 176.60 3dgh s GLY 174 N -3.81 1.62 0.34 2.72 0.00 -0.74 -4.59 107.32 102.87 3dgh s GLY 174 Ca -0.05 -0.77 0.03 0.00 0.00 0.00 0.00 44.72 43.94 3dgh s GLY 174 CO 0.48 -0.47 0.10 -0.26 0.00 0.00 0.00 173.10 172.94 3dgh s ILE 175 N -3.00 0.82 0.31 0.90 -4.36 -0.08 -4.81 121.20 110.98 3dgh s ILE 175 Ca 0.55 -2.00 0.02 0.00 -0.26 0.00 0.00 60.65 58.96 3dgh s ILE 175 Cb -0.11 -2.59 -0.01 0.00 1.25 0.00 0.00 42.46 41.00 3dgh s ILE 175 CO 0.45 0.00 0.09 0.35 0.24 0.00 0.00 174.94 176.06 3dgh n THR 176 N -0.72 0.00 0.28 8.37 -2.24 -1.26 -0.74 114.28 117.97 3dgh n THR 176 Ca -0.03 -1.75 0.16 0.00 -2.27 0.00 0.00 64.05 60.16 3dgh n THR 176 Cb 0.66 0.58 0.91 0.00 -2.10 0.00 0.00 70.33 70.38 3dgh n THR 176 CO 0.00 0.00 0.00 0.77 -0.57 0.00 0.00 175.07 175.27 3dgh h SER 177 N 1.14 0.00 -0.13 3.42 4.64 -1.94 -1.32 113.55 119.36 3dgh h SER 177 Ca -0.25 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.03 3dgh h SER 177 Cb 0.90 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.97 3dgh h SER 177 CO 0.39 0.00 -0.04 0.44 -0.87 0.00 0.00 176.83 176.75 3dgh h ASP 178 N 0.00 0.37 0.36 4.97 3.45 -1.95 -3.04 116.42 120.57 3dgh h ASP 178 Ca 0.02 -0.07 -0.32 0.00 0.43 0.00 0.00 57.03 57.09 3dgh h ASP 178 Cb 0.10 -0.10 -0.04 0.00 -0.56 0.00 0.00 39.33 38.73 3dgh h ASP 178 CO -0.00 0.46 -1.82 0.47 -1.57 0.00 0.00 179.24 176.78 3dgh n ASP 179 N -4.30 1.27 -0.18 6.45 8.00 -0.56 -4.57 116.55 122.67 3dgh n ASP 179 Ca 0.01 0.34 -0.03 0.00 0.71 0.00 0.00 54.79 55.81 3dgh n ASP 179 Cb 0.24 -0.30 0.07 0.00 -0.02 0.00 0.00 41.12 41.10 3dgh n ASP 179 CO 0.00 0.00 0.00 0.25 -0.39 0.00 0.00 177.20 177.06 3dgh h LEU 180 N 0.02 0.36 -1.15 0.64 6.46 -1.27 -2.21 115.31 118.17 3dgh h LEU 180 Ca -0.34 0.04 0.00 0.00 -0.12 0.00 0.00 57.88 57.46 3dgh h LEU 180 Cb 2.03 -0.03 0.00 0.00 -0.73 0.00 0.00 40.66 41.93 3dgh h LEU 180 CO 0.08 0.25 0.00 -0.26 -0.62 0.00 0.00 178.44 177.89 3dgh h PHE 181 N 0.50 0.00 0.00 1.25 0.04 -1.81 -2.46 116.94 114.47 3dgh h PHE 181 Ca 0.25 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.99 3dgh h PHE 181 Cb 0.18 0.00 -0.05 0.00 2.20 0.00 0.00 35.95 38.28 3dgh h PHE 181 CO -0.11 0.00 -0.37 -1.13 -0.60 0.00 0.00 178.31 176.10 3dgh n SER 182 N -2.54 1.59 -4.67 2.17 3.41 -1.01 -4.85 113.62 107.72 3dgh n SER 182 Ca 0.01 -3.02 -0.46 0.00 -0.26 0.00 0.00 58.87 55.14 3dgh n SER 182 Cb 0.22 -0.41 -0.04 0.00 -0.26 0.00 0.00 64.21 63.72 3dgh n SER 182 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 3dgh n LEU 183 N -0.86 3.23 0.19 1.04 0.00 -0.87 -4.85 117.00 114.89 3dgh n LEU 183 Ca 0.13 1.06 0.11 0.00 0.00 0.00 0.00 56.01 57.30 3dgh n LEU 183 Cb 0.73 -1.42 0.65 0.00 0.00 0.00 0.00 43.42 43.37 3dgh n LEU 183 CO -0.01 -0.21 1.10 0.44 0.00 0.00 0.00 177.39 178.71 3dgh h ASP 184 N 6.74 0.01 -4.80 1.96 5.19 -1.92 -3.44 116.42 120.16 3dgh h ASP 184 Ca -0.46 -0.00 -0.26 0.00 -0.62 0.00 0.00 57.03 55.70 3dgh h ASP 184 Cb 1.25 -0.00 -0.15 0.00 0.18 0.00 0.00 39.33 40.61 3dgh h ASP 184 CO 0.90 0.01 -0.66 0.00 -3.12 0.00 0.00 179.24 176.38 3dgh s ARG 185 N -5.07 1.06 0.30 3.56 1.70 -1.26 -4.95 118.95 114.29 3dgh s ARG 185 Ca -0.05 -1.51 -0.29 0.00 -0.47 0.00 0.00 55.73 53.41 3dgh s ARG 185 Cb 0.18 -0.10 -0.13 0.00 -0.57 0.00 0.00 34.95 34.33 3dgh s ARG 185 CO 0.69 -0.18 1.32 0.39 -1.08 0.00 0.00 175.30 176.44 3dgh n GLU 186 N -0.20 2.07 -0.04 3.89 1.02 -1.26 -4.91 120.64 121.20 3dgh n GLU 186 Ca -0.06 0.73 0.02 0.00 -0.02 0.00 0.00 57.16 57.82 3dgh n GLU 186 Cb 0.63 -2.33 0.34 0.00 -0.02 0.00 0.00 31.44 30.07 3dgh n GLU 186 CO 0.00 0.00 0.00 -1.35 1.18 0.00 0.00 177.13 176.96 3dgh h PRO 187 N 3.19 0.62 0.00 3.49 0.11 -1.97 -3.48 132.00 133.95 3dgh h PRO 187 Ca -0.45 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.59 3dgh h PRO 187 Cb 1.28 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.27 3dgh h PRO 187 CO 0.68 0.49 0.00 0.41 -0.21 0.00 0.00 178.00 179.37 3dgh n GLY 188 N -1.23 1.91 3.66 -0.55 0.00 -1.26 -3.76 105.19 103.96 3dgh n GLY 188 Ca 0.03 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 45.11 3dgh n GLY 188 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 3dgh s LYS 189 N 0.00 4.19 -0.09 1.61 2.20 -1.26 -2.86 119.74 123.52 3dgh s LYS 189 Ca 0.00 1.87 0.02 0.00 -0.36 0.00 0.00 55.97 57.50 3dgh s LYS 189 Cb 0.00 -3.87 0.01 0.00 -1.51 0.00 0.00 37.83 32.47 3dgh s LYS 189 CO 0.00 -0.79 -0.15 0.99 -0.36 0.00 0.00 175.35 175.04 3dgh s THR 190 N 3.80 1.40 -0.21 3.43 2.01 -0.15 -0.22 115.64 125.71 3dgh s THR 190 Ca 0.63 -0.60 -0.21 0.00 0.31 0.00 0.00 61.69 61.82 3dgh s THR 190 Cb -0.26 -1.28 -0.02 0.00 0.01 0.00 0.00 72.50 70.94 3dgh s THR 190 CO 0.21 0.42 0.64 -0.22 -0.69 0.00 0.00 174.62 174.98 3dgh s LEU 191 N 0.85 4.13 -0.36 4.42 2.96 -0.30 -1.15 118.68 129.23 3dgh s LEU 191 Ca -0.10 0.82 -0.09 0.00 -0.22 0.00 0.00 54.13 54.53 3dgh s LEU 191 Cb -0.15 -2.89 0.03 0.00 0.50 0.00 0.00 46.19 43.67 3dgh s LEU 191 CO 0.01 -0.30 0.17 -0.69 -1.32 0.00 0.00 176.35 174.22 3dgh s VAL 192 N 2.05 4.31 -0.39 1.68 1.01 0.11 -0.01 120.40 129.16 3dgh s VAL 192 Ca 0.28 -0.94 -0.16 0.00 0.00 0.00 0.00 61.98 61.16 3dgh s VAL 192 Cb -0.16 -3.42 0.01 0.00 0.00 0.00 0.00 36.38 32.81 3dgh s VAL 192 CO 0.10 -0.21 0.40 -0.69 0.00 0.00 0.00 175.10 174.70 3dgh s VAL 193 N 1.50 5.13 0.00 2.92 1.01 -0.25 -0.24 120.40 130.48 3dgh s VAL 193 Ca 0.01 -0.21 0.00 0.00 0.00 0.00 0.00 61.98 61.77 3dgh s VAL 193 Cb -0.19 -3.95 0.00 0.00 0.00 0.00 0.00 36.38 32.24 3dgh s VAL 193 CO 0.05 -0.29 0.00 0.61 0.00 0.00 0.00 175.10 175.47 3dgh n GLY 194 N 5.05 4.03 0.37 4.51 0.00 -0.55 0.12 105.19 118.71 3dgh n GLY 194 Ca -0.08 -1.19 0.08 0.00 0.00 0.00 0.00 46.02 44.82 3dgh n GLY 194 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dgh n ALA 195 N -0.14 2.84 -1.34 4.61 0.00 -1.26 -4.22 120.51 120.99 3dgh n ALA 195 Ca 0.00 -2.82 -0.16 0.00 0.00 0.00 0.00 53.44 50.46 3dgh n ALA 195 Cb 0.00 -0.39 0.18 0.00 0.00 0.00 0.00 19.45 19.24 3dgh n ALA 195 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dgh n GLY 196 N -1.16 -2.13 0.34 0.00 0.00 -1.26 -0.60 105.19 100.38 3dgh n GLY 196 Ca 0.16 -1.58 -0.02 0.00 0.00 0.00 0.00 46.02 44.58 3dgh n GLY 196 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 3dgh h TYR 197 N -2.07 1.02 0.18 1.61 -0.00 -1.95 -1.63 116.97 114.13 3dgh h TYR 197 Ca -0.32 -0.02 -0.01 0.00 -0.00 0.00 0.00 58.73 58.38 3dgh h TYR 197 Cb 0.94 -0.33 0.00 0.00 -0.00 0.00 0.00 36.73 37.35 3dgh h TYR 197 CO 0.00 0.71 -0.09 0.82 -0.00 0.00 0.00 178.16 179.60 3dgh h ILE 198 N 1.04 0.84 -0.67 -0.90 2.04 -1.93 0.02 117.51 117.95 3dgh h ILE 198 Ca 0.26 -0.07 0.00 0.00 1.00 0.00 0.00 64.86 66.06 3dgh h ILE 198 Cb 0.03 0.88 -0.03 0.00 -0.74 0.00 0.00 36.82 36.96 3dgh h ILE 198 CO -0.04 0.02 0.44 1.23 0.00 0.00 0.00 178.15 179.79 3dgh h GLY 199 N -0.27 0.95 1.02 5.37 0.00 -1.69 -1.73 103.07 106.73 3dgh h GLY 199 Ca -0.02 -0.36 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 3dgh h GLY 199 CO 0.04 0.36 -0.20 1.41 0.00 0.00 0.00 176.54 178.14 3dgh h LEU 200 N 0.92 0.85 -0.51 3.11 4.07 -1.18 -0.47 115.31 122.10 3dgh h LEU 200 Ca 0.25 -0.41 0.00 0.00 0.08 0.00 0.00 57.88 57.80 3dgh h LEU 200 Cb -0.09 -0.24 -0.02 0.00 1.08 0.00 0.00 40.66 41.39 3dgh h LEU 200 CO -0.05 1.07 0.33 -0.33 -1.08 0.00 0.00 178.44 178.38 3dgh h GLU 201 N 0.63 0.68 -0.19 1.13 5.08 -0.86 -0.59 114.58 120.45 3dgh h GLU 201 Ca 0.08 -0.05 -0.02 0.00 -1.00 0.00 0.00 59.36 58.38 3dgh h GLU 201 Cb 0.76 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.85 3dgh h GLU 201 CO 0.06 0.46 0.04 0.00 -1.00 0.00 0.00 179.01 178.57 3dgh h ALA 203 N 0.84 1.05 0.41 0.00 0.00 -0.98 -0.62 119.26 119.95 3dgh h ALA 203 Ca 0.06 0.04 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 3dgh h ALA 203 Cb 0.29 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 3dgh h ALA 203 CO 0.00 0.02 -0.28 0.78 0.00 0.00 0.00 179.25 179.77 3dgh h GLY 204 N 0.68 -0.71 1.80 0.00 0.00 -0.73 -1.84 103.07 102.27 3dgh h GLY 204 Ca 0.36 0.31 -0.10 0.00 0.00 0.00 0.00 47.33 47.91 3dgh h GLY 204 CO -0.25 -0.27 -0.38 0.27 0.00 0.00 0.00 176.54 175.91 3dgh h PHE 205 N -0.67 0.26 -0.45 5.60 -5.15 -1.19 -1.82 116.94 113.51 3dgh h PHE 205 Ca -0.04 -0.07 0.01 0.00 -0.20 0.00 0.00 57.97 57.67 3dgh h PHE 205 Cb 0.57 -0.06 -0.02 0.00 0.22 0.00 0.00 35.95 36.65 3dgh h PHE 205 CO -0.12 0.58 0.29 -0.07 -2.00 0.00 0.00 178.31 177.00 3dgh h LEU 206 N 0.19 0.50 -0.54 2.10 3.38 -0.93 -1.35 115.31 118.67 3dgh h LEU 206 Ca 0.02 -0.01 0.00 0.00 0.09 0.00 0.00 57.88 57.98 3dgh h LEU 206 Cb 0.76 -0.12 -0.03 0.00 0.09 0.00 0.00 40.66 41.36 3dgh h LEU 206 CO 0.06 0.37 0.35 0.50 0.09 0.00 0.00 178.44 179.80 3dgh h LYS 207 N 0.60 0.72 0.00 1.13 1.63 -1.14 -0.52 116.57 118.99 3dgh h LYS 207 Ca 0.17 -0.05 -0.01 0.00 -0.85 0.00 0.00 60.65 59.91 3dgh h LYS 207 Cb -0.06 -0.16 -0.00 0.00 -0.60 0.00 0.00 32.23 31.41 3dgh h LYS 207 CO -0.04 0.49 -0.06 0.78 -3.45 0.00 0.00 179.45 177.17 3dgh h GLY 208 N 0.73 0.00 -2.58 5.01 0.00 -0.95 -1.48 103.07 103.79 3dgh h GLY 208 Ca 0.20 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.53 3dgh h GLY 208 CO -0.04 0.00 0.00 1.04 0.00 0.00 0.00 176.54 177.54 3dgh n LEU 209 N -3.36 3.87 0.00 3.11 4.77 -0.54 -4.78 117.00 120.06 3dgh n LEU 209 Ca -0.02 -1.94 0.00 0.00 -0.03 0.00 0.00 56.01 54.02 3dgh n LEU 209 Cb 0.21 -0.49 0.00 0.00 -2.33 0.00 0.00 43.42 40.81 3dgh n LEU 209 CO 0.27 0.79 0.00 0.61 -1.33 0.00 0.00 177.39 177.73 3dgh n GLY 210 N 1.29 0.75 3.95 -0.72 0.00 -0.56 -4.56 105.19 105.34 3dgh n GLY 210 Ca 0.22 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 46.00 3dgh n GLY 210 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 3dgh n TYR 211 N -2.30 -3.06 -3.76 1.61 4.02 -0.25 -5.01 117.16 108.41 3dgh n TYR 211 Ca 0.00 -1.72 -0.29 0.00 -0.01 0.00 0.00 57.90 55.88 3dgh n TYR 211 Cb 0.00 -0.78 -0.13 0.00 -0.02 0.00 0.00 39.34 38.41 3dgh n TYR 211 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 3dgh s GLU 212 N -5.26 1.64 0.36 -0.72 0.41 -1.14 -4.19 118.70 109.80 3dgh s GLU 212 Ca 0.69 -2.43 -0.15 0.00 -0.41 0.00 0.00 54.97 52.66 3dgh s GLU 212 Cb -0.04 -2.67 -0.09 0.00 -1.78 0.00 0.00 34.13 29.56 3dgh s GLU 212 CO 0.46 -1.20 0.78 -1.25 -0.49 0.00 0.00 175.26 173.55 3dgh s PRO 213 N -0.20 3.99 -0.02 0.39 0.04 -1.26 -0.98 135.00 136.96 3dgh s PRO 213 Ca 0.21 0.70 0.06 0.00 0.04 0.00 0.00 61.00 62.01 3dgh s PRO 213 Cb -0.17 -2.38 -0.02 0.00 0.04 0.00 0.00 34.50 31.97 3dgh s PRO 213 CO -0.06 0.08 -0.20 0.99 0.04 0.00 0.00 177.00 177.85 3dgh s THR 214 N -2.11 1.58 -0.27 1.26 2.01 -0.30 -4.16 