#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1diq s VAL 8 N 0.00 4.86 0.24 0.00 0.11 -1.26 -5.06 120.40 119.29 1diq s VAL 8 Ca 0.00 1.52 0.12 0.00 -2.93 0.00 0.00 61.98 60.68 1diq s VAL 8 Cb 0.00 -4.09 -0.05 0.00 -1.53 0.00 0.00 36.38 30.71 1diq s VAL 8 CO 0.00 -0.06 -0.21 -0.76 -3.33 0.00 0.00 175.10 170.74 1diq s LEU 9 N 2.79 2.54 0.51 2.54 2.01 -1.26 -4.57 118.68 123.24 1diq s LEU 9 Ca 0.34 -0.95 -0.21 0.00 0.01 0.00 0.00 54.13 53.32 1diq s LEU 9 Cb -0.15 -1.15 -0.06 0.00 0.01 0.00 0.00 46.19 44.84 1diq s LEU 9 CO 0.07 0.07 1.18 -2.84 1.01 0.00 0.00 176.35 175.85 1diq s PRO 10 N -3.15 3.45 -0.02 1.29 0.02 -1.19 -4.41 135.00 130.98 1diq s PRO 10 Ca 0.26 1.78 -0.31 0.00 0.02 0.00 0.00 61.00 62.76 1diq s PRO 10 Cb -0.06 -2.20 -0.09 0.00 0.02 0.00 0.00 34.50 32.17 1diq s PRO 10 CO 0.13 -0.81 1.99 1.17 -0.33 0.00 0.00 177.00 179.15 1diq n LYS 11 N -0.96 2.60 0.00 5.54 4.81 -1.26 -1.79 118.16 127.10 1diq n LYS 11 Ca 0.10 0.93 0.00 0.00 -0.87 0.00 0.00 58.31 58.47 1diq n LYS 11 Cb 0.49 -2.95 0.00 0.00 0.02 0.00 0.00 35.03 32.59 1diq n LYS 11 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1diq n GLY 12 N 4.69 1.83 3.75 3.14 0.00 -1.26 -5.00 105.19 112.34 1diq n GLY 12 Ca 0.22 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.88 1diq n GLY 12 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1diq s VAL 13 N -2.51 5.39 0.50 1.61 1.01 -0.74 -5.10 120.40 120.57 1diq s VAL 13 Ca 0.00 0.29 -0.11 0.00 0.00 0.00 0.00 61.98 62.16 1diq s VAL 13 Cb 0.00 -3.50 -0.06 0.00 0.00 0.00 0.00 36.38 32.82 1diq s VAL 13 CO 0.00 0.46 0.89 0.42 0.00 0.00 0.00 175.10 176.87 1diq s THR 14 N 0.16 4.73 0.52 3.92 -4.23 -1.26 -4.47 115.64 115.00 1diq s THR 14 Ca 0.11 0.75 0.25 0.00 -1.18 0.00 0.00 61.69 61.62 1diq s THR 14 Cb -0.12 -3.79 0.40 0.00 1.34 0.00 0.00 72.50 70.33 1diq s THR 14 CO 0.00 -0.80 1.97 -0.61 -0.54 0.00 0.00 174.62 174.65 1diq h GLN 15 N 0.55 0.06 -0.03 3.99 5.75 -1.98 -2.07 115.11 121.37 1diq h GLN 15 Ca -0.46 -0.00 -0.03 0.00 -0.15 0.00 0.00 58.65 58.01 1diq h GLN 15 Cb 1.19 -0.01 0.00 0.00 1.07 0.00 0.00 27.48 29.73 1diq h GLN 15 CO 0.62 0.04 -0.09 0.78 -2.65 0.00 0.00 178.83 177.53 1diq h GLY 16 N 0.06 0.12 1.62 2.39 0.00 -1.99 -2.36 103.07 102.90 1diq h GLY 16 Ca 0.29 -0.15 -0.07 0.00 0.00 0.00 0.00 47.33 47.40 1diq h GLY 16 CO -0.02 0.14 -0.14 0.83 0.00 0.00 0.00 176.54 177.35 1diq h GLU 17 N -0.48 0.46 -0.31 4.80 4.39 -1.87 -2.52 114.58 119.05 1diq h GLU 17 Ca -0.00 -0.13 -0.13 0.00 0.34 0.00 0.00 59.36 59.44 1diq h GLU 17 Cb 0.72 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.31 1diq h GLU 17 CO 0.02 0.59 -0.33 0.35 -1.16 0.00 0.00 179.01 178.48 1diq h PHE 18 N 0.42 0.81 -0.25 4.33 3.57 -1.43 -2.49 116.94 121.90 1diq h PHE 18 Ca 0.08 -0.21 -0.11 0.00 3.53 0.00 0.00 57.97 61.25 1diq h PHE 18 Cb 0.49 -0.18 -0.01 0.00 2.79 0.00 0.00 35.95 39.04 1diq h PHE 18 CO 0.01 0.93 -0.32 -0.91 -2.23 0.00 0.00 178.31 175.79 1diq h ASN 19 N 0.58 0.55 -0.07 0.41 2.35 -1.01 -1.10 115.58 117.28 1diq h ASN 19 Ca 0.06 -0.21 -0.14 0.00 -0.55 0.00 0.00 56.30 55.46 1diq h ASN 19 Cb 0.85 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 39.06 1diq h ASN 19 CO 0.07 0.84 -0.43 0.11 -1.65 0.00 0.00 177.43 176.37 1diq h LYS 20 N 0.45 0.61 -0.22 0.81 1.57 -1.37 -1.61 116.57 116.83 1diq h LYS 20 Ca 0.05 -0.33 -0.03 0.00 -1.87 0.00 0.00 60.65 58.48 1diq h LYS 20 Cb 0.78 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.10 1diq h LYS 20 CO 0.06 0.92 0.02 0.00 -0.57 0.00 0.00 179.45 179.89 1diq h ALA 21 N 1.03 0.29 -0.17 3.86 0.00 -1.17 -1.49 119.26 121.61 1diq h ALA 21 Ca 0.04 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 1diq h ALA 21 Cb 0.95 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.65 1diq h ALA 21 CO 0.09 -0.01 -0.16 0.28 0.00 0.00 0.00 179.25 179.45 1diq h VAL 22 N 0.15 1.20 -0.45 0.00 2.07 -1.13 0.40 116.25 118.49 1diq h VAL 22 Ca 0.06 -0.90 -0.14 0.00 0.82 0.00 0.00 66.70 66.54 1diq h VAL 22 Cb 0.36 1.25 -0.01 0.00 -1.52 0.00 0.00 31.29 31.37 1diq h VAL 22 CO 0.01 0.28 -0.27 -0.61 0.02 0.00 0.00 177.57 177.00 1diq h GLN 23 N 0.27 0.98 -0.07 1.57 5.75 -1.01 -1.69 115.11 120.91 1diq h GLN 23 Ca 0.05 -0.45 -0.17 0.00 -0.15 0.00 0.00 58.65 57.93 1diq h GLN 23 Cb 0.44 -0.02 -0.01 0.00 1.07 0.00 0.00 27.48 28.96 1diq h GLN 23 CO 0.03 1.12 -0.70 0.87 -2.65 0.00 0.00 178.83 177.50 1diq h LYS 24 N 0.83 0.31 -0.12 1.69 1.57 -0.78 -2.44 116.57 117.64 1diq h LYS 24 Ca 0.09 -0.25 -0.00 0.00 -1.87 0.00 0.00 60.65 58.62 1diq h LYS 24 Cb 0.86 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.21 1diq h LYS 24 CO 0.08 0.89 0.06 0.74 -0.57 0.00 0.00 179.45 180.65 1diq h PHE 25 N 0.22 0.18 -0.49 -1.35 0.04 -0.74 -2.32 116.94 112.47 1diq h PHE 25 Ca -0.02 -0.01 0.02 0.00 2.80 0.00 0.00 57.97 60.76 1diq h PHE 25 Cb 1.26 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 39.32 1diq h PHE 25 CO 0.03 0.23 0.29 0.00 -0.60 0.00 0.00 178.31 178.27 1diq h ARG 26 N 0.07 