115.64 113.66 3dgh s THR 214 Ca 0.55 -0.85 -0.10 0.00 0.31 0.00 0.00 61.69 61.60 3dgh s THR 214 Cb -0.10 -1.31 -0.04 0.00 0.01 0.00 0.00 72.50 71.06 3dgh s THR 214 CO 0.20 0.45 0.14 -0.69 -0.69 0.00 0.00 174.62 174.03 3dgh s VAL 215 N -0.47 4.94 -0.23 3.82 1.01 -0.35 0.07 120.40 129.19 3dgh s VAL 215 Ca 0.08 0.04 -0.12 0.00 0.00 0.00 0.00 61.98 61.98 3dgh s VAL 215 Cb -0.08 -3.34 -0.05 0.00 0.00 0.00 0.00 36.38 32.92 3dgh s VAL 215 CO -0.01 0.29 0.24 -0.32 0.00 0.00 0.00 175.10 175.30 3dgh s MET 216 N 1.67 4.09 -0.23 2.72 1.75 0.67 -0.10 119.30 129.86 3dgh s MET 216 Ca 0.07 -0.13 -0.01 0.00 -1.25 0.00 0.00 55.69 54.37 3dgh s MET 216 Cb -0.16 -3.55 0.02 0.00 2.84 0.00 0.00 34.83 33.98 3dgh s MET 216 CO 0.08 -0.00 -0.08 0.08 -0.65 0.00 0.00 175.02 174.44 3dgh s VAL 217 N 1.24 2.80 0.05 10.11 1.01 -0.25 -1.49 120.40 133.88 3dgh s VAL 217 Ca 0.11 -0.93 -0.20 0.00 0.00 0.00 0.00 61.98 60.96 3dgh s VAL 217 Cb -0.14 -2.36 -0.13 0.00 0.00 0.00 0.00 36.38 33.75 3dgh s VAL 217 CO 0.06 0.29 1.41 -0.09 0.00 0.00 0.00 175.10 176.78 3dgh h ARG 218 N 8.01 0.35 0.00 2.72 2.43 -1.85 0.12 114.38 126.17 3dgh h ARG 218 Ca -0.36 -0.15 0.00 0.00 -0.81 0.00 0.00 59.98 58.66 3dgh h ARG 218 Cb 1.12 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 3dgh h ARG 218 CO 0.59 0.66 0.00 -1.13 -1.51 0.00 0.00 179.97 178.58 3dgh n SER 219 N -4.62 0.00 -4.69 -3.80 3.41 -1.26 -4.11 113.62 98.55 3dgh n SER 219 Ca -0.05 0.00 -0.23 0.00 -0.26 0.00 0.00 58.87 58.32 3dgh n SER 219 Cb 0.30 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.18 3dgh n SER 219 CO 0.00 0.00 0.00 0.27 -0.16 0.00 0.00 175.04 175.15 3dgh s ILE 220 N 0.00 3.09 -0.09 -1.33 -0.00 -1.26 -4.66 121.20 116.94 3dgh s ILE 220 Ca 0.00 -1.81 -0.14 0.00 -0.00 0.00 0.00 60.65 58.71 3dgh s ILE 220 Cb 0.00 -2.91 -0.05 0.00 -0.00 0.00 0.00 42.46 39.50 3dgh s ILE 220 CO 0.00 -0.24 0.34 -0.69 -0.00 0.00 0.00 174.94 174.35 3dgh s VAL 221 N -2.41 5.21 -1.19 8.37 1.01 -1.26 -4.48 120.40 125.64 3dgh s VAL 221 Ca 0.35 0.67 -0.18 0.00 0.00 0.00 0.00 61.98 62.82 3dgh s VAL 221 Cb -0.03 -3.66 -0.00 0.00 0.00 0.00 0.00 36.38 32.69 3dgh s VAL 221 CO 0.21 0.48 0.72 0.18 0.00 0.00 0.00 175.10 176.69 3dgh n LEU 222 N 2.77 -2.54 -4.66 3.92 4.77 0.23 -4.86 117.00 116.64 3dgh n LEU 222 Ca -0.13 -1.03 -0.46 0.00 -0.03 0.00 0.00 56.01 54.36 3dgh n LEU 222 Cb 0.52 -2.31 -0.03 0.00 -2.33 0.00 0.00 43.42 39.27 3dgh n LEU 222 CO 0.38 0.49 1.00 -1.14 -1.33 0.00 0.00 177.39 176.79 3dgh n ARG 223 N -4.29 1.91 -0.06 3.23 0.63 -1.26 -1.41 116.66 115.40 3dgh n ARG 223 Ca -0.14 0.68 0.00 0.00 -0.92 0.00 0.00 57.85 57.47 3dgh n ARG 223 Cb 0.61 -2.33 0.00 0.00 0.45 0.00 0.00 32.46 31.18 3dgh n ARG 223 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 3dgh n GLY 224 N 2.33 0.81 3.77 5.14 0.00 -1.26 -5.03 105.19 110.95 3dgh n GLY 224 Ca 0.13 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.92 3dgh n GLY 224 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3dgh s PHE 225 N -2.35 2.99 -0.30 1.61 0.08 -0.50 -5.00 117.98 114.51 3dgh s PHE 225 Ca 0.00 -0.13 -0.41 0.00 0.12 0.00 0.00 56.93 56.52 3dgh s PHE 225 Cb 0.00 -1.36 -0.16 0.00 -0.57 0.00 0.00 43.02 40.93 3dgh s PHE 225 CO 0.00 0.54 1.76 -3.47 -0.10 0.00 0.00 175.22 173.95 3dgh n ASP 226 N -0.93 2.29 0.18 1.36 -0.08 -1.26 -4.83 116.55 113.29 3dgh n ASP 226 Ca -0.08 1.06 0.06 0.00 -1.51 0.00 0.00 54.79 54.32 3dgh n ASP 226 Cb 0.58 -1.12 0.30 0.00 2.34 0.00 0.00 41.12 43.21 3dgh n ASP 226 CO 0.00 0.00 0.00 1.56 0.12 0.00 0.00 177.20 178.88 3dgh h GLN 227 N 7.23 0.00 0.04 -0.67 1.08 -1.93 0.91 115.11 121.76 3dgh h GLN 227 Ca -0.45 0.00 -0.00 0.00 -1.45 0.00 0.00 58.65 56.74 3dgh h GLN 227 Cb 1.32 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.75 3dgh h GLN 227 CO 0.97 0.37 -0.02 0.37 -0.95 0.00 0.00 178.83 179.57 3dgh h GLN 228 N 0.00 -0.05 -0.79 1.46 4.15 -2.00 -2.28 115.11 115.61 3dgh h GLN 228 Ca -0.00 0.00 -0.04 0.00 0.77 0.00 0.00 58.65 59.38 3dgh h GLN 228 Cb 0.96 0.01 -0.04 0.00 0.21 0.00 0.00 27.48 28.63 3dgh h GLN 228 CO 0.05 0.09 0.34 0.52 -1.93 0.00 0.00 178.83 177.90 3dgh h MET 229 N -0.18 1.16 -0.59 1.69 2.86 -1.85 -1.90 114.93 116.11 3dgh h MET 229 Ca -0.01 -0.19 0.06 0.00 -2.06 0.00 0.00 59.70 57.50 3dgh h MET 229 Cb 0.16 -0.20 -0.05 0.00 0.06 0.00 0.00 31.60 31.58 3dgh h MET 229 CO 0.01 0.92 0.30 0.00 1.06 0.00 0.00 176.91 179.20 3dgh h ALA 230 N 1.18 0.77 0.00 6.32 0.00 -0.76 -0.98 119.26 125.78 3dgh h ALA 230 Ca 0.27 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 3dgh h ALA 230 Cb 0.17 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.87 3dgh h ALA 230 CO -0.03 -0.05 -0.68 0.93 0.00 0.00 0.00 179.25 179.42 3dgh h GLU 231 N 0.56 0.00 -0.77 0.00 4.39 -1.20 -1.08 114.58 116.48 3dgh h GLU 231 Ca 0.27 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.94 3dgh h GLU 231 Cb 0.19 0.00 -0.04 0.00 -0.10 0.00 0.00 28.75 28.81 3dgh h GLU 231 CO -0.19 0.68 0.36 -0.07 -1.16 0.00 0.00 179.01 178.64 3dgh h LEU 232 N 0.00 1.02 -0.28 1.33 3.38 -0.89 0.66 115.31 120.53 3dgh h LEU 232 Ca -0.01 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 3dgh h LEU 232 Cb 1.21 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.69 3dgh h LEU 232 CO 0.09 0.88 0.13 0.58 0.09 0.00 0.00 178.44 180.20 3dgh h VAL 233 N 1.10 1.16 -0.57 1.22 2.07 -0.83 0.18 116.25 120.58 3dgh h VAL 233 Ca 0.26 -0.47 0.01 0.00 0.82 0.00 0.00 66.70 67.32 3dgh h VAL 233 Cb 0.13 0.95 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 3dgh h VAL 233 CO -0.03 0.16 0.37 0.00 0.02 0.00 0.00 177.57 178.09 3dgh h ALA 234 N 0.98 0.72 -0.73 1.67 0.00 -1.02 -1.49 119.26 119.38 3dgh h ALA 234 Ca 0.09 -0.04 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 3dgh h ALA 234 Cb 0.14 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 3dgh h ALA 234 CO -0.01 0.16 0.29 0.00 0.00 0.00 0.00 179.25 179.68 3dgh h ALA 235 N 1.21 0.95 -0.48 0.00 0.00 -0.59 -0.87 119.26 119.47 3dgh h ALA 235 Ca 0.21 -0.19 -0.01 0.00 0.00 0.00 0.00 54.91 54.92 3dgh h ALA 235 Cb -0.09 -0.29 -0.02 0.00 0.00 0.00 0.00 17.79 17.39 3dgh h ALA 235 CO -0.04 0.58 0.28 0.66 0.00 0.00 0.00 179.25 180.73 3dgh h SER 236 N 1.06 0.58 -0.21 0.00 4.64 -0.45 -0.62 113.55 118.55 3dgh h SER 236 Ca 0.24 -0.03 -0.21 0.00 -0.47 0.00 0.00 61.79 61.33 3dgh h SER 236 Cb 0.22 -0.15 0.01 0.00 -0.31 0.00 0.00 62.40 62.17 3dgh h SER 236 CO -0.02 0.46 -0.68 0.24 -0.87 0.00 0.00 176.83 175.96 3dgh h MET 237 N 0.67 0.83 -0.81 4.77 2.86 -0.50 -2.78 114.93 119.97 3dgh h MET 237 Ca 0.17 -0.61 0.04 0.00 -2.06 0.00 0.00 59.70 57.24 3dgh h MET 237 Cb -0.00 0.11 -0.05 0.00 0.06 0.00 0.00 31.60 31.71 3dgh h MET 237 CO -0.03 1.23 0.51 0.93 1.06 0.00 0.00 176.91 180.61 3dgh h GLU 238 N 0.59 0.95 -0.52 1.72 5.08 -0.83 -0.87 114.58 120.70 3dgh h GLU 238 Ca -0.02 -0.06 0.10 0.00 -1.00 0.00 0.00 59.36 58.38 3dgh h GLU 238 Cb 1.30 -0.21 -0.03 0.00 0.50 0.00 0.00 28.75 30.31 3dgh h GLU 238 CO 0.14 0.63 0.35 1.49 -1.00 0.00 0.00 179.01 180.62 3dgh h GLU 239 N 0.97 0.25 -0.12 2.33 4.81 -1.02 -0.21 114.58 121.60 3dgh h GLU 239 Ca 0.33 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.55 3dgh h GLU 239 Cb 0.06 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.38 3dgh h GLU 239 CO -0.13 0.17 0.00 0.54 -0.73 0.00 0.00 179.01 178.86 3dgh n ARG 240 N -4.45 1.42 -1.17 1.92 1.74 -0.40 -4.90 116.66 110.82 3dgh n ARG 240 Ca 0.08 -0.64 0.00 0.00 -0.77 0.00 0.00 57.85 56.52 3dgh n ARG 240 Cb 0.40 -1.31 0.00 0.00 -1.02 0.00 0.00 32.46 30.53 3dgh n ARG 240 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3dgh n GLY 241 N 0.95 0.61 3.37 -0.13 0.00 -0.09 -5.04 105.19 104.86 3dgh n GLY 241 Ca 0.13 -0.78 -0.43 0.00 0.00 0.00 0.00 46.02 44.94 3dgh n GLY 241 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 3dgh s ILE 242 N -2.00 4.93 0.47 -0.61 1.01 -0.77 -4.93 121.20 119.30 3dgh s ILE 242 Ca 0.00 -1.08 -0.22 0.00 0.00 0.00 0.00 60.65 59.35 3dgh s ILE 242 Cb 0.00 -3.92 -0.07 0.00 0.01 0.00 0.00 42.46 38.48 3dgh s ILE 242 CO 0.00 -0.50 1.14 -2.16 0.00 0.00 0.00 174.94 173.42 3dgh s PRO 243 N 1.58 3.72 -0.05 2.79 0.04 -1.26 -3.73 135.00 138.09 3dgh s PRO 243 Ca 0.04 1.71 0.04 0.00 0.04 0.00 0.00 61.00 62.82 3dgh s PRO 243 Cb -0.23 -2.33 -0.02 0.00 0.04 0.00 0.00 34.50 31.96 3dgh s PRO 243 CO 0.06 -0.57 -0.16 -0.06 0.04 0.00 0.00 177.00 176.31 3dgh s PHE 244 N -1.61 2.65 -0.47 0.56 0.08 -1.26 -1.21 117.98 116.71 3dgh s PHE 244 Ca 0.65 -0.23 -0.08 0.00 0.12 0.00 0.00 56.93 57.39 3dgh s PHE 244 Cb -0.27 -1.62 0.12 0.00 -0.57 0.00 0.00 43.02 40.69 3dgh s PHE 244 CO 0.32 0.13 0.33 -0.51 -0.10 0.00 0.00 175.22 175.39 3dgh s LEU 245 N -0.66 5.63 0.40 -0.37 1.43 0.85 -4.94 118.68 121.02 3dgh s LEU 245 Ca 0.10 -1.97 -0.23 0.00 -1.03 0.00 0.00 54.13 51.00 3dgh s LEU 245 Cb -0.11 -1.98 -0.10 0.00 0.03 0.00 0.00 46.19 44.03 3dgh s LEU 245 CO 0.01 -0.66 0.96 -0.13 0.23 0.00 0.00 176.35 176.75 3dgh s ARG 246 N 1.27 4.31 -1.49 1.70 1.81 -1.26 -1.08 118.95 124.21 3dgh s ARG 246 Ca 0.07 1.23 -0.09 0.00 -1.72 0.00 0.00 55.73 55.21 3dgh s ARG 246 Cb -0.25 -2.39 0.06 0.00 -0.45 0.00 0.00 34.95 31.92 3dgh s ARG 246 CO -0.02 0.04 0.80 1.63 -0.68 0.00 0.00 175.30 177.07 3dgh n LYS 247 N -0.24 -4.69 -4.59 3.54 4.76 -0.09 -4.87 118.16 111.99 3dgh n LYS 247 Ca 0.05 0.54 -0.22 0.00 -2.87 0.00 0.00 58.31 55.82 3dgh n LYS 247 Cb 0.52 -5.21 -0.15 0.00 -1.84 0.00 0.00 35.03 28.35 3dgh n LYS 247 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 3dgh s THR 248 N -3.48 1.05 0.05 -0.18 2.01 -0.51 0.15 115.64 114.73 3dgh s THR 248 Ca 0.42 -0.60 0.05 0.00 0.31 0.00 0.00 61.69 61.87 3dgh s THR 248 Cb -0.22 -0.89 -0.02 0.00 0.01 0.00 0.00 72.50 71.38 3dgh s THR 248 CO 0.85 0.27 -0.14 0.68 -0.69 0.00 0.00 174.62 175.59 3dgh s VAL 249 N -0.36 1.12 0.40 3.82 -7.23 -0.59 -3.31 120.40 114.26 3dgh s VAL 249 Ca 0.05 -1.09 -0.23 0.00 -1.81 0.00 0.00 61.98 58.90 3dgh s VAL 249 Cb -0.05 -1.03 -0.10 0.00 0.56 0.00 0.00 36.38 35.75 3dgh s VAL 249 CO -0.00 -0.06 0.98 -2.16 -0.31 0.00 0.00 175.10 173.54 3dgh s PRO 250 N -1.32 4.27 -0.12 4.82 0.04 -1.26 -1.10 135.00 140.33 3dgh s PRO 250 Ca 0.01 1.28 0.07 0.00 0.04 0.00 0.00 61.00 62.39 3dgh s PRO 250 Cb -0.08 -2.41 -0.12 0.00 0.04 0.00 0.00 34.50 31.92 3dgh s PRO 250 CO 0.02 -0.01 -0.02 1.28 0.04 0.00 0.00 177.00 178.31 3dgh n LEU 251 N -0.23 1.08 -3.55 -3.56 4.32 0.11 -4.87 117.00 110.30 3dgh n LEU 251 Ca 0.05 -0.03 -0.07 0.00 -0.02 0.00 0.00 56.01 55.94 3dgh n LEU 251 Cb 0.52 -0.01 -0.02 0.00 -1.62 0.00 0.00 43.42 42.29 3dgh n LEU 251 CO 0.41 0.45 0.73 -0.94 -1.22 0.00 0.00 177.39 176.82 3dgh s SER 252 N -4.76 -0.31 -0.03 -1.43 1.04 -1.13 -4.23 113.70 102.85 3dgh s SER 252 Ca -0.11 -0.06 0.04 0.00 0.48 0.00 0.00 55.95 56.30 3dgh s SER 252 Cb 0.04 0.37 -0.00 0.00 0.10 0.00 0.00 66.02 66.53 3dgh s SER 252 CO 0.42 -0.62 -0.13 0.54 0.98 0.00 0.00 173.24 174.43 3dgh s VAL 253 N -3.06 1.09 0.08 5.02 0.11 -0.03 -2.03 120.40 121.58 3dgh s VAL 253 Ca 0.07 -0.55 0.02 0.00 -2.93 0.00 0.00 61.98 58.59 3dgh s VAL 253 Cb -0.01 -0.94 -0.04 0.00 -1.53 0.00 0.00 36.38 33.86 3dgh s VAL 253 CO -0.07 0.32 -0.07 -1.83 -3.33 0.00 0.00 175.10 170.13 3dgh s GLU 254 N 0.02 0.73 -0.19 1.54 -1.05 -0.22 -3.95 118.70 115.58 3dgh s GLU 254 Ca -0.01 -1.17 -0.09 0.00 -0.15 0.00 0.00 54.97 53.54 3dgh s GLU 254 Cb -0.09 -0.19 -0.05 0.00 -0.44 0.00 0.00 34.13 33.37 3dgh s GLU 254 CO 0.01 -0.01 0.12 0.21 0.95 0.00 0.00 175.26 176.54 3dgh s LYS 255 N -3.24 4.10 0.64 -4.83 2.20 -1.26 -0.61 119.74 116.74 3dgh s LYS 255 Ca 0.06 -0.24 -0.07 0.00 -0.36 0.00 0.00 55.97 55.35 3dgh s LYS 255 Cb 0.01 -3.36 0.02 0.00 -1.51 0.00 0.00 37.83 32.99 3dgh s LYS 255 CO -0.04 0.32 0.97 -0.65 -0.36 0.00 0.00 175.35 175.59 3dgh s GLN 256 N 0.28 2.73 0.51 4.03 -0.21 0.05 -4.95 119.66 122.10 3dgh s GLN 256 Ca 0.07 0.03 0.18 0.00 0.02 0.00 0.00 55.36 55.66 3dgh s GLN 256 Cb -0.11 -2.20 1.25 0.00 1.00 0.00 0.00 33.01 32.95 3dgh s GLN 256 CO -0.01 -0.90 2.09 -0.44 -2.12 0.00 0.00 175.29 173.91 3dgh h ASP 257 N -0.37 0.07 -0.19 5.90 3.32 -1.99 -0.78 116.42 122.39 3dgh h ASP 257 Ca -0.45 -0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.60 3dgh h ASP 257 Cb 1.27 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 40.80 3dgh h ASP 257 CO 0.61 0.05 0.00 -0.90 -1.72 0.00 0.00 179.24 177.28 3dgh n ASP 258 N -4.48 1.23 0.00 6.45 5.75 -1.26 -4.90 116.55 119.34 3dgh n ASP 258 Ca 0.02 -1.84 0.00 0.00 -0.01 0.00 0.00 54.79 52.96 3dgh n ASP 258 Cb 0.25 -0.13 0.00 0.00 -1.03 0.00 0.00 41.12 40.22 3dgh n ASP 258 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 3dgh n GLY 259 N 0.94 2.21 3.78 6.12 0.00 -0.30 -5.03 105.19 112.92 3dgh n GLY 259 Ca 0.11 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.82 3dgh n GLY 259 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dgh s LYS 260 N -0.37 2.41 -0.29 1.61 -0.14 -1.26 -4.68 119.74 117.03 3dgh s LYS 260 Ca 0.00 1.04 -0.09 0.00 -1.36 0.00 0.00 55.97 55.56 3dgh s LYS 260 Cb 0.00 -1.92 -0.02 0.00 -1.68 0.00 0.00 37.83 34.21 3dgh s LYS 260 CO 0.00 -1.49 0.13 -0.51 -0.76 0.00 0.00 175.35 172.72 3dgh s LEU 261 N -5.80 3.90 -0.30 3.17 1.43 0.12 -0.77 118.68 120.43 3dgh s LEU 261 Ca 0.60 -0.36 -0.22 0.00 -1.03 0.00 0.00 54.13 53.12 3dgh s LEU 261 Cb -0.16 -2.00 -0.01 0.00 0.03 0.00 0.00 46.19 44.06 3dgh s LEU 261 CO 0.56 -0.13 0.70 -0.22 0.23 0.00 0.00 176.35 177.49 3dgh s LEU 262 N 1.63 4.12 -0.22 1.79 2.96 0.22 -0.52 118.68 128.67 3dgh s LEU 262 Ca 0.05 0.55 -0.06 0.00 -0.22 0.00 0.00 54.13 54.45 3dgh s LEU 262 Cb -0.16 -2.93 -0.03 0.00 0.50 0.00 0.00 46.19 43.57 3dgh s LEU 262 CO 0.06 -0.53 0.02 -0.69 -1.32 0.00 0.00 176.35 173.89 3dgh s VAL 263 N 2.76 4.08 -0.03 1.68 1.01 -0.11 -1.06 120.40 128.73 3dgh s VAL 263 Ca 0.28 -0.26 -0.08 0.00 0.00 0.00 0.00 61.98 61.92 3dgh s VAL 263 Cb -0.15 -2.87 -0.05 0.00 0.00 0.00 0.00 36.38 33.32 3dgh s VAL 263 CO 0.12 0.40 0.26 -0.54 0.00 0.00 0.00 175.10 175.34 3dgh s LYS 264 N 1.19 3.60 0.20 2.72 1.02 -0.86 -1.75 119.74 125.87 3dgh s LYS 264 Ca 0.04 0.00 -0.09 0.00 0.02 0.00 0.00 55.97 55.94 3dgh s LYS 264 Cb -0.14 -3.14 -0.01 0.00 -0.52 0.00 0.00 37.83 34.01 3dgh s LYS 264 CO 0.02 0.69 0.32 1.52 -0.92 0.00 0.00 175.35 176.99 3dgh s TYR 265 N -1.18 0.56 -0.01 3.18 -0.85 -0.41 0.07 117.35 118.71 3dgh s TYR 265 Ca 0.23 -0.89 0.02 0.00 -0.52 0.00 0.00 57.07 55.91 3dgh s TYR 265 Cb -0.13 -0.08 0.00 0.00 0.38 0.00 0.00 41.96 42.13 3dgh s TYR 265 CO 0.12 -0.80 -0.06 0.21 -1.52 0.00 0.00 175.55 173.49 3dgh s LYS 266 N -4.03 0.60 -0.13 -3.49 2.20 -0.26 -1.09 119.74 113.54 3dgh s LYS 266 Ca 0.24 -0.20 -0.29 0.00 -0.36 0.00 0.00 55.97 55.36 3dgh s LYS 266 Cb 0.03 -0.59 -0.01 0.00 -1.51 0.00 0.00 37.83 35.74 3dgh s LYS 266 CO 0.06 0.09 1.01 1.21 -0.36 0.00 0.00 175.35 177.36 3dgh s ASN 267 N 0.11 7.20 0.52 1.43 2.47 0.06 -1.54 114.94 125.19 3dgh s ASN 267 Ca -0.01 1.48 0.30 0.00 0.42 0.00 0.00 52.86 55.06 3dgh s ASN 267 Cb -0.06 -2.55 1.05 0.00 -1.45 0.00 0.00 41.25 38.25 3dgh s ASN 267 CO -0.00 -0.49 1.87 0.58 -3.72 0.00 0.00 177.10 175.34 3dgh h VAL 268 N 5.18 0.02 0.01 -5.21 2.07 -0.63 0.11 116.25 117.80 3dgh h VAL 268 Ca -0.28 -0.68 -0.29 0.00 0.82 0.00 0.00 66.70 66.27 3dgh h VAL 268 Cb 1.13 1.66 -0.04 0.00 -1.52 0.00 0.00 31.29 32.52 3dgh h VAL 268 CO 0.88 0.01 -1.60 -0.62 0.02 0.00 0.00 177.57 176.26 3dgh n GLU 269 N -3.10 0.59 0.05 1.57 1.02 -1.26 -4.52 120.64 114.99 3dgh n GLU 269 Ca 0.02 0.48 -0.12 0.00 -0.02 0.00 0.00 57.16 57.52 3dgh n GLU 269 Cb 0.38 -1.69 -0.13 0.00 -0.02 0.00 0.00 31.44 29.97 3dgh n GLU 269 CO 0.00 0.00 0.00 1.79 1.18 0.00 0.00 177.13 180.10 3dgh h THR 270 N -0.87 1.36 0.00 2.62 1.35 -1.93 -3.48 112.91 111.96 3dgh h THR 270 Ca -0.43 -3.05 0.00 0.00 -0.55 0.00 0.00 66.41 62.39 3dgh h THR 270 Cb 1.45 2.76 0.00 0.00 -1.73 0.00 0.00 68.15 70.63 3dgh h THR 270 CO -0.22 0.83 0.00 0.61 -0.25 0.00 0.00 175.52 176.49 3dgh n GLY 271 N 1.52 1.02 3.74 5.82 0.00 0.39 -5.04 105.19 112.64 3dgh n GLY 271 Ca -0.09 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.51 3dgh n GLY 271 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 3dgh s GLU 272 N -0.44 4.42 -0.02 1.61 2.02 -1.25 -4.67 118.70 120.37 3dgh s GLU 272 Ca 0.00 2.02 -0.01 0.00 0.02 0.00 0.00 54.97 57.00 3dgh s GLU 272 Cb 0.00 -3.19 -0.04 0.00 0.10 0.00 0.00 34.13 31.00 3dgh s GLU 272 CO 0.00 -0.19 0.06 -1.21 0.02 0.00 0.00 175.26 173.94 3dgh s GLU 273 N -0.34 3.04 0.02 1.61 2.02 -1.26 -0.76 118.70 123.02 3dgh s GLU 273 Ca 0.55 -0.47 0.00 0.00 0.02 0.00 0.00 54.97 55.07 3dgh s GLU 273 Cb -0.36 -2.84 -0.00 0.00 0.10 0.00 0.00 34.13 31.03 3dgh s GLU 273 CO 0.39 0.66 0.02 0.45 0.02 0.00 0.00 175.26 176.81 3dgh n SER 274 N 1.39 -0.06 -3.46 -0.19 2.88 -0.25 -5.00 113.62 108.93 3dgh n SER 274 Ca -0.14 -1.11 -0.13 0.00 -1.33 0.00 0.00 58.87 56.16 3dgh n SER 274 Cb 0.53 0.12 -0.03 0.00 -0.75 0.00 0.00 64.21 64.08 3dgh n SER 274 CO 0.00 0.00 0.00 -1.83 -1.23 0.00 0.00 175.04 171.98 3dgh s GLU 275 N -2.05 1.22 0.17 -1.46 -1.05 -1.26 -1.28 118.70 112.98 3dgh s GLU 275 Ca 0.02 -0.36 -0.14 0.00 -0.15 0.00 0.00 54.97 54.33 3dgh s GLU 275 Cb -0.00 0.56 0.02 0.00 -0.44 0.00 0.00 34.13 34.27 3dgh s GLU 275 CO 0.01 -0.50 0.42 0.34 0.95 0.00 0.00 175.26 176.48 3dgh s ASP 276 N -2.47 -0.15 -0.11 0.83 3.68 -0.72 -5.01 116.67 112.72 3dgh s ASP 276 Ca -0.01 -0.57 -0.04 0.00 2.13 0.00 0.00 52.55 54.06 3dgh s ASP 276 Cb -0.01 0.51 -0.04 0.00 -1.45 0.00 0.00 42.92 41.94 3dgh s ASP 276 CO -0.09 -0.96 0.05 0.54 0.13 0.00 0.00 175.17 174.85 3dgh s VAL 277 N -3.89 4.74 0.08 1.11 0.11 -1.26 -0.94 120.40 120.36 3dgh s VAL 277 Ca 0.10 -0.08 0.01 0.00 -2.93 0.00 0.00 61.98 59.08 3dgh s VAL 277 Cb 0.01 -3.04 -0.04 0.00 -1.53 0.00 0.00 36.38 31.78 3dgh s VAL 277 CO -0.04 0.58 -0.06 -0.31 -3.33 0.00 0.00 175.10 171.95 3dgh s TYR 278 N -0.69 0.78 0.04 1.54 2.02 0.33 -4.93 117.35 116.44 3dgh s TYR 278 Ca 0.12 -0.96 -0.08 0.00 -0.37 0.00 0.00 57.07 55.78 3dgh s TYR 278 Cb -0.12 -0.48 -0.31 0.00 -0.40 0.00 0.00 41.96 40.66 3dgh s TYR 278 CO 0.02 -0.22 1.03 -0.44 -1.57 0.00 0.00 175.55 174.37 3dgh h ASP 279 N 3.04 0.57 -3.98 2.29 3.32 -0.85 0.34 116.42 121.15 3dgh h ASP 279 Ca -0.35 -0.64 -0.31 0.00 0.02 0.00 0.00 57.03 55.75 3dgh h ASP 279 Cb 1.16 -0.19 -0.28 0.00 0.22 0.00 0.00 39.33 40.25 3dgh h ASP 279 CO 0.65 1.51 -0.75 -0.89 -1.72 0.00 0.00 179.24 178.04 3dgh s THR 280 N -2.63 0.39 -0.21 0.35 2.01 -0.84 -4.72 115.64 109.99 3dgh s THR 280 Ca -0.07 -0.29 0.01 0.00 0.31 0.00 0.00 61.69 61.65 3dgh s THR 280 Cb 0.06 -0.35 0.05 0.00 0.01 0.00 0.00 72.50 72.27 3dgh s THR 280 CO 0.90 0.06 -0.09 -0.69 -0.69 0.00 0.00 174.62 174.11 3dgh s VAL 281 N -0.24 1.67 -0.30 3.82 1.01 -1.26 -1.15 120.40 123.95 3dgh s VAL 281 Ca 0.01 -1.13 -0.09 0.00 0.00 0.00 0.00 61.98 60.76 3dgh s VAL 281 Cb -0.03 -1.80 -0.01 0.00 0.00 0.00 0.00 36.38 34.54 3dgh s VAL 281 CO -0.00 0.08 0.14 -0.22 0.00 0.00 0.00 175.10 175.10 3dgh s LEU 282 N 1.36 4.00 -0.27 3.92 2.96 0.98 -0.90 118.68 130.73 3dgh s LEU 282 Ca -0.03 -0.44 -0.22 0.00 -0.22 0.00 0.00 54.13 53.22 3dgh s LEU 282 Cb -0.17 -2.00 -0.01 0.00 0.50 0.00 0.00 46.19 44.51 3dgh s LEU 282 CO -0.07 -0.16 0.69 0.26 -1.32 0.00 0.00 176.35 175.75 3dgh s TRP 283 N 1.62 3.26 -0.43 5.38 0.23 0.09 -1.09 118.94 127.99 3dgh s TRP 283 Ca 0.05 0.81 0.10 0.00 -2.03 0.00 0.00 56.10 55.03 3dgh s TRP 283 Cb -0.17 -2.98 0.38 0.00 0.03 0.00 0.00 33.47 30.74 3dgh s TRP 283 CO 0.06 -0.41 0.89 0.00 0.96 0.00 0.00 176.95 178.45 3dgh n ALA 284 N 5.89 3.50 -0.20 0.98 0.00 0.12 -4.39 120.51 126.41 3dgh n ALA 284 Ca 0.01 -3.87 0.10 0.00 0.00 0.00 0.00 53.44 49.68 3dgh n ALA 284 Cb 0.49 -0.82 0.26 0.00 0.00 0.00 0.00 19.45 19.38 3dgh n ALA 284 CO 0.00 0.00 0.00 0.44 0.00 0.00 0.00 177.50 177.94 3dgh n ILE 285 N -0.05 0.90 0.00 0.00 -5.35 -1.23 -4.19 119.36 109.44 3dgh n ILE 285 Ca 0.26 -0.95 0.00 0.00 -0.27 0.00 0.00 62.75 61.79 3dgh n ILE 285 Cb 0.61 0.60 0.00 0.00 -1.74 0.00 0.00 39.64 39.11 3dgh n ILE 285 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 3dgh n GLY 286 N 1.33 2.59 3.05 3.28 0.00 -1.26 -4.94 105.19 109.23 3dgh n GLY 286 Ca 0.20 -1.96 -0.24 0.00 0.00 0.00 0.00 46.02 44.03 3dgh n GLY 286 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3dgh s ARG 287 N -1.83 1.46 -0.18 1.61 0.52 -1.26 -1.12 118.95 118.15 3dgh s ARG 287 Ca 0.00 -0.43 -0.08 0.00 -0.52 0.00 0.00 55.73 54.70 3dgh s ARG 287 Cb 0.00 -1.27 -0.04 0.00 0.52 0.00 0.00 34.95 34.15 3dgh s ARG 287 CO 0.00 0.12 0.10 0.21 0.02 0.00 0.00 175.30 175.75 3dgh s LYS 288 N 0.33 3.97 0.45 3.54 2.20 0.59 -4.83 119.74 125.98 3dgh s LYS 288 Ca -0.08 -0.26 -0.25 0.00 -0.36 0.00 0.00 55.97 55.03 3dgh s LYS 288 Cb -0.12 -3.29 -0.08 0.00 -1.51 0.00 0.00 37.83 32.83 3dgh s LYS 288 CO 0.02 0.37 1.34 0.20 -0.36 0.00 0.00 175.35 176.92 3dgh s GLY 289 N 0.13 2.90 -0.76 5.54 0.00 -1.22 -0.98 107.32 112.93 3dgh s GLY 289 Ca 0.07 1.29 -0.05 0.00 0.00 0.00 0.00 44.72 46.03 3dgh s GLY 289 CO -0.00 1.86 2.78 1.04 0.00 0.00 0.00 173.10 178.78 3dgh n LEU 290 N -0.22 7.00 0.11 0.66 4.77 -0.80 -4.57 117.00 123.96 3dgh n LEU 290 Ca 0.06 -4.24 -0.02 0.00 -0.03 0.00 