0.57 -0.27 1.51 3.08 -1.26 0.10 114.38 118.18 1diq h ARG 26 Ca 0.04 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 60.02 1diq h ARG 26 Cb 0.12 -0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 1diq h ARG 26 CO -0.01 0.38 -0.00 0.00 -1.07 0.00 0.00 179.97 179.27 1diq h ALA 27 N 1.22 1.49 0.09 0.04 0.00 -1.34 0.22 119.26 120.98 1diq h ALA 27 Ca 0.20 -0.17 -0.21 0.00 0.00 0.00 0.00 54.91 54.73 1diq h ALA 27 Cb 0.02 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.68 1diq h ALA 27 CO -0.09 0.37 -1.03 1.25 0.00 0.00 0.00 179.25 179.75 1diq h LEU 28 N 0.40 0.29 0.00 0.00 7.12 -1.10 -3.41 115.31 118.61 1diq h LEU 28 Ca 0.09 -0.85 -0.25 0.00 0.13 0.00 0.00 57.88 57.00 1diq h LEU 28 Cb 0.28 -0.10 -0.05 0.00 -0.53 0.00 0.00 40.66 40.26 1diq h LEU 28 CO 0.01 1.45 -2.21 0.18 -0.13 0.00 0.00 178.44 177.74 1diq n LEU 29 N -4.14 0.06 0.00 2.25 4.77 0.33 -5.07 117.00 115.19 1diq n LEU 29 Ca -0.21 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.80 1diq n LEU 29 Cb 0.79 0.32 0.00 0.00 -2.33 0.00 0.00 43.42 42.20 1diq n LEU 29 CO 0.39 0.33 0.00 0.61 -1.33 0.00 0.00 177.39 177.39 1diq n GLY 30 N 1.58 2.18 0.11 -0.72 0.00 0.77 -4.66 105.19 104.46 1diq n GLY 30 Ca -0.23 -2.07 -0.11 0.00 0.00 0.00 0.00 46.02 43.61 1diq n GLY 30 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1diq h ASP 31 N 0.00 0.30 0.47 1.61 3.32 -1.94 -3.27 116.42 116.91 1diq h ASP 31 Ca 0.00 -0.28 0.00 0.00 0.02 0.00 0.00 57.03 56.77 1diq h ASP 31 Cb 0.00 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.45 1diq h ASP 31 CO 0.00 1.14 0.00 -0.90 -1.72 0.00 0.00 179.24 177.76 1diq n ASP 32 N -3.58 0.00 -0.81 6.45 5.75 -1.26 -3.06 116.55 120.04 1diq n ASP 32 Ca -0.05 -0.20 0.11 0.00 -0.01 0.00 0.00 54.79 54.64 1diq n ASP 32 Cb 0.90 -0.25 0.07 0.00 -1.03 0.00 0.00 41.12 40.80 1diq n ASP 32 CO 0.00 0.00 0.00 0.59 -0.11 0.00 0.00 177.20 177.68 1diq n ASN 33 N -1.25 2.68 -4.12 -1.12 3.02 -1.23 -4.84 115.26 108.39 1diq n ASN 33 Ca 0.14 -1.84 -0.33 0.00 -0.03 0.00 0.00 54.58 52.53 1diq n ASN 33 Cb 0.21 0.12 -0.16 0.00 -0.61 0.00 0.00 39.78 39.34 1diq n ASN 33 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1diq s VAL 34 N -2.03 2.12 -0.32 2.41 1.01 -1.17 -1.14 120.40 121.28 1diq s VAL 34 Ca 0.24 -1.04 -0.05 0.00 0.00 0.00 0.00 61.98 61.13 1diq s VAL 34 Cb 0.19 -1.95 0.03 0.00 0.00 0.00 0.00 36.38 34.65 1diq s VAL 34 CO 0.35 0.44 0.07 -0.76 0.00 0.00 0.00 175.10 175.20 1diq s LEU 35 N 1.26 4.07 0.00 3.92 1.02 0.41 -4.94 118.68 124.42 1diq s LEU 35 Ca 0.03 -1.07 0.00 0.00 0.02 0.00 0.00 54.13 53.11 1diq s LEU 35 Cb -0.14 -1.82 0.00 0.00 0.02 0.00 0.00 46.19 44.24 1diq s LEU 35 CO -0.11 -0.27 0.00 1.33 0.02 0.00 0.00 176.35 177.31 1diq n VAL 36 N 4.77 0.00 -2.75 -1.59 0.24 -1.26 -1.39 118.33 116.35 1diq n VAL 36 Ca -0.13 -0.34 -0.41 0.00 -2.04 0.00 0.00 64.34 61.41 1diq n VAL 36 Cb 0.45 0.85 -0.04 0.00 -1.47 0.00 0.00 33.84 33.63 1diq n VAL 36 CO 0.00 0.00 0.00 -1.61 -2.14 0.00 0.00 176.83 173.08 1diq s GLU 37 N -1.24 4.65 0.64 7.34 2.02 -1.26 -4.94 118.70 125.91 1diq s GLU 37 Ca 0.00 1.40 0.35 0.00 0.02 0.00 0.00 54.97 56.74 1diq s GLU 37 Cb 0.00 -3.39 1.95 0.00 0.10 0.00 0.00 34.13 32.79 1diq s GLU 37 CO 0.00 0.18 2.16 0.66 0.02 0.00 0.00 175.26 178.28 1diq h SER 38 N 5.80 0.00 1.38 -0.19 4.64 -1.97 -0.80 113.55 122.40 1diq h SER 38 Ca -0.43 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.89 1diq h SER 38 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1diq h SER 38 CO 0.72 0.00 -0.12 -0.90 -0.87 0.00 0.00 176.83 175.67 1diq n ASP 39 N -3.30 0.82 0.00 4.97 5.75 -1.26 -2.52 116.55 121.01 1diq n ASP 39 Ca -0.01 0.50 0.01 0.00 -0.01 0.00 0.00 54.79 55.27 1diq n ASP 39 Cb 0.23 -0.63 -0.11 0.00 -1.03 0.00 0.00 41.12 39.58 1diq n ASP 39 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1diq n GLN 40 N -2.26 0.64 0.14 0.11 6.02 -0.33 -4.15 117.38 117.55 1diq n GLN 40 Ca 0.05 0.09 0.08 0.00 -0.01 0.00 0.00 57.00 57.21 1diq n GLN 40 Cb 0.43 -1.70 0.05 0.00 1.02 0.00 0.00 30.24 30.05 1diq n GLN 40 CO 0.00 0.00 0.00 -0.07 -1.01 0.00 0.00 177.06 175.98 1diq h LEU 41 N 0.00 0.00 -1.00 1.08 4.07 -1.47 -3.39 115.31 114.60 1diq h LEU 41 Ca -0.20 0.00 0.16 0.00 0.08 0.00 0.00 57.88 57.92 1diq h LEU 41 Cb 1.58 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 43.22 1diq h LEU 41 CO 0.03 0.22 0.61 0.58 -1.08 0.00 0.00 178.44 178.80 1diq h VAL 42 N 0.00 0.78 0.00 1.22 2.07 -1.65 -2.05 116.25 116.62 1diq h VAL 42 Ca -0.03 -0.29 0.00 0.00 0.82 0.00 0.00 66.70 67.20 1diq h VAL 42 Cb 1.19 -0.13 0.00 0.00 -1.52 0.00 0.00 31.29 30.83 1diq h VAL 42 CO 0.02 0.15 0.00 1.55 0.02 0.00 0.00 177.57 179.32 1diq h PRO 43 N 0.84 0.00 0.00 1.57 0.13 -1.85 -2.69 132.00 130.00 1diq h PRO 43 Ca 0.55 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.66 1diq h PRO 43 Cb 0.75 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.87 1diq h PRO 43 CO -0.34 0.00 -0.51 1.88 -0.23 0.00 0.00 178.00 178.80 1diq h TYR 44 N 0.00 