0.00 56.01 51.78 3dgh n LEU 290 Cb 0.44 -1.33 0.05 0.00 -2.33 0.00 0.00 43.42 40.25 3dgh n LEU 290 CO 0.55 1.86 0.37 -0.37 -1.33 0.00 0.00 177.39 178.48 3dgh h VAL 291 N 2.27 1.38 -0.16 4.08 -1.51 -1.87 -3.38 116.25 117.06 3dgh h VAL 291 Ca 0.50 -2.60 0.01 0.00 -1.23 0.00 0.00 66.70 63.39 3dgh h VAL 291 Cb 0.66 2.46 -0.02 0.00 -2.13 0.00 0.00 31.29 32.26 3dgh h VAL 291 CO 1.05 0.71 0.06 -0.78 -1.23 0.00 0.00 177.57 177.38 3dgh h ASP 292 N 0.00 0.07 0.75 4.19 3.58 -1.96 -2.56 116.42 120.50 3dgh h ASP 292 Ca -0.01 0.01 0.00 0.00 0.42 0.00 0.00 57.03 57.46 3dgh h ASP 292 Cb 1.40 0.00 0.00 0.00 1.72 0.00 0.00 39.33 42.45 3dgh h ASP 292 CO 0.09 0.07 0.00 0.44 -2.88 0.00 0.00 179.24 176.96 3dgh h ASP 293 N 0.14 0.00 1.32 2.28 3.45 -1.94 -3.07 116.42 118.60 3dgh h ASP 293 Ca 0.07 0.00 -0.01 0.00 0.43 0.00 0.00 57.03 57.51 3dgh h ASP 293 Cb 0.04 0.00 -0.00 0.00 -0.56 0.00 0.00 39.33 38.80 3dgh h ASP 293 CO -0.07 0.00 -0.06 -0.07 -1.57 0.00 0.00 179.24 177.47 3dgh h LEU 294 N 0.00 0.00 -2.26 1.55 3.38 -1.66 -3.40 115.31 112.91 3dgh h LEU 294 Ca 0.00 0.00 -0.44 0.00 0.09 0.00 0.00 57.88 57.53 3dgh h LEU 294 Cb 0.38 0.00 0.04 0.00 0.09 0.00 0.00 40.66 41.17 3dgh h LEU 294 CO 0.00 0.06 -0.88 0.59 0.09 0.00 0.00 178.44 178.30 3dgh n ASN 295 N -3.15 -2.36 -0.06 -0.43 3.02 -1.16 0.11 115.26 111.22 3dgh n ASN 295 Ca 0.02 -0.92 0.13 0.00 -0.03 0.00 0.00 54.58 53.77 3dgh n ASN 295 Cb 0.42 -3.63 0.53 0.00 -0.61 0.00 0.00 39.78 36.48 3dgh n ASN 295 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 3dgh h LEU 296 N -1.83 0.31 -2.40 3.41 3.38 -1.86 -0.81 115.31 115.51 3dgh h LEU 296 Ca -0.63 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.35 3dgh h LEU 296 Cb 1.36 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.05 3dgh h LEU 296 CO 0.55 0.19 0.02 -0.65 0.09 0.00 0.00 178.44 178.64 3dgh h PRO 297 N 0.35 0.00 0.00 1.13 0.11 -1.90 -0.71 132.00 130.98 3dgh h PRO 297 Ca 0.26 0.00 -0.03 0.00 0.11 0.00 0.00 66.00 66.34 3dgh h PRO 297 Cb 0.57 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.67 3dgh h PRO 297 CO -0.07 0.00 -0.13 -0.91 -0.21 0.00 0.00 178.00 176.68 3dgh h ASN 298 N 0.00 0.00 -0.01 -2.05 -0.26 -1.44 -2.73 115.58 109.10 3dgh h ASN 298 Ca 0.01 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.75 3dgh h ASN 298 Cb 0.05 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.31 3dgh h ASN 298 CO -0.00 0.13 -0.73 0.00 -1.06 0.00 0.00 177.43 175.77 3dgh n ALA 299 N -2.38 4.13 -1.38 -0.83 0.00 -0.38 -4.11 120.51 115.56 3dgh n ALA 299 Ca -0.02 -0.59 -0.04 0.00 0.00 0.00 0.00 53.44 52.79 3dgh n ALA 299 Cb 0.22 -0.73 -0.01 0.00 0.00 0.00 0.00 19.45 18.93 3dgh n ALA 299 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3dgh n GLY 300 N 1.43 0.56 3.69 0.00 0.00 -0.58 -4.47 105.19 105.81 3dgh n GLY 300 Ca 0.06 -0.84 -0.40 0.00 0.00 0.00 0.00 46.02 44.83 3dgh n GLY 300 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3dgh s VAL 301 N -2.16 5.01 0.19 1.61 1.01 -0.96 -4.74 120.40 120.36 3dgh s VAL 301 Ca 0.00 1.36 -0.30 0.00 0.00 0.00 0.00 61.98 63.04 3dgh s VAL 301 Cb 0.00 -4.01 -0.08 0.00 0.00 0.00 0.00 36.38 32.29 3dgh s VAL 301 CO 0.00 0.16 1.14 -0.89 0.00 0.00 0.00 175.10 175.52 3dgh s THR 302 N 1.43 3.69 0.32 3.92 2.01 -1.26 -4.51 115.64 121.24 3dgh s THR 302 Ca 0.34 1.47 0.09 0.00 0.31 0.00 0.00 61.69 63.90 3dgh s THR 302 Cb -0.17 -3.94 -0.05 0.00 0.01 0.00 0.00 72.50 68.36 3dgh s THR 302 CO 0.14 0.26 0.02 0.68 -0.69 0.00 0.00 174.62 175.03 3dgh s VAL 303 N -0.28 2.86 -0.31 3.82 -7.23 -1.26 -4.35 120.40 113.64 3dgh s VAL 303 Ca 0.50 -1.93 -0.02 0.00 -1.81 0.00 0.00 61.98 58.73 3dgh s VAL 303 Cb -0.31 -2.82 0.10 0.00 0.56 0.00 0.00 36.38 33.91 3dgh s VAL 303 CO 0.37 -0.24 0.11 -1.58 -0.31 0.00 0.00 175.10 173.44 3dgh s GLN 304 N -3.72 0.59 0.00 4.82 0.74 0.42 -4.89 119.66 117.62 3dgh s GLN 304 Ca 0.34 -0.95 0.00 0.00 0.05 0.00 0.00 55.36 54.80 3dgh s GLN 304 Cb -0.02 -1.79 0.00 0.00 1.10 0.00 0.00 33.01 32.30 3dgh s GLN 304 CO 0.20 -1.00 0.00 1.63 -0.55 0.00 0.00 175.29 175.57 3dgh n LYS 305 N 4.93 0.00 -0.02 1.67 5.02 -1.26 -1.58 118.16 126.92 3dgh n LYS 305 Ca -0.03 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.26 3dgh n LYS 305 Cb 0.42 -0.22 0.00 0.00 -0.02 0.00 0.00 35.03 35.21 3dgh n LYS 305 CO 0.00 0.00 0.00 -0.40 -0.52 0.00 0.00 177.40 176.48 3dgh n ASP 306 N 1.65 0.00 -4.54 4.39 5.68 -1.26 -4.86 116.55 117.60 3dgh n ASP 306 Ca 0.00 0.00 -0.26 0.00 -0.50 0.00 0.00 54.79 54.03 3dgh n ASP 306 Cb 0.00 -0.12 -0.11 0.00 -1.14 0.00 0.00 41.12 39.75 3dgh n ASP 306 CO 0.00 0.00 0.00 -0.54 -1.33 0.00 0.00 177.20 175.33 3dgh s LYS 307 N -0.04 1.81 -0.29 0.11 -0.14 -0.62 -3.44 119.74 117.14 3dgh s LYS 307 Ca 0.00 -1.96 -0.03 0.00 -1.36 0.00 0.00 55.97 52.62 3dgh s LYS 307 Cb 0.00 -1.56 0.04 0.00 -1.68 0.00 0.00 37.83 34.63 3dgh s LYS 307 CO 0.00 0.05 -0.00 0.42 -0.76 0.00 0.00 175.35 175.06 3dgh s ILE 308 N -2.73 3.14 0.23 2.17 1.01 -0.10 -0.44 121.20 124.49 3dgh s ILE 308 Ca 0.33 -1.17 -0.30 0.00 0.00 0.00 0.00 60.65 59.52 3dgh s ILE 308 Cb 0.05 -2.72 -0.09 0.00 0.01 0.00 0.00 42.46 39.71 3dgh s ILE 308 CO 0.16 0.00 1.25 -2.16 0.00 0.00 0.00 174.94 174.20 3dgh s PRO 309 N 1.32 4.45 0.13 2.79 0.04 -1.26 -1.52 135.00 140.94 3dgh s PRO 309 Ca -0.02 2.00 0.01 0.00 0.04 0.00 0.00 61.00 63.03 3dgh s PRO 309 Cb -0.18 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 3dgh s PRO 309 CO -0.01 -0.13 -0.02 0.14 0.04 0.00 0.00 177.00 177.02 3dgh s VAL 310 N -0.37 0.59 0.12 -0.36 -7.23 -1.26 -4.57 120.40 107.32 3dgh s VAL 310 Ca 0.52 -1.94 -0.00 0.00 -1.81 0.00 0.00 61.98 58.75 3dgh s VAL 310 Cb -0.35 -1.91 0.02 0.00 0.56 0.00 0.00 36.38 34.70 3dgh s VAL 310 CO 0.41 -0.66 0.16 -0.90 -0.31 0.00 0.00 175.10 173.80 3dgh n ASP 311 N -0.13 0.21 0.04 4.85 5.68 -0.72 -4.87 116.55 121.63 3dgh n ASP 311 Ca -0.09 -1.18 0.05 0.00 -0.50 0.00 0.00 54.79 53.07 3dgh n ASP 311 Cb 0.62 -0.10 0.25 0.00 -1.14 0.00 0.00 41.12 40.75 3dgh n ASP 311 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 3dgh n SER 312 N -2.99 0.17 -0.98 -1.12 3.41 -1.26 -0.27 113.62 110.58 3dgh n SER 312 Ca 0.03 0.56 0.08 0.00 -0.26 0.00 0.00 58.87 59.28 3dgh n SER 312 Cb 0.09 -0.59 0.24 0.00 -0.26 0.00 0.00 64.21 63.69 3dgh n SER 312 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3dgh n GLN 313 N -1.71 2.99 -1.47 4.33 6.02 -1.26 -4.53 117.38 121.75 3dgh n GLN 313 Ca 0.01 -2.42 -0.16 0.00 -0.01 0.00 0.00 57.00 54.42 3dgh n GLN 313 Cb 0.08 -1.51 -0.07 0.00 1.02 0.00 0.00 30.24 29.77 3dgh n GLN 313 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 3dgh n GLU 314 N 0.75 -1.22 -2.68 -1.09 4.71 0.63 -4.98 120.64 116.75 3dgh n GLU 314 Ca 0.18 1.07 -0.41 0.00 -0.01 0.00 0.00 57.16 57.99 3dgh n GLU 314 Cb 0.60 -5.29 -0.04 0.00 -1.01 0.00 0.00 31.44 25.69 3dgh n GLU 314 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 3dgh s ALA 315 N -2.56 3.28 1.09 0.62 0.00 -1.26 -1.38 121.76 121.56 3dgh s ALA 315 Ca 0.00 0.63 -0.13 0.00 0.00 0.00 0.00 51.96 52.47 3dgh s ALA 315 Cb 0.00 -3.29 0.18 0.00 0.00 0.00 0.00 23.12 20.01 3dgh s ALA 315 CO 0.00 -0.04 0.82 0.25 0.00 0.00 0.00 175.76 176.79 3dgh n THR 316 N 2.57 0.00 0.27 0.00 -2.24 -0.53 -1.75 114.28 112.60 3dgh n THR 316 Ca 0.02 -0.48 0.10 0.00 -2.27 0.00 0.00 64.05 61.42 3dgh n THR 316 Cb 0.48 -1.39 0.49 0.00 -2.10 0.00 0.00 70.33 67.81 3dgh n THR 316 CO 0.00 0.00 0.00 -0.46 -0.57 0.00 0.00 175.07 174.04 3dgh n ASN 317 N -3.96 0.54 -4.54 3.42 6.94 -1.26 -4.47 115.26 111.94 3dgh n ASN 317 Ca 0.11 0.69 -0.38 0.00 -0.02 0.00 0.00 54.58 54.98 3dgh n ASN 317 Cb 0.40 -0.78 -0.11 0.00 -2.36 0.00 0.00 39.78 36.92 3dgh n ASN 317 CO 0.00 0.00 0.00 -0.69 -1.03 0.00 0.00 177.26 175.54 3dgh s VAL 318 N -3.39 5.05 0.46 3.53 1.01 -1.26 -5.02 120.40 120.78 3dgh s VAL 318 Ca 0.01 -0.02 0.15 0.00 0.00 0.00 0.00 61.98 62.12 3dgh s VAL 318 Cb 0.07 -3.45 0.32 0.00 0.00 0.00 0.00 36.38 33.32 3dgh s VAL 318 CO 0.27 0.20 2.03 0.00 0.00 0.00 0.00 175.10 177.60 3dgh h ALA 319 N 8.36 2.04 -0.57 5.51 0.00 -1.99 -0.85 119.26 131.76 3dgh h ALA 319 Ca -0.35 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.55 3dgh h ALA 319 Cb 1.18 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.90 3dgh h ALA 319 CO 0.58 -0.13 0.00 0.27 0.00 0.00 0.00 179.25 179.97 3dgh n ASN 320 N -4.47 3.30 -4.12 0.00 6.94 -1.26 -4.87 115.26 110.78 3dgh n ASN 320 Ca 0.06 -1.98 -0.32 0.00 -0.02 0.00 0.00 54.58 52.32 3dgh n ASN 320 Cb 0.30 -0.38 -0.16 0.00 -2.36 0.00 0.00 39.78 37.18 3dgh n ASN 320 CO 0.00 0.00 0.00 -0.63 -1.03 0.00 0.00 177.26 175.60 3dgh s ILE 321 N -1.24 1.92 0.32 1.53 1.01 -0.32 -1.45 121.20 122.96 3dgh s ILE 321 Ca 0.41 -0.88 0.10 0.00 0.00 0.00 0.00 60.65 60.28 3dgh s ILE 321 Cb 0.22 -1.72 -0.06 0.00 0.01 0.00 0.00 42.46 40.91 3dgh s ILE 321 CO 0.29 0.52 -0.08 -0.31 0.00 0.00 0.00 174.94 175.36 3dgh s TYR 322 N 1.04 2.45 -0.01 3.97 1.51 -0.07 -1.45 117.35 124.79 3dgh s TYR 322 Ca -0.03 -0.41 -0.05 0.00 -1.01 0.00 0.00 57.07 55.57 3dgh s TYR 322 Cb -0.14 -1.30 0.00 0.00 -0.11 0.00 0.00 41.96 40.41 3dgh s TYR 322 CO -0.06 0.59 0.11 0.00 -1.11 0.00 0.00 175.55 175.08 3dgh s ALA 323 N -2.53 -0.25 0.06 3.71 0.00 -0.48 0.01 121.76 122.28 3dgh s ALA 323 Ca 0.33 -0.07 -0.22 0.00 0.00 0.00 0.00 51.96 52.00 3dgh s ALA 323 Cb -0.01 0.03 0.05 0.00 0.00 0.00 0.00 23.12 23.19 3dgh s ALA 323 CO 0.17 -0.16 0.51 0.54 0.00 0.00 0.00 175.76 176.83 3dgh s VAL 324 N -1.00 0.03 0.00 0.00 0.11 -0.56 -4.76 120.40 114.21 3dgh s VAL 324 Ca -0.11 -0.26 0.00 0.00 -2.93 0.00 0.00 61.98 58.68 3dgh s VAL 324 Cb -0.06 -0.99 0.00 0.00 -1.53 0.00 0.00 36.38 33.80 3dgh s VAL 324 CO 0.01 -0.14 0.00 0.61 -3.33 0.00 0.00 175.10 172.24 3dgh n GLY 325 N 0.32 -1.73 0.39 6.54 0.00 -1.26 -4.33 105.19 105.11 3dgh n GLY 325 Ca -0.18 -1.57 0.19 0.00 0.00 0.00 0.00 46.02 44.45 3dgh n GLY 325 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3dgh h ASP 326 N 0.00 0.18 0.32 1.61 3.45 -1.91 -2.40 116.42 117.67 3dgh h ASP 326 Ca 0.00 0.01 -0.01 0.00 0.43 0.00 0.00 57.03 57.46 3dgh h ASP 326 Cb 0.00 -0.02 -0.00 0.00 -0.56 0.00 0.00 39.33 38.74 3dgh h ASP 326 CO 0.00 0.09 -0.06 -0.29 -1.57 0.00 0.00 179.24 177.41 3dgh h ILE 327 N 0.19 0.36 -4.04 0.35 2.10 -1.81 -3.43 117.51 111.23 3dgh h ILE 327 Ca 0.32 -0.34 -0.49 0.00 1.08 0.00 0.00 64.86 65.44 3dgh h ILE 327 Cb 1.01 1.24 0.04 0.00 -1.09 0.00 0.00 36.82 38.02 3dgh h ILE 327 CO -0.06 0.06 0.42 0.27 -1.08 0.00 0.00 178.15 177.76 3dgh s ILE 328 N -4.18 3.53 0.03 2.19 -4.36 -0.91 -0.92 121.20 116.58 3dgh s ILE 328 Ca -0.03 1.04 -0.30 0.00 -0.26 0.00 0.00 60.65 61.09 3dgh s ILE 328 Cb 0.13 -3.47 -0.06 0.00 1.25 0.00 0.00 42.46 40.31 3dgh s ILE 328 CO 0.54 -0.12 1.32 -0.47 0.24 0.00 0.00 174.94 176.44 3dgh s TYR 329 N -1.78 3.13 -0.35 1.37 5.04 -0.58 -4.22 117.35 119.96 3dgh s TYR 329 Ca 0.65 1.03 0.00 0.00 -2.44 0.00 0.00 57.07 56.31 3dgh s TYR 329 Cb -0.21 -3.57 0.00 0.00 0.35 0.00 0.00 41.96 38.53 3dgh s TYR 329 CO 0.26 -1.96 0.00 0.41 -1.34 0.00 0.00 175.55 172.91 3dgh n GLY 330 N 3.46 0.61 3.48 8.97 0.00 -1.26 -4.83 105.19 115.62 3dgh n GLY 330 Ca 0.11 -0.91 -0.25 0.00 0.00 0.00 0.00 46.02 44.97 3dgh n GLY 330 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 3dgh s LYS 331 N -2.42 1.73 0.21 1.61 -0.14 -1.26 -5.09 119.74 114.38 3dgh s LYS 331 Ca 0.00 -1.63 -0.32 0.00 -1.36 0.00 0.00 55.97 52.66 3dgh s LYS 331 Cb 0.00 -1.86 -0.13 0.00 -1.68 0.00 0.00 37.83 34.16 3dgh s LYS 331 CO 0.00 0.36 1.57 -2.30 -0.76 0.00 0.00 175.35 174.22 3dgh n PRO 332 N -0.36 2.36 -2.97 -1.68 -0.02 -1.26 -4.89 135.00 126.17 3dgh n PRO 332 Ca -0.08 0.84 -0.44 0.00 -2.02 0.00 0.00 63.50 61.81 3dgh n PRO 332 Cb 0.58 -2.61 0.00 0.00 -0.02 0.00 0.00 33.50 31.46 3dgh n PRO 332 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 3dgh n GLU 333 N 2.98 3.61 -4.09 -0.52 1.02 -1.26 -4.82 120.64 117.56 3dgh n GLU 333 Ca 0.14 -4.07 -0.09 0.00 -0.02 0.00 0.00 57.16 53.12 3dgh n GLU 333 Cb 0.32 -2.81 -0.10 0.00 -0.02 0.00 0.00 31.44 28.83 3dgh n GLU 333 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 3dgh s LEU 334 N -0.14 2.42 -0.02 -4.62 1.43 -1.26 -5.04 118.68 111.45 3dgh s LEU 334 Ca 0.37 -0.86 -0.25 0.00 -1.03 0.00 0.00 54.13 52.37 3dgh s LEU 334 Cb -0.02 0.04 -0.20 0.00 0.03 0.00 0.00 46.19 46.05 3dgh s LEU 334 CO -0.01 -0.45 1.23 0.74 0.23 0.00 0.00 176.35 178.09 3dgh h THR 335 N 3.53 1.42 0.00 5.49 2.02 -1.99 -2.04 112.91 121.34 3dgh h THR 335 Ca -0.34 -1.30 -0.04 0.00 0.77 0.00 0.00 66.41 65.51 3dgh h THR 335 Cb 1.17 2.24 -0.01 0.00 -1.74 0.00 0.00 68.15 69.81 3dgh h THR 335 CO 0.58 0.34 -0.17 -0.65 0.37 0.00 0.00 175.52 175.99 3dgh h PRO 336 N -0.45 0.00 0.14 6.66 0.11 -1.99 0.42 132.00 136.89 3dgh h PRO 336 Ca 0.00 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.11 3dgh h PRO 336 Cb 0.58 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.69 3dgh h PRO 336 CO 0.01 0.17 -0.07 0.28 -0.21 0.00 0.00 178.00 178.18 3dgh h VAL 337 N 0.00 0.97 -0.56 3.15 2.07 -1.90 -1.61 116.25 118.36 3dgh h VAL 337 Ca -0.00 -0.43 0.08 0.00 0.82 0.00 0.00 66.70 67.16 3dgh h VAL 337 Cb 0.40 1.24 -0.06 0.00 -1.52 0.00 0.00 31.29 31.35 3dgh h VAL 337 CO 0.02 0.10 0.22 0.00 0.02 0.00 0.00 177.57 177.94 3dgh h ALA 338 N 0.45 0.72 0.15 1.67 0.00 -0.66 0.03 119.26 121.61 3dgh h ALA 338 Ca -0.02 0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.95 3dgh h ALA 338 Cb 0.31 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.12 3dgh h ALA 338 CO 0.03 -0.17 -0.07 0.28 0.00 0.00 0.00 179.25 179.32 3dgh h VAL 339 N 0.42 0.91 -0.43 0.00 2.07 -0.89 -0.56 116.25 117.78 3dgh h VAL 339 Ca 0.27 -0.22 -0.15 0.00 0.82 0.00 0.00 66.70 67.43 3dgh h VAL 339 Cb 0.29 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.10 3dgh h VAL 339 CO -0.26 0.05 -0.31 0.25 0.02 0.00 0.00 177.57 177.32 3dgh h LEU 340 N -0.30 1.01 -0.75 2.57 5.85 -1.18 -1.62 115.31 120.89 3dgh h LEU 340 Ca -0.02 -0.44 -0.04 0.00 0.84 0.00 0.00 57.88 58.22 3dgh h LEU 340 Cb 0.24 -0.28 -0.03 0.00 0.37 0.00 0.00 40.66 40.95 3dgh h LEU 340 CO 0.03 1.23 0.29 0.00 -0.34 0.00 0.00 178.44 179.66 3dgh h ALA 341 N 0.81 0.97 -0.41 1.25 0.00 -0.97 -0.13 119.26 120.78 3dgh h ALA 341 Ca 0.08 -0.19 -0.08 0.00 0.00 0.00 0.00 54.91 54.72 3dgh h ALA 341 Cb 0.90 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.38 3dgh h ALA 341 CO 0.08 0.60 -0.07 0.78 0.00 0.00 0.00 179.25 180.65 3dgh h GLY 342 N 1.08 0.84 0.96 0.00 0.00 -0.94 -1.29 103.07 103.73 3dgh h GLY 342 Ca 0.25 -0.67 0.00 0.00 0.00 0.00 0.00 47.33 46.91 3dgh h GLY 342 CO -0.02 0.61 -0.04 -0.09 0.00 0.00 0.00 176.54 177.01 3dgh h ARG 343 N 0.60 -0.08 -0.62 4.80 2.43 -1.16 -2.29 114.38 118.07 3dgh h ARG 343 Ca 0.11 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.27 3dgh h ARG 343 Cb 0.58 0.02 -0.03 0.00 -0.42 0.00 0.00 29.97 30.12 3dgh h ARG 343 CO 0.03 -0.05 0.32 -0.07 -1.51 0.00 0.00 179.97 178.69 3dgh h LEU 344 N -0.09 0.76 -0.24 3.80 3.38 -0.95 -1.96 115.31 120.01 3dgh h LEU 344 Ca -0.00 -0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 3dgh h LEU 344 Cb 0.08 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.62 3dgh h LEU 344 CO -0.00 0.63 0.12 0.25 0.09 0.00 0.00 178.44 179.52 3dgh h LEU 345 N 0.86 0.31 -0.94 1.67 5.85 -1.06 -1.01 115.31 121.00 3dgh h LEU 345 Ca 0.22 -0.11 0.02 0.00 0.84 0.00 0.00 57.88 58.85 3dgh h LEU 345 Cb 0.05 -0.08 -0.05 0.00 0.37 0.00 0.00 40.66 40.94 3dgh h LEU 345 CO -0.03 0.34 0.62 0.00 -0.34 0.00 0.00 178.44 179.02 3dgh h ALA 346 N 0.99 1.22 -0.12 1.25 0.00 -1.17 -0.60 119.26 120.83 3dgh h ALA 346 Ca 0.08 -0.05 -0.04 0.00 0.00 0.00 0.00 54.91 54.90 3dgh h ALA 346 Cb 0.10 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 3dgh h ALA 346 CO -0.01 0.53 -0.12 0.00 0.00 0.00 0.00 179.25 179.65 3dgh h ARG 347 N 1.22 0.19 0.04 0.00 -0.00 -0.79 0.16 114.38 115.21 3dgh h ARG 347 Ca 0.36 -0.04 -0.24 0.00 -0.50 0.00 0.00 59.98 59.56 3dgh h ARG 347 Cb -0.06 -0.03 0.00 0.00 0.00 0.00 0.00 29.97 29.88 3dgh h ARG 347 CO -0.10 0.32 -1.03 0.00 0.00 0.00 0.00 179.97 179.16 3dgh h ARG 348 N 0.18 0.35 -0.09 0.04 3.08 -0.43 -0.50 114.38 117.01 3dgh h ARG 348 Ca 0.04 -0.43 -0.09 0.00 0.07 0.00 0.00 59.98 59.57 3dgh h ARG 348 Cb 0.33 0.14 0.00 0.00 0.08 0.00 0.00 29.97 30.52 3dgh h ARG 348 CO 0.02 1.13 -0.28 -0.07 -1.07 0.00 0.00 179.97 179.70 3dgh h LEU 349 N 0.17 0.40 -0.26 3.04 3.38 -0.66 -3.39 115.31 117.99 3dgh h LEU 349 Ca -0.09 -0.60 0.00 0.00 0.09 0.00 0.00 57.88 57.27 3dgh h LEU 349 Cb 1.69 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.32 3dgh h LEU 349 CO 0.17 0.94 0.00 -1.22 0.09 0.00 0.00 178.44 178.42 3dgh n TYR 350 N -4.45 0.00 0.23 1.13 4.02 0.53 -4.75 117.16 113.86 3dgh n TYR 350 Ca -0.08 0.00 0.04 0.00 -0.01 0.00 0.00 57.90 57.86 3dgh n TYR 350 Cb 0.47 0.00 0.06 0.00 -0.02 0.00 0.00 39.34 39.85 3dgh n TYR 350 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 3dgh n GLY 351 N 0.53 0.36 2.19 2.72 0.00 -0.32 -4.79 105.19 105.89 3dgh n GLY 351 Ca 0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 46.02 45.70 3dgh n GLY 351 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3dgh n GLY 352 N 0.45 0.77 3.86 -0.02 0.00 -0.97 -4.95 105.19 104.33 3dgh n GLY 352 Ca 0.06 -0.66 -0.31 0.00 0.00 0.00 0.00 46.02 45.11 3dgh n GLY 352 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 3dgh s SER 353 N -2.79 6.66 0.00 1.61 0.15 -0.47 -4.98 113.70 113.87 3dgh s SER 353 Ca 0.00 1.22 0.09 0.00 0.70 0.00 0.00 55.95 57.96 3dgh s SER 353 Cb 0.00 -2.35 -0.10 0.00 -1.71 0.00 0.00 66.02 61.86 3dgh s SER 353 CO 0.00 -0.30 0.41 0.35 1.20 0.00 0.00 173.24 174.90 3dgh n THR 354 N -0.81 0.00 -1.71 6.45 -2.24 -1.26 -4.28 114.28 110.43 3dgh n THR 354 Ca 0.03 -0.28 -0.42 0.00 -2.27 0.00 0.00 64.05 61.10 3dgh n THR 354 Cb 0.54 1.01 -0.03 0.00 -2.10 0.00 0.00 70.33 69.74 3dgh n THR 354 CO 0.00 0.00 0.00 -1.58 -0.57 0.00 0.00 175.07 172.92 3dgh s GLN 355 N -1.86 4.05 0.25 -0.78 0.74 -1.26 -4.98 119.66 115.82 3dgh s GLN 355 Ca 0.04 2.50 -0.04 0.00 0.05 0.00 0.00 55.36 57.91 3dgh s GLN 355 Cb 0.07 -4.16 -0.05 0.00 1.10 0.00 0.00 33.01 29.97 3dgh s GLN 355 CO 0.38 -1.05 0.50 1.03 -0.55 0.00 0.00 175.29 175.59 3dgh s ARG 356 N 4.59 3.60 0.31 1.67 0.52 -1.26 -4.83 118.95 123.54 3dgh s ARG 356 Ca 0.88 -0.09 -0.29 0.00 -0.52 0.00 0.00 55.73 55.70 3dgh s ARG 356 Cb -0.40 -2.71 -0.10 0.00 0.52 0.00 0.00 34.95 32.25 3dgh s ARG 356 CO 0.39 0.29 1.34 1.41 0.02 0.00 0.00 175.30 178.75 3dgh s MET 357 N -3.41 4.34 -0.45 3.54 -2.45 -1.26 -4.99 119.30 114.61 3dgh s MET 357 Ca 0.42 2.23 -0.15 0.00 -1.25 0.00 0.00 55.69 56.94 3dgh s MET 357 Cb -0.11 -3.09 0.06 0.00 1.25 0.00 0.00 34.83 32.94 3dgh s MET 357 CO 0.29 -0.24 0.36 0.34 1.05 0.00 0.00 175.02 176.82 3dgh s ASP 358 N -0.26 6.11 0.00 1.11 -1.08 -1.26 -4.93 116.67 116.35 3dgh s ASP 358 Ca 0.51 -1.21 0.21 0.00 -0.52 0.00 0.00 52.55 51.55 3dgh s ASP 358 Cb -0.40 -2.16 0.60 0.00 -1.46 0.00 0.00 42.92 39.50 3dgh s ASP 358 CO 0.50 -0.58 1.48 -1.22 0.52 0.00 0.00 175.17 175.87 3dgh n TYR 359 N 5.17 0.32 -3.15 -5.34 4.02 -1.26 -4.93 117.16 111.99 3dgh n TYR 359 Ca -0.12 -0.16 -0.38 0.00 -0.01 0.00 0.00 57.90 57.23 3dgh n TYR 359 Cb 0.45 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.71 3dgh n TYR 359 CO 0.00 0.00 0.00 0.15 -1.01 0.00 0.00 176.86 176.00 3dgh s LYS 360 N -1.68 4.33 -1.39 -0.72 -0.14 -1.26 -4.30 119.74 114.59 3dgh s LYS 360 Ca 0.34 0.89 -0.09 0.00 -1.36 0.00 0.00 55.97 55.76 3dgh s LYS 360 Cb 0.19 -3.18 0.03 0.00 -1.68 0.00 0.00 37.83 33.19 3dgh s LYS 360 CO 0.28 0.58 1.08 -0.25 -0.76 0.00 0.00 175.35 176.27 3dgh n ASP 361 N 1.49 -5.08 -4.68 2.83 10.43 -1.26 -4.94 116.55 115.35 3dgh n ASP 361 Ca -0.07 -0.64 -0.43 0.00 2.57 0.00 0.00 54.79 56.22 3dgh n ASP 361 Cb 0.50 -4.66 -0.02 0.00 1.84 0.00 0.00 41.12 38.78 3dgh n ASP 361 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 3dgh s VAL 362 N -3.34 4.75 0.54 2.53 1.01 -1.26 -4.50 120.40 120.12 3dgh s VAL 362 Ca 0.50 2.03 -0.19 0.00 0.00 0.00 0.00 61.98 64.32 3dgh s VAL 362 Cb -0.23 -4.31 -0.06 0.00 0.00 0.00 0.00 36.38 31.78 3dgh s VAL 362 CO 0.76 -0.07 1.07 0.00 0.00 0.00 0.00 175.10 176.87 3dgh s ALA 363 N 2.47 2.77 0.07 5.51 0.00 -1.26 -4.60 121.76 126.72 3dgh s ALA 363 Ca 0.46 0.61 -0.09 0.00 0.00 0.00 0.00 51.96 52.94 3dgh s ALA 363 Cb -0.17 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.67 3dgh s ALA 363 CO 0.13 -0.60 0.20 -0.08 0.00 0.00 0.00 175.76 175.41 3dgh s THR 364 N -2.06 0.13 -0.02 0.00 -1.32 -0.50 -5.02 115.64 106.85 3dgh s THR 364 Ca 0.68 -1.04 0.02 0.00 -1.21 0.00 0.00 61.69 60.14 3dgh s THR 364 Cb -0.18 -1.17 0.00 0.00 -1.51 0.00 0.00 72.50 69.64 3dgh s THR 364 CO 0.27 -0.58 -0.08 -0.89 -2.21 0.00 0.00 174.62 171.14 3dgh s THR 365 N -3.34 0.68 -0.36 5.08 2.01 -1.26 -1.52 115.64 116.93 3dgh s THR 365 Ca 0.01 -0.30 -0.13 0.00 0.31 0.00 0.00 61.69 61.57 3dgh s THR 365 Cb 0.02 -0.61 -0.00 0.00 0.01 0.00 0.00 72.50 71.92 3dgh s THR 365 CO -0.08 0.22 0.25 -0.69 -0.69 0.00 0.00 174.62 173.62 3dgh s VAL 366 N 0.22 5.18 -0.64 3.82 1.01 0.15 -5.00 120.40 125.14 3dgh s VAL 366 Ca -0.03 -0.38 -0.05 0.00 0.00 0.00 0.00 61.98 61.52 3dgh s VAL 366 Cb -0.08 -3.73 0.02 0.00 0.00 0.00 0.00 36.38 32.59 3dgh s VAL 366 CO 0.00 -0.09 2.82 0.49 0.00 0.00 0.00 175.10 178.32 3dgh n PHE 367 N 5.10 1.63 -1.22 5.22 3.01 -1.26 -1.47 117.46 128.47 3dgh n PHE 367 Ca -0.12 -2.13 -0.29 0.00 1.01 0.00 0.00 57.45 55.92 3dgh n PHE 367 Cb 0.49 -1.57 0.17 0.00 -0.01 0.00 0.00 39.48 38.56 3dgh n PHE 367 CO 0.00 0.00 0.00 0.95 1.01 0.00 0.00 176.76 178.72 3dgh s THR 368 N -1.31 2.09 0.23 4.37 -4.23 -1.26 -4.74 115.64 110.79 3dgh s THR 368 Ca 0.60 0.03 -0.07 0.00 -1.18 0.00 0.00 61.69 61.07 3dgh s THR 368 Cb 0.32 -2.56 0.20 0.00 1.34 0.00 0.00 72.50 71.80 3dgh s THR 368 CO -0.15 -0.04 1.70 -0.65 -0.54 0.00 0.00 174.62 174.94 3dgh h PRO 369 N -1.83 0.30 -4.73 3.99 0.11 -1.89 -2.90 132.00 125.06 3dgh h PRO 369 Ca -0.54 -0.02 -0.68 0.00 0.11 0.00 0.00 66.00 64.88 3dgh h PRO 369 Cb 1.33 -0.07 -0.20 0.00 0.11 0.00 0.00 31.00 32.17 3dgh h PRO 369 CO 0.58 0.20 -0.49 -1.17 -0.21 0.00 0.00 178.00 176.90 3dgh s LEU 370 N -10.52 4.44 0.56 2.35 2.96 -1.26 -5.01 118.68 112.20 3dgh s LEU 370 Ca -0.13 -0.45 -0.18 0.00 -0.22 0.00 0.00 54.13 53.16 3dgh s LEU 370 Cb 0.20 -2.11 -0.05 0.00 0.50 0.00 0.00 46.19 44.73 3dgh s LEU 370 CO 0.75 -0.23 1.08 -1.61 -1.32 0.00 0.00 176.35 175.02 3dgh s GLU 371 N 1.70 3.37 -0.11 1.98 2.02 -1.09 -4.74 118.70 121.83 3dgh s GLU 371 Ca 0.06 1.37 0.01 0.00 0.02 0.00 0.00 54.97 56.43 3dgh s GLU 371 Cb -0.17 -2.03 0.02 0.00 0.10 0.00 0.00 34.13 32.05 3dgh s GLU 371 CO 0.10 -0.79 -0.13 -0.47 0.02 0.00 0.00 175.26 173.99 3dgh s TYR 372 N -2.14 1.79 0.09 1.61 5.04 -0.54 -0.76 117.35 122.44 3dgh s TYR 372 Ca 0.67 -0.85 0.06 0.00 -2.44 0.00 0.00 57.07 54.52 3dgh s TYR 372 Cb -0.19 -1.33 -0.03 0.00 0.35 0.00 0.00 41.96 40.76 3dgh s TYR 372 CO 0.31 -0.47 -0.16 0.00 -1.34 0.00 0.00 175.55 173.89 3dgh s ALA 373 N 1.14 1.40 0.12 3.97 0.00 -0.13 0.35 121.76 128.62 3dgh s ALA 373 Ca -0.04 -1.12 -0.18 0.00 0.00 0.00 0.00 51.96 50.62 3dgh s ALA 373 Cb -0.14 -0.13 0.04 0.00 0.00 0.00 0.00 23.12 22.89 3dgh s ALA 373 CO -0.03 0.20 0.45 0.00 0.00 0.00 0.00 175.76 176.39 3dgh s VAL 375 N -3.61 0.00 0.00 0.00 0.11 -0.47 -1.41 120.40 115.02 3dgh s VAL 375 Ca 0.01 -0.02 0.00 0.00 -2.93 0.00 0.00 61.98 59.04 3dgh s VAL 375 Cb 0.01 -0.37 0.00 0.00 -1.53 0.00 0.00 36.38 34.49 3dgh s VAL 375 CO -0.11 -0.01 0.00 0.61 -3.33 0.00 0.00 175.10 172.26 3dgh n GLY 376 N 2.87 -1.45 3.76 6.54 0.00 -1.26 -1.04 105.19 114.61 3dgh n GLY 376 Ca -0.13 -1.40 -0.39 0.00 0.00 0.00 0.00 46.02 44.11 3dgh n GLY 376 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3dgh s LEU 377 N 0.00 4.47 0.86 0.99 1.43 -0.04 -4.84 118.68 121.54 3dgh s LEU 377 Ca 0.00 2.02 -0.10 0.00 -1.03 0.00 0.00 54.13 55.01 3dgh s LEU 377 Cb 0.00 -3.81 0.11 0.00 0.03 0.00 0.00 46.19 42.53 3dgh s LEU 377 CO 0.00 -0.07 1.13 -0.94 0.23 0.00 0.00 176.35 176.70 3dgh s SER 378 N -1.27 3.49 0.14 2.29 1.04 -1.26 -4.19 113.70 113.93 3dgh s SER 378 Ca 0.47 2.08 -0.18 0.00 0.48 0.00 0.00 55.95 58.79 3dgh s SER 378 Cb -0.25 -2.55 -0.02 0.00 0.10 0.00 0.00 66.02 63.30 3dgh s SER 378 CO 0.31 -2.72 1.77 -0.08 0.98 0.00 0.00 173.24 173.51 3dgh h GLU 379 N -1.57 0.29 -0.74 4.02 4.81 -1.97 -0.87 114.58 118.56 3dgh h GLU 379 Ca -0.43 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 58.75 3dgh h GLU 379 Cb 1.26 -0.07 -0.03 0.00 0.63 0.00 0.00 28.75 30.54 3dgh h GLU 379 CO 0.45 0.19 0.35 1.05 -0.73 0.00 0.00 179.01 180.33 3dgh h GLU 380 N 0.30 1.05 -0.34 1.92 9.09 -1.99 -0.72 114.58 123.90 3dgh h GLU 380 Ca 0.11 -0.15 -0.10 0.00 0.05 0.00 0.00 59.36 59.27 3dgh h GLU 380 Cb 0.02 -0.19 -0.01 0.00 -1.65 0.00 0.00 28.75 26.91 3dgh h GLU 380 CO -0.06 0.81 -0.22 -0.44 0.05 0.00 0.00 179.01 179.15 3dgh h ASP 381 N 1.05 0.65 -0.33 3.06 5.19 -1.84 -0.70 116.42 123.51 3dgh h ASP 381 Ca 0.26 -0.22 -0.05 0.00 -0.62 0.00 0.00 57.03 56.39 3dgh h ASP 381 Cb 0.11 -0.18 -0.01 0.00 0.18 0.00 0.00 39.33 39.42 3dgh h ASP 381 CO -0.03 0.87 0.02 0.00 -3.12 0.00 0.00 179.24 176.98 3dgh h ALA 382 N 1.18 0.44 -0.75 3.45 0.00 -0.87 -1.42 119.26 121.30 3dgh h ALA 382 Ca 0.08 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 3dgh h ALA 382 Cb 0.69 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 18.32 3dgh h ALA 382 CO 0.05 0.18 0.44 0.28 0.00 0.00 0.00 179.25 180.19 3dgh h VAL 383 N 0.39 1.22 -0.39 0.00 2.07 -0.95 -0.71 116.25 117.88 3dgh h VAL 383 Ca 0.10 -0.51 -0.02 0.00 0.82 0.00 0.00 66.70 67.09 3dgh h VAL 383 Cb 0.41 0.20 -0.02 0.00 -1.52 0.00 0.00 31.29 30.36 3dgh h VAL 383 CO 0.01 0.23 0.16 0.50 0.02 0.00 0.00 177.57 178.49 3dgh h LYS 384 N 1.03 0.57 -0.16 1.57 3.64 -1.01 0.12 116.57 122.33 3dgh h LYS 384 Ca 0.27 -0.10 -0.10 0.00 -1.27 0.00 0.00 60.65 59.45 3dgh h LYS 384 Cb -0.01 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.72 3dgh h LYS 384 CO -0.05 0.55 -0.28 0.37 -2.27 0.00 0.00 179.45 177.77 3dgh h GLN 385 N 0.48 0.47 0.00 1.90 4.15 -1.01 -3.38 115.11 117.73 3dgh h GLN 385 Ca 0.13 -0.29 0.00 0.00 0.77 0.00 0.00 58.65 59.25 3dgh h GLN 385 Cb 0.18 0.03 0.00 0.00 0.21 0.00 0.00 27.48 27.91 3dgh h GLN 385 CO -0.01 0.89 -1.03 1.19 -1.93 0.00 0.00 178.83 177.94 3dgh n PHE 386 N -4.40 0.00 0.00 3.99 3.01 -0.29 -5.10 117.46 114.67 3dgh n PHE 386 Ca -0.06 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.40 3dgh n PHE 386 Cb 0.46 -0.13 0.00 0.00 -0.01 0.00 0.00 39.48 39.80 3dgh n PHE 386 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 3dgh n GLY 387 N 1.51 -0.22 0.36 1.37 0.00 0.41 -4.42 105.19 104.21 3dgh n GLY 387 Ca 0.00 -1.38 0.11 0.00 0.00 0.00 0.00 46.02 44.75 3dgh n GLY 387 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3dgh h ALA 388 N 0.00 1.67 0.00 4.61 0.00 -1.90 -0.88 119.26 122.76 3dgh h ALA 388 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.96 3dgh h ALA 388 Cb 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.66 3dgh h ALA 388 CO 0.00 0.03 0.00 -0.40 0.00 0.00 0.00 179.25 178.88 3dgh n ASP 389 N -4.67 0.00 -0.31 0.00 5.75 -1.26 -2.41 116.55 113.65 3dgh n ASP 389 Ca 0.21 -0.18 0.03 0.00 -0.01 0.00 0.00 54.79 54.84 3dgh n ASP 389 Cb 0.48 -0.16 0.07 0.00 -1.03 0.00 0.00 41.12 40.49 3dgh n ASP 389 CO 0.00 0.00 0.00 -0.62 -0.11 0.00 0.00 177.20 176.47 3dgh n GLU 390 N -1.16 2.49 -4.80 0.11 -0.58 -0.34 -4.94 120.64 111.42 3dgh n GLU 390 Ca 0.09 -1.65 -0.32 0.00 -0.42 0.00 0.00 57.16 54.87 3dgh n GLU 390 Cb 0.09 -1.13 -0.13 0.00 -0.57 0.00 0.00 31.44 29.70 3dgh n GLU 390 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 3dgh s ILE 391 N -0.92 2.99 0.01 -3.67 -1.09 -1.01 -1.23 121.20 116.27 3dgh s ILE 391 Ca 0.11 -0.89 0.06 0.00 -2.23 0.00 0.00 60.65 57.70 3dgh s ILE 391 Cb 0.06 -2.20 -0.02 0.00 -1.58 0.00 0.00 42.46 38.72 3dgh s ILE 391 CO 0.08 0.49 -0.18 -0.70 -1.23 0.00 0.00 174.94 173.40 3dgh s GLU 392 N -1.01 1.36 -0.15 2.79 2.56 0.04 -4.68 118.70 119.60 3dgh s GLU 392 Ca 0.13 -0.74 0.01 0.00 0.00 0.00 0.00 54.97 54.37 3dgh s GLU 392 Cb -0.11 -1.36 0.02 0.00 2.00 0.00 0.00 34.13 34.68 3dgh s GLU 392 CO 0.03 0.36 -0.18 0.08 -0.56 0.00 0.00 175.26 174.99 3dgh s VAL 393 N -0.58 1.81 -0.17 3.70 1.01 -1.26 -1.26 120.40 123.66 3dgh s VAL 393 Ca 0.06 -0.80 -0.10 0.00 0.00 0.00 0.00 61.98 61.15 3dgh s VAL 393 Cb -0.08 -1.65 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 3dgh s VAL 393 CO 0.00 0.50 0.17 -0.36 0.00 0.00 0.00 175.10 175.41 3dgh s PHE 394 N 1.25 3.48 0.19 5.22 0.40 0.14 -1.15 117.98 127.51 3dgh s PHE 394 Ca 0.02 0.45 -0.17 0.00 -0.60 0.00 0.00 56.93 56.63 3dgh s PHE 394 Cb -0.14 -2.13 0.02 0.00 0.51 0.00 0.00 43.02 41.29 3dgh s PHE 394 CO -0.09 0.41 0.50 -3.38 0.70 0.00 0.00 175.22 173.36 3dgh s HIS 395 N -0.04 -0.07 -0.07 0.36 -3.43 -0.46 -0.21 115.29 111.36 3dgh s HIS 395 Ca 0.12 -0.27 -0.32 0.00 -0.80 0.00 0.00 55.06 53.78 3dgh s HIS 395 Cb -0.12 0.35 0.14 0.00 -1.43 0.00 0.00 32.58 31.52 3dgh s HIS 395 CO 0.01 -0.89 1.39 0.20 -2.00 0.00 0.00 174.74 173.45 3dgh s GLY 396 N -2.88 -0.47 0.23 -1.38 0.00 -0.78 -4.41 107.32 97.62 3dgh s GLY 396 Ca 0.10 0.89 0.02 0.00 0.00 0.00 0.00 44.72 45.72 3dgh s GLY 396 CO -0.03 0.16 0.39 -0.19 0.00 0.00 0.00 173.10 173.44 3dgh s TYR 397 N -2.15 3.48 0.26 1.90 1.51 -1.26 -1.95 117.35 119.13 3dgh s TYR 397 Ca 0.15 0.20 -0.07 0.00 -1.01 0.00 0.00 57.07 56.34 3dgh s TYR 397 Cb 0.07 -1.75 -0.01 0.00 -0.11 0.00 0.00 41.96 40.16 3dgh s TYR 397 CO -0.06 0.37 0.38 1.52 -1.11 0.00 0.00 175.55 176.65 3dgh s TYR 398 N -1.96 0.79 -0.15 2.71 -0.85 -0.63 -4.99 117.35 112.27 3dgh s TYR 398 Ca 0.37 -1.07 -0.01 0.00 -0.52 0.00 0.00 57.07 55.84 3dgh s TYR 398 Cb -0.10 -0.11 0.04 0.00 0.38 0.00 0.00 41.96 42.17 3dgh s TYR 398 CO 0.30 -0.93 -0.01 0.15 -1.52 0.00 0.00 175.55 173.54 3dgh s LYS 399 N -3.81 0.98 0.29 -3.49 1.02 -1.26 -4.66 119.74 108.81 3dgh s LYS 399 Ca 0.29 -0.31 -0.30 0.00 0.02 0.00 0.00 55.97 55.68 3dgh s LYS 399 Cb 0.02 -1.74 -0.11 0.00 -0.52 0.00 0.00 37.83 35.48 3dgh s LYS 399 CO 0.13 -0.45 1.53 -2.14 -0.92 0.00 0.00 175.35 173.50 3dgh s PRO 400 N 1.80 4.17 0.38 -1.68 0.02 -1.26 -4.90 135.00 133.53 3dgh s PRO 400 Ca 0.02 2.49 0.08 0.00 0.02 0.00 0.00 61.00 63.60 3dgh s PRO 400 Cb -0.15 -3.04 0.82 0.00 0.02 0.00 0.00 34.50 32.15 3dgh s PRO 400 CO -0.07 -0.55 1.97 1.15 -0.33 0.00 0.00 177.00 179.17 3dgh h THR 401 N 3.37 1.00 0.00 0.99 2.02 -1.95 -1.52 112.91 116.82 3dgh h THR 401 Ca -0.47 -0.23 0.00 0.00 0.77 0.00 0.00 66.41 66.48 3dgh h THR 401 Cb 1.22 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.91 3dgh h THR 401 CO 0.77 0.12 0.00 -0.33 0.37 0.00 0.00 175.52 176.45 3dgh h GLU 402 N 0.66 0.00 0.00 6.66 3.07 -1.99 -3.06 114.58 119.92 3dgh h GLU 402 Ca 0.29 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.15 3dgh h GLU 402 Cb 0.31 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 3dgh h GLU 402 CO -0.09 0.00 -0.27 0.74 -1.40 0.00 0.00 179.01 177.99 3dgh h PHE 403 N 0.00 0.00 0.27 4.33 0.05 -1.63 -3.40 116.94 116.56 3dgh h PHE 403 Ca 0.00 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.78 3dgh h PHE 403 Cb 0.28 0.00 0.00 0.00 2.00 0.00 0.00 35.95 38.23 3dgh h PHE 403 CO 0.00 0.00 -0.13 0.74 -0.18 0.00 0.00 178.31 178.74 3dgh h PHE 404 N 0.00 -0.33 -0.22 -0.55 0.05 -1.67 -0.97 116.94 113.25 3dgh h PHE 404 Ca 0.00 -0.01 -0.02 0.00 3.82 0.00 0.00 57.97 61.77 3dgh h PHE 404 Cb 0.81 0.11 -0.01 0.00 2.00 0.00 0.00 35.95 38.86 3dgh h PHE 404 CO 0.00 -0.01 0.08 0.82 -0.18 0.00 0.00 178.31 179.02 3dgh h ILE 405 N -0.68 1.18 0.00 -0.55 1.08 -1.81 -2.29 117.51 114.45 3dgh h ILE 405 Ca -0.04 -0.57 0.00 0.00 -0.39 0.00 0.00 64.86 63.86 3dgh h ILE 405 Cb 0.47 1.14 0.00 0.00 -3.07 0.00 0.00 36.82 35.37 3dgh h ILE 405 CO 0.06 0.18 0.00 -0.81 -0.69 0.00 0.00 178.15 176.89 3dgh n PRO 406 N -4.78 0.05 -3.58 2.37 -0.04 -1.25 -4.90 135.00 122.87 3dgh n PRO 406 Ca -0.03 0.18 -0.21 0.00 -0.04 0.00 0.00 63.50 63.39 3dgh n PRO 406 Cb 0.14 -1.50 0.07 0.00 -0.04 0.00 0.00 33.50 32.17 3dgh n PRO 406 CO 0.00 0.00 0.00 1.04 -0.04 0.00 0.00 175.50 176.50 3dgh n GLN 407 N -1.46 -6.63 -2.63 0.54 6.02 -0.52 -4.96 117.38 107.73 3dgh n GLN 407 Ca 0.05 0.78 -0.38 0.00 -0.01 0.00 0.00 57.00 57.44 3dgh n GLN 407 Cb 0.20 -5.72 -0.05 0.00 1.02 0.00 0.00 30.24 25.69 3dgh n GLN 407 CO 0.00 0.00 0.00 0.21 -1.01 0.00 0.00 177.06 176.26 3dgh s LYS 408 N -5.88 4.54 0.20 -1.09 2.20 -0.49 -4.97 119.74 114.26 3dgh s LYS 408 Ca 0.25 1.54 -0.32 0.00 -0.36 0.00 0.00 55.97 57.07 3dgh s LYS 408 Cb -0.11 -2.93 -0.12 0.00 -1.51 0.00 0.00 37.83 33.15 3dgh s LYS 408 CO 0.75 0.20 1.69 0.45 -0.36 0.00 0.00 175.35 178.08 3dgh n SER 409 N 0.75 3.78 -0.79 1.43 2.88 -1.26 -4.85 113.62 115.55 3dgh n SER 409 Ca 0.01 1.07 0.07 0.00 -1.33 0.00 0.00 58.87 58.69 3dgh n SER 409 Cb 0.48 -1.54 0.19 0.00 -0.75 0.00 0.00 64.21 62.59 3dgh n SER 409 CO 0.00 0.00 0.00 1.33 -1.23 0.00 0.00 175.04 175.14 3dgh n VAL 410 N 3.78 1.08 -0.03 2.46 0.24 -1.26 -4.71 118.33 119.89 3dgh n VAL 410 Ca 0.16 -1.04 0.18 0.00 -2.04 0.00 0.00 64.34 61.59 3dgh n VAL 410 Cb 0.33 0.46 0.63 0.00 -1.47 0.00 0.00 33.84 33.79 3dgh n VAL 410 CO 0.00 0.00 0.00 -0.09 -2.14 0.00 0.00 176.83 174.60 3dgh h ARG 411 N 2.44 0.13 -0.07 7.34 2.43 -1.92 -2.57 114.38 122.15 3dgh h ARG 411 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 3dgh h ARG 411 Cb 0.82 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 30.35 3dgh h ARG 411 CO 0.02 0.08 0.00 0.66 -1.51 0.00 0.00 179.97 179.22 3dgh n TYR 412 N -4.42 0.20 -2.70 2.20 4.02 -1.26 -4.89 117.16 110.31 3dgh n TYR 412 Ca 0.10 -0.81 -0.42 0.00 -0.01 0.00 0.00 57.90 56.75 3dgh n TYR 412 Cb 0.53 -0.14 -0.03 0.00 -0.02 0.00 0.00 39.34 39.68 3dgh n TYR 412 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 3dgh s TYR 414 N 4.48 0.04 0.04 0.00 5.04 -1.16 -1.60 117.35 124.20 3dgh s TYR 414 Ca 0.36 -0.01 -0.02 0.00 -2.44 0.00 0.00 57.07 54.96 3dgh s TYR 414 Cb -0.06 -0.03 -0.03 0.00 0.35 0.00 0.00 41.96 42.19 3dgh s TYR 414 CO 0.00 -0.00 -0.00 -0.48 -1.34 0.00 0.00 175.55 173.73 3dgh s LEU 415 N -0.01 2.28 0.02 6.97 2.34 -0.82 -1.36 118.68 128.08 3dgh s LEU 415 Ca 0.00 -0.79 -0.16 0.00 0.06 0.00 0.00 54.13 53.24 3dgh s LEU 415 Cb -0.00 0.27 0.03 0.00 -0.56 0.00 0.00 46.19 45.93 3dgh s LEU 415 CO -0.00 -0.52 0.36 -1.59 -1.06 0.00 0.00 176.35 173.54 3dgh s LYS 416 N -3.10 0.80 -0.14 1.48 -2.85 -0.33 -1.86 119.74 113.74 3dgh s LYS 416 Ca -0.01 -0.30 0.02 0.00 -1.00 0.00 0.00 55.97 54.68 3dgh s LYS 416 Cb 0.02 0.35 0.01 0.00 -2.06 0.00 0.00 37.83 36.15 3dgh s LYS 416 CO -0.07 -0.25 -0.21 0.00 0.10 0.00 0.00 175.35 174.92 3dgh s ALA 417 N -1.98 2.30 -0.29 0.59 0.00 0.71 -1.23 121.76 121.86 3dgh s ALA 417 Ca -0.09 -1.08 -0.10 0.00 0.00 0.00 0.00 51.96 50.69 3dgh s ALA 417 Cb -0.02 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.03 3dgh s ALA 417 CO 0.01 -0.01 0.17 0.08 0.00 0.00 0.00 175.76 176.00 3dgh s VAL 418 N 0.79 5.01 0.12 0.00 1.01 0.25 -0.68 120.40 126.89 3dgh s VAL 418 Ca -0.07 -0.04 0.02 0.00 0.00 0.00 0.00 61.98 61.89 3dgh s VAL 418 Cb -0.16 -3.43 -0.04 0.00 0.00 0.00 0.00 36.38 32.75 3dgh s VAL 418 CO -0.01 0.21 -0.04 0.00 0.00 0.00 0.00 175.10 175.26 3dgh s ALA 419 N 1.71 1.09 0.23 5.51 0.00 -0.39 0.55 121.76 130.46 3dgh s ALA 419 Ca 0.06 -1.44 -0.32 0.00 0.00 0.00 0.00 51.96 50.27 3dgh s ALA 419 Cb -0.16 0.32 -0.13 0.00 0.00 0.00 0.00 23.12 23.16 3dgh s ALA 419 CO 0.09 -0.28 1.60 -1.91 0.00 0.00 0.00 175.76 175.26 3dgh n GLU 420 N -0.11 2.49 0.02 0.00 2.13 0.44 -0.78 120.64 124.83 3dgh n GLU 420 Ca -0.10 0.89 -0.19 0.00 0.66 0.00 0.00 57.16 58.42 3dgh n GLU 420 Cb 0.62 -2.67 -0.11 0.00 0.27 0.00 0.00 31.44 29.54 3dgh n GLU 420 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 3dgh h ARG 421 N 5.52 0.47 0.00 5.31 2.43 -1.44 -3.38 114.38 123.29 3dgh h ARG 421 Ca -0.45 -0.54 0.00 0.00 -0.81 0.00 0.00 59.98 58.18 3dgh h ARG 421 Cb 1.23 0.16 0.00 0.00 -0.42 0.00 0.00 29.97 30.95 3dgh h ARG 421 CO 0.86 1.19 0.00 0.72 -1.51 0.00 0.00 179.97 181.22 3dgh n HIS 422 N -4.10 -1.02 -0.58 2.20 8.25 -1.26 -4.81 115.22 113.90 3dgh n HIS 422 Ca -0.11 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.35 3dgh n HIS 422 Cb 0.76 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.87 3dgh n HIS 422 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3dgh n GLY 423 N 5.00 3.43 0.01 -1.41 0.00 -1.26 -1.98 105.19 108.98 3dgh n GLY 423 Ca 0.00 -0.12 0.15 0.00 0.00 0.00 0.00 46.02 46.04 3dgh n GLY 423 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 3dgh n ASP 424 N 4.12 0.04 -3.59 1.61 8.00 -1.26 -4.93 116.55 120.53 3dgh n ASP 424 Ca 0.00 -0.12 -0.21 0.00 0.71 0.00 0.00 54.79 55.18 3dgh n ASP 424 Cb 0.00 -0.29 0.06 0.00 -0.02 0.00 0.00 41.12 40.88 3dgh n ASP 424 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 3dgh n GLN 425 N -1.28 -6.08 -1.73 -1.24 6.02 -0.84 -4.49 117.38 107.74 3dgh n GLN 425 Ca 0.14 0.74 -0.42 0.00 -0.01 0.00 0.00 57.00 57.44 3dgh n GLN 425 Cb 0.25 -5.59 -0.02 0.00 1.02 0.00 0.00 30.24 25.91 3dgh n GLN 425 CO 0.00 0.00 0.00 -2.13 -1.01 0.00 0.00 177.06 173.92 3dgh n ARG 426 N -4.34 2.58 -2.40 -1.09 3.00 -1.26 -0.80 116.66 112.36 3dgh n ARG 426 Ca -0.23 0.92 -0.42 0.00 -0.00 0.00 0.00 57.85 58.12 3dgh n ARG 426 Cb 0.65 -2.69 -0.03 0.00 0.00 0.00 0.00 32.46 30.39 3dgh n ARG 426 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.63 177.71 3dgh s VAL 427 N 0.14 3.89 -0.21 5.15 1.01 -0.39 -0.42 120.40 129.57 3dgh s VAL 427 Ca 0.66 1.40 0.15 0.00 0.00 0.00 0.00 61.98 64.19 3dgh s VAL 427 Cb -0.53 -3.90 -0.23 0.00 0.00 0.00 0.00 36.38 31.73 3dgh s VAL 427 CO 0.47 0.13 0.01 -1.22 0.00 0.00 0.00 175.10 174.49 3dgh n TYR 428 N 3.64 0.00 -3.54 5.22 0.53 0.19 -4.92 117.16 118.29 3dgh n TYR 428 Ca 0.08 0.00 -0.18 0.00 -1.02 0.00 0.00 57.90 56.79 3dgh n TYR 428 Cb 0.46 -0.98 -0.06 0.00 -1.03 0.00 0.00 39.34 37.73 3dgh n TYR 428 CO 0.00 0.00 0.00 0.20 -1.02 0.00 0.00 176.86 176.04 3dgh s GLY 429 N -5.63 -0.55 -0.02 2.72 0.00 -0.55 -0.87 107.32 102.42 3dgh s GLY 429 Ca -0.14 1.29 0.02 0.00 0.00 0.00 0.00 44.72 45.89 3dgh s GLY 429 CO 0.77 0.94 -0.07 1.08 0.00 0.00 0.00 173.10 175.82 3dgh s LEU 430 N -1.13 1.82 -0.02 0.66 1.43 -0.21 -0.58 118.68 120.65 3dgh s LEU 430 Ca -0.11 -0.15 -0.00 0.00 -1.03 0.00 0.00 54.13 52.84 3dgh s LEU 430 Cb -0.01 -0.45 0.03 0.00 0.03 0.00 0.00 46.19 45.79 3dgh s LEU 430 CO 0.09 0.06 0.03 -1.00 0.23 0.00 0.00 176.35 175.76 3dgh s HIS 431 N 0.14 0.02 -0.09 0.29 3.76 -0.37 -1.36 115.29 117.69 3dgh s HIS 431 Ca -0.02 0.12 -0.04 0.00 -0.15 0.00 0.00 55.06 54.97 3dgh s HIS 431 Cb -0.07 -0.21 0.04 0.00 1.11 0.00 0.00 32.58 33.46 3dgh s HIS 431 CO 0.00 -0.08 0.19 -0.47 -0.85 0.00 0.00 174.74 173.53 3dgh s TYR 432 N 0.94 -0.24 -0.15 1.40 5.04 -0.44 -1.19 117.35 122.71 3dgh s TYR 432 Ca -0.08 0.63 0.00 0.00 -2.44 0.00 0.00 57.07 55.19 3dgh s TYR 432 Cb -0.11 -0.04 -0.01 0.00 0.35 0.00 0.00 41.96 42.15 3dgh s TYR 432 CO -0.03 -0.21 -0.15 0.42 -1.34 0.00 0.00 175.55 174.25 3dgh s ILE 433 N 1.35 2.78 -4.78 3.14 1.01 -0.47 -0.96 121.20 123.27 3dgh s ILE 433 Ca -0.08 -0.74 0.00 0.00 0.00 0.00 0.00 60.65 59.83 3dgh s ILE 433 Cb -0.11 -2.17 0.00 0.00 0.01 0.00 0.00 42.46 40.19 3dgh s ILE 433 CO -0.07 0.52 0.00 0.61 0.00 0.00 0.00 174.94 175.99 3dgh n GLY 434 N 3.92 -1.47 3.76 6.18 0.00 0.06 -3.00 105.19 114.64 3dgh n GLY 434 Ca -0.19 -1.22 -0.38 0.00 0.00 0.00 0.00 46.02 44.24 3dgh n GLY 434 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 3dgh s PRO 435 N -1.92 3.59 -1.47 1.61 0.04 -1.26 -2.78 135.00 132.81 3dgh s PRO 435 Ca 0.00 1.92 -0.02 0.00 0.04 0.00 0.00 61.00 62.94 3dgh s PRO 435 Cb 0.00 -2.38 0.01 0.00 0.04 0.00 0.00 34.50 32.18 3dgh s PRO 435 CO 0.00 -0.73 0.33 1.33 0.04 0.00 0.00 177.00 177.97 3dgh n VAL 436 N -0.61 -2.35 -0.22 -0.36 0.24 -1.26 -4.85 118.33 108.92 3dgh n VAL 436 Ca 0.08 -0.46 -0.01 0.00 -2.04 0.00 0.00 64.34 61.91 3dgh n VAL 436 Cb 0.47 -2.13 0.21 0.00 -1.47 0.00 0.00 33.84 30.92 3dgh n VAL 436 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 3dgh h ALA 437 N 0.83 1.37 -0.23 2.33 0.00 -1.87 -1.67 119.26 120.03 3dgh h ALA 437 Ca -0.64 -0.09 -0.14 0.00 0.00 0.00 0.00 54.91 54.04 3dgh h ALA 437 Cb 1.38 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.86 3dgh h ALA 437 CO 0.66 0.54 -0.45 0.78 0.00 0.00 0.00 179.25 180.78 3dgh h GLY 438 N 1.06 0.62 1.03 0.00 0.00 -1.91 -1.05 103.07 102.82 3dgh h GLY 438 Ca 0.27 -0.65 -0.05 0.00 0.00 0.00 0.00 47.33 46.90 3dgh h GLY 438 CO -0.05 0.59 0.25 0.83 0.00 0.00 0.00 176.54 178.16 3dgh h GLU 439 N 0.46 1.06 0.05 4.80 4.39 -1.76 -2.18 114.58 121.40 3dgh h GLU 439 Ca 0.03 -0.21 -0.00 0.00 0.34 0.00 0.00 59.36 59.52 3dgh h GLU 439 Cb 0.96 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 3dgh h GLU 439 CO 0.09 0.89 -0.03 0.28 -1.16 0.00 0.00 179.01 179.08 3dgh h VAL 440 N 1.00 1.09 -0.02 3.13 2.07 -1.03 -3.32 116.25 119.17 3dgh h VAL 440 Ca 0.23 -0.46 -0.14 0.00 0.82 0.00 0.00 66.70 67.15 3dgh h VAL 440 Cb 0.25 1.39 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 3dgh h VAL 440 CO -0.01 0.12 -0.66 0.40 0.02 0.00 0.00 177.57 177.43 3dgh h ILE 441 N -0.27 1.46 -0.38 4.57 1.08 -1.15 -3.37 117.51 119.45 3dgh h ILE 441 Ca -0.01 -2.22 0.08 0.00 -0.39 0.00 0.00 64.86 62.31 3dgh h ILE 441 Cb 0.24 2.19 -0.09 0.00 -3.07 0.00 0.00 36.82 36.09 3dgh h ILE 441 CO 0.01 0.64 -0.34 -0.61 -0.69 0.00 0.00 178.15 177.16 3dgh h GLN 442 N 0.05 -0.27 -0.22 2.37 5.75 -1.49 -0.46 115.11 120.84 3dgh h GLN 442 Ca -0.01 0.02 -0.06 0.00 -0.15 0.00 0.00 58.65 58.45 3dgh h GLN 442 Cb 1.18 0.06 -0.01 0.00 1.07 0.00 0.00 27.48 29.78 3dgh h GLN 442 CO 0.09 -0.18 -0.11 0.78 -2.65 0.00 0.00 178.83 176.77 3dgh h GLY 443 N -0.28 0.38 2.00 2.39 0.00 -1.79 -1.64 103.07 104.13 3dgh h GLY 443 Ca 0.16 -0.24 -0.09 0.00 0.00 0.00 0.00 47.33 47.16 3dgh h GLY 443 CO -0.53 0.22 -0.45 0.74 0.00 0.00 0.00 176.54 176.52 3dgh h PHE 444 N 0.33 0.00 -0.81 5.60 0.04 -1.34 -1.00 116.94 119.77 3dgh h PHE 444 Ca 0.07 0.00 -0.04 0.00 2.80 0.00 0.00 57.97 60.80 3dgh h PHE 444 Cb 0.40 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.51 3dgh h PHE 444 CO 0.01 0.45 0.36 0.00 -0.60 0.00 0.00 178.31 178.53 3dgh h ALA 445 N 1.55 1.04 -0.29 2.45 0.00 -0.17 0.60 119.26 124.44 3dgh h ALA 445 Ca -0.00 -0.18 -0.09 0.00 0.00 0.00 0.00 54.91 54.64 3dgh h ALA 445 Cb 0.81 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 3dgh h ALA 445 CO 0.06 0.64 -0.21 0.00 0.00 0.00 0.00 179.25 179.74 3dgh h ALA 446 N 1.19 1.10 -0.68 0.00 0.00 -1.16 -2.12 119.26 117.58 3dgh h ALA 446 Ca 0.27 -0.33 -0.06 0.00 0.00 0.00 0.00 54.91 54.79 3dgh h ALA 446 Cb 0.16 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3dgh h ALA 446 CO -0.03 0.56 0.18 0.00 0.00 0.00 0.00 179.25 179.96 3dgh h ALA 447 N 1.29 0.90 -0.66 0.00 0.00 -0.63 -1.97 119.26 118.19 3dgh h ALA 447 Ca 0.08 -0.23 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 3dgh h ALA 447 Cb 0.63 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 3dgh h ALA 447 CO 0.04 0.60 0.24 1.25 0.00 0.00 0.00 179.25 181.39 3dgh h LEU 448 N 1.01 0.93 -2.03 0.00 5.85 -0.72 -1.04 115.31 119.31 3dgh h LEU 448 Ca 0.22 -0.19 -0.02 0.00 0.84 0.00 0.00 57.88 58.73 3dgh h LEU 448 Cb 0.35 -0.24 -0.00 0.00 0.37 0.00 0.00 40.66 41.13 3dgh h LEU 448 CO -0.00 0.87 -0.09 0.11 -0.34 0.00 0.00 178.44 178.98 3dgh h LYS 449 N 0.94 0.00 -0.33 1.25 1.79 -1.11 -1.44 116.57 117.68 3dgh h LYS 449 Ca 0.22 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.69 3dgh h LYS 449 Cb 0.24 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.89 3dgh h LYS 449 CO -0.01 0.09 0.00 0.45 -1.08 0.00 0.00 179.45 178.90 3dgh n SER 450 N -3.87 2.04 0.00 0.86 2.88 -0.65 -4.93 113.62 109.94 3dgh n SER 450 Ca -0.02 -1.91 0.00 0.00 -1.33 0.00 0.00 58.87 55.61 3dgh n SER 450 Cb 0.19 -0.22 0.00 0.00 -0.75 0.00 0.00 64.21 63.43 3dgh n SER 450 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3dgh n GLY 451 N 1.15 0.72 3.61 0.46 0.00 -0.54 -4.99 105.19 105.59 3dgh n GLY 451 Ca 0.14 -0.65 -0.59 0.00 0.00 0.00 0.00 46.02 44.92 3dgh n GLY 451 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 3dgh n LEU 452 N 0.00 1.03 -4.83 0.99 7.94 -0.49 -4.82 117.00 116.83 3dgh n LEU 452 Ca 0.00 1.14 -0.22 0.00 -1.11 0.00 0.00 56.01 55.83 3dgh n LEU 452 Cb 0.09 -1.01 -0.04 0.00 0.53 0.00 0.00 43.42 42.99 3dgh n LEU 452 CO 0.00 -1.23 -0.12 0.42 -1.11 0.00 0.00 177.39 175.35 3dgh s THR 453 N 1.33 3.69 0.18 1.96 -4.23 -1.26 -1.27 115.64 116.04 3dgh s THR 453 Ca 0.94 -1.42 -0.13 0.00 -1.18 0.00 0.00 61.69 59.89 3dgh s THR 453 Cb -1.21 -3.20 0.09 0.00 1.34 0.00 0.00 72.50 69.51 3dgh s THR 453 CO 0.61 -0.22 1.75 0.40 -0.54 0.00 0.00 174.62 176.63 3dgh h ILE 454 N 1.35 0.84 -0.49 2.99 1.08 -1.19 -0.50 117.51 121.59 3dgh h ILE 454 Ca -0.45 -0.13 0.04 0.00 -0.39 0.00 0.00 64.86 63.92 3dgh h ILE 454 Cb 1.25 0.44 -0.04 0.00 -3.07 0.00 0.00 36.82 35.40 3dgh h ILE 454 CO 0.59 0.07 0.26 0.78 -0.69 0.00 0.00 178.15 179.16 3dgh h ASN 455 N 0.37 0.39 -0.43 1.72 -0.26 -1.86 0.37 115.58 115.88 3dgh h ASN 455 Ca 0.24 0.02 -0.01 0.00 -0.56 0.00 0.00 56.30 55.98 3dgh h ASN 455 Cb 0.24 -0.06 -0.02 0.00 -1.06 0.00 0.00 38.32 37.43 3dgh h ASN 455 CO -0.24 0.27 0.21 0.74 -1.06 0.00 0.00 177.43 177.36 3dgh h THR 456 N 0.51 1.18 0.56 2.81 2.02 -1.89 -2.25 112.91 115.84 3dgh h THR 456 Ca 0.21 -0.49 -0.02 0.00 0.77 0.00 0.00 66.41 66.87 3dgh h THR 456 Cb 0.09 0.71 -0.00 0.00 -1.74 0.00 0.00 68.15 67.21 3dgh h THR 456 CO -0.13 0.19 -0.31 0.25 0.37 0.00 0.00 175.52 175.88 3dgh h LEU 457 N 0.55 -0.77 -1.56 2.58 5.85 -0.54 -1.67 115.31 119.75 3dgh h LEU 457 Ca 0.15 0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.87 3dgh h LEU 457 Cb 0.11 0.22 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 3dgh h LEU 457 CO -0.02 -0.51 -0.19 -0.29 -0.34 0.00 0.00 178.44 177.10 3dgh h ILE 458 N -0.82 0.63 -0.11 4.05 2.10 -0.94 -2.08 117.51 120.35 3dgh h ILE 458 Ca -0.07 -0.83 0.00 0.00 1.08 0.00 0.00 64.86 65.04 3dgh h ILE 458 Cb 0.65 1.54 0.00 0.00 -1.09 0.00 0.00 36.82 37.92 3dgh h ILE 458 CO 0.09 0.18 0.00 0.59 -1.08 0.00 0.00 178.15 177.93 3dgh n ASN 459 N -3.58 2.43 -4.70 2.19 3.02 -0.85 -4.75 115.26 109.01 3dgh n ASN 459 Ca -0.01 -1.81 -0.42 0.00 -0.03 0.00 0.00 54.58 52.31 3dgh n ASN 459 Cb 0.33 -0.06 -0.03 0.00 -0.61 0.00 0.00 39.78 39.41 3dgh n ASN 459 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 3dgh s THR 460 N -1.88 3.93 0.15 3.41 2.01 -0.64 -4.99 115.64 117.64 3dgh s THR 460 Ca 0.34 1.36 -0.30 0.00 0.31 0.00 0.00 61.69 63.39 3dgh s THR 460 Cb 0.20 -3.87 -0.08 0.00 0.01 0.00 0.00 72.50 68.77 3dgh s THR 460 CO 0.31 0.07 1.23 -0.69 -0.69 0.00 0.00 174.62 174.84 3dgh s VAL 461 N 1.51 3.61 0.58 3.82 1.01 -1.26 -4.83 120.40 124.85 3dgh s VAL 461 Ca 0.60 1.28 -0.17 0.00 0.00 0.00 0.00 61.98 63.68 3dgh s VAL 461 Cb -0.30 -3.82 -0.04 0.00 0.00 0.00 0.00 36.38 32.22 3dgh s VAL 461 CO 0.27 0.17 1.10 -0.83 0.00 0.00 0.00 175.10 175.81 3dgh s GLY 462 N 0.46 2.38 -0.20 4.51 0.00 -1.26 -5.03 107.32 108.18 3dgh s GLY 462 Ca 0.56 0.63 -0.19 0.00 0.00 0.00 0.00 44.72 45.72 3dgh s GLY 462 CO 0.34 0.98 0.53 -0.42 0.00 0.00 0.00 173.10 174.53 3dgh s ILE 463 N -2.10 5.10 -0.04 0.90 1.01 -1.26 -5.07 121.20 119.75 3dgh s ILE 463 Ca 0.69 0.98 0.06 0.00 0.00 0.00 0.00 60.65 62.38 3dgh s ILE 463 Cb -0.20 -3.85 -0.02 0.00 0.01 0.00 0.00 42.46 38.39 3dgh s ILE 463 CO 0.32 0.18 -0.22 -2.28 0.00 0.00 0.00 174.94 172.94 3dgh s HIS 464 N 1.62 2.48 -0.22 3.97 2.46 -1.26 -3.12 115.29 121.22 3dgh s HIS 464 Ca 0.25 -0.36 -0.17 0.00 0.47 0.00 0.00 55.06 55.24 3dgh s HIS 464 Cb -0.15 -1.56 -0.03 0.00 -0.13 0.00 0.00 32.58 30.70 3dgh s HIS 464 CO 0.10 0.02 0.46 -1.25 -2.47 0.00 0.00 174.74 171.60 3dgh s PRO 465 N -0.60 4.14 0.23 2.88 0.05 -1.26 -5.19 135.00 135.25 3dgh s PRO 465 Ca 0.09 0.27 0.01 0.00 0.05 0.00 0.00 61.00 61.43 3dgh s PRO 465 Cb -0.11 -3.58 -0.04 0.00 0.05 0.00 0.00 34.50 30.83 3dgh s PRO 465 CO -0.00 -0.16 0.17 0.95 0.05 0.00 0.00 177.00 178.01 3dgh s THR 466 N 1.68 0.00 -0.09 1.26 -4.23 -1.18 -5.01 115.64 108.08 3dgh s THR 466 Ca 0.21 -1.99 0.15 0.00 -1.18 0.00 0.00 61.69 58.87 3dgh s THR 466 Cb -0.15 -2.50 -0.19 0.00 1.34 0.00 0.00 72.50 71.00 3dgh s THR 466 CO 0.09 0.00 0.72 0.35 -0.54 0.00 0.00 174.62 175.23 3dgh n THR 467 N -0.36 1.39 0.26 3.99 -2.24 -1.26 -4.21 114.28 111.84 3dgh n THR 467 Ca 0.03 -0.75 0.09 0.00 -2.27 0.00 0.00 64.05 61.16 3dgh n THR 467 Cb 0.65 -0.87 0.67 0.00 -2.10 0.00 0.00 70.33 68.68 3dgh n THR 467 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3dgh h ALA 468 N 1.21 1.68 0.00 6.98 0.00 -1.96 -1.73 119.26 125.45 3dgh h ALA 468 Ca -0.23 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.60 3dgh h ALA 468 Cb 1.81 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.59 3dgh h ALA 468 CO 0.06 0.10 0.00 1.05 0.00 0.00 0.00 179.25 180.46 3dgh h GLU 469 N 0.00 0.00 0.00 0.00 4.11 -1.78 -2.16 114.58 114.75 3dgh h GLU 469 Ca -0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.36 59.40 3dgh h GLU 469 Cb 0.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.41 3dgh h GLU 469 CO 0.01 0.00 -0.12 0.93 0.07 0.00 0.00 179.01 179.90 3dgh h GLU 470 N 0.00 0.00 0.00 1.06 4.39 -1.56 -1.25 114.58 117.22 3dgh h GLU 470 Ca 0.00 0.00 -0.03 0.00 0.34 0.00 0.00 59.36 59.67 3dgh h GLU 470 Cb 0.05 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.70 3dgh h GLU 470 CO 0.00 0.12 -0.14 0.74 -1.16 0.00 0.00 179.01 178.57 3dgh h PHE 471 N 0.00 0.00 -0.01 4.33 0.04 -1.59 -2.66 116.94 117.05 3dgh h PHE 471 Ca -0.00 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.77 3dgh h PHE 471 Cb 0.24 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.39 3dgh h PHE 471 CO 0.00 0.14 -0.10 0.25 -0.60 0.00 0.00 178.31 178.00 3dgh n THR 472 N -3.91 0.00 -2.26 -1.55 -2.24 -0.48 -4.10 114.28 99.74 3dgh n THR 472 Ca -0.02 -0.17 -0.04 0.00 -2.27 0.00 0.00 64.05 61.56 3dgh n THR 472 Cb 0.23 0.31 0.07 0.00 -2.10 0.00 0.00 70.33 68.84 3dgh n THR 472 CO 0.00 0.00 0.00 -2.11 -0.57 0.00 0.00 175.07 172.39 3dgh n ARG 473 N -0.34 1.76 -2.53 -0.78 1.85 -1.00 -4.36 116.66 111.26 3dgh n ARG 473 Ca 0.17 -3.27 -0.41 0.00 -1.00 0.00 0.00 57.85 53.34 3dgh n ARG 473 Cb 0.32 -1.39 -0.02 0.00 -1.05 0.00 0.00 32.46 30.32 3dgh n ARG 473 CO 0.00 0.00 0.00 -0.51 -0.01 0.00 0.00 177.63 177.11 3dgh s LEU 474 N -2.70 3.61 0.03 2.89 1.02 -1.23 -4.81 118.68 117.48 3dgh s LEU 474 Ca 0.37 -1.83 0.22 0.00 0.02 0.00 0.00 54.13 52.91 3dgh s LEU 474 Cb 0.37 -2.57 -0.18 0.00 0.02 0.00 0.00 46.19 43.83 3dgh s LEU 474 CO -0.06 -1.47 0.75 0.00 0.02 0.00 0.00 176.35 175.59 3dgh n ALA 475 N 9.08 3.14 -2.73 4.21 0.00 -1.26 -4.80 120.51 128.15 3dgh n ALA 475 Ca 0.40 -0.46 -0.35 0.00 0.00 0.00 0.00 53.44 53.04 3dgh n ALA 475 Cb 0.49 -0.86 -0.08 0.00 0.00 0.00 0.00 19.45 18.99 3dgh n ALA 475 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3dgh s ILE 476 N -3.36 5.35 0.19 0.00 -1.09 -1.26 -4.43 121.20 116.60 3dgh s ILE 476 Ca -0.02 0.17 -0.00 0.00 -2.23 0.00 0.00 60.65 58.56 3dgh s ILE 476 Cb 0.14 -3.44 -0.04 0.00 -1.58 0.00 0.00 42.46 37.53 3dgh s ILE 476 CO 0.86 0.43 0.37 0.42 -1.23 0.00 0.00 174.94 175.79 3dgh s THR 477 N 0.46 5.22 0.21 2.92 -4.23 0.37 -1.36 115.64 119.23 3dgh s THR 477 Ca 0.07 -0.39 -0.08 0.00 -1.18 0.00 0.00 61.69 60.11 3dgh s THR 477 Cb -0.11 -3.73 0.16 0.00 1.34 0.00 0.00 72.50 70.15 3dgh s THR 477 CO -0.01 -0.15 1.79 0.11 -0.54 0.00 0.00 174.62 175.82 3dgh h LYS 478 N 2.08 1.16 -0.01 3.99 1.57 -1.47 -1.17 116.57 122.72 3dgh h LYS 478 Ca -0.48 -0.20 -0.02 0.00 -1.87 0.00 0.00 60.65 58.09 3dgh h LYS 478 Cb 1.19 -0.20 0.00 0.00 0.08 0.00 0.00 32.23 33.30 3dgh h LYS 478 CO 0.68 0.93 -0.08 -0.09 -0.57 0.00 0.00 179.45 180.32 3dgh h ARG 479 N 1.14 0.07 0.00 3.15 2.43 -1.96 -3.41 114.38 115.80 3dgh h ARG 479 Ca 0.27 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.38 3dgh h ARG 479 Cb 0.18 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.74 3dgh h ARG 479 CO -0.03 0.76 0.00 0.43 -1.51 0.00 0.00 179.97 179.63 3dgh n SER 480 N -4.67 0.99 0.00 -3.80 7.64 -1.24 -5.10 113.62 107.43 3dgh n SER 480 Ca -0.09 -1.18 0.00 0.00 1.01 0.00 0.00 58.87 58.60 3dgh n SER 480 Cb 0.39 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.59 3dgh n SER 480 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3dgh n GLY 481 N -0.09 3.61 0.15 0.23 0.00 -0.44 -1.89 105.19 106.76 3dgh n GLY 481 Ca 0.00 0.18 0.04 0.00 0.00 0.00 0.00 46.02 46.24 3dgh n GLY 481 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3dgh h LEU 482 N 0.00 0.00 0.00 0.99 3.38 -1.87 0.11 115.31 117.92 3dgh h LEU 482 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 3dgh h LEU 482 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 3dgh h LEU 482 CO 0.00 0.44 0.00 0.47 0.09 0.00 0.00 178.44 179.44