0.00 0.00 1.56 0.05 -1.66 -3.34 116.97 113.58 1diq h TYR 44 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1diq h TYR 44 Cb 0.40 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.14 1diq h TYR 44 CO 0.00 0.08 -0.08 -0.97 -1.05 0.00 0.00 178.16 176.14 1diq h ASN 45 N 0.00 0.00 -2.27 3.88 -0.00 -1.48 -2.79 115.58 112.92 1diq h ASN 45 Ca -0.01 -0.01 -0.57 0.00 -0.00 0.00 0.00 56.30 55.71 1diq h ASN 45 Cb 1.07 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.39 1diq h ASN 45 CO 0.01 0.00 1.35 -0.75 -0.00 0.00 0.00 177.43 178.04 1diq s LYS 46 N -3.18 3.55 0.16 6.67 2.20 -1.25 -4.89 119.74 123.00 1diq s LYS 46 Ca 0.08 2.11 0.09 0.00 -0.36 0.00 0.00 55.97 57.90 1diq s LYS 46 Cb 0.08 -4.25 -0.04 0.00 -1.51 0.00 0.00 37.83 32.11 1diq s LYS 46 CO 0.65 -1.62 -0.21 0.96 -0.36 0.00 0.00 175.35 174.77 1diq s ILE 47 N 6.59 1.97 -0.53 5.43 -4.36 -1.26 -4.55 121.20 124.49 1diq s ILE 47 Ca 0.91 -1.86 0.14 0.00 -0.26 0.00 0.00 60.65 59.58 1diq s ILE 47 Cb -0.34 -1.87 0.42 0.00 1.25 0.00 0.00 42.46 41.92 1diq s ILE 47 CO 0.36 -0.18 1.34 0.23 0.24 0.00 0.00 174.94 176.93 1diq n MET 48 N 0.48 2.92 -3.11 0.37 2.81 -1.26 -4.97 117.12 114.36 1diq n MET 48 Ca -0.15 -2.47 -0.32 0.00 -1.81 0.00 0.00 57.70 52.96 1diq n MET 48 Cb 0.56 -1.57 -0.05 0.00 -0.71 0.00 0.00 33.22 31.44 1diq n MET 48 CO 0.00 0.00 0.00 -1.64 1.51 0.00 0.00 175.97 175.84 1diq s MET 49 N -1.96 3.93 -1.48 0.03 -1.94 -1.26 -1.89 119.30 114.72 1diq s MET 49 Ca 0.33 0.57 -0.10 0.00 -1.71 0.00 0.00 55.69 54.79 1diq s MET 49 Cb 0.24 -2.45 -0.08 0.00 2.01 0.00 0.00 34.83 34.55 1diq s MET 49 CO 0.12 0.14 2.76 -0.35 -0.01 0.00 0.00 175.02 177.68 1diq n PRO 50 N -0.54 3.35 -3.54 2.03 -0.04 -1.26 -4.79 135.00 130.20 1diq n PRO 50 Ca 0.03 -2.09 -0.12 0.00 -0.04 0.00 0.00 63.50 61.28 1diq n PRO 50 Cb 0.53 -2.77 -0.04 0.00 -0.04 0.00 0.00 33.50 31.18 1diq n PRO 50 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1diq s VAL 51 N 2.48 0.03 0.59 0.52 0.11 -1.26 -4.83 120.40 118.05 1diq s VAL 51 Ca 0.63 -0.26 -0.15 0.00 -2.93 0.00 0.00 61.98 59.26 1diq s VAL 51 Cb 0.16 -1.04 -0.04 0.00 -1.53 0.00 0.00 36.38 33.93 1diq s VAL 51 CO -0.05 -0.15 1.05 -1.61 -3.33 0.00 0.00 175.10 171.01 1diq s GLU 52 N -3.29 3.33 0.45 1.54 8.01 -1.26 -4.95 118.70 122.53 1diq s GLU 52 Ca -0.01 1.17 0.17 0.00 0.01 0.00 0.00 54.97 56.32 1diq s GLU 52 Cb 0.00 -2.04 1.12 0.00 -4.31 0.00 0.00 34.13 28.91 1diq s GLU 52 CO -0.09 -0.80 1.94 -0.91 0.01 0.00 0.00 175.26 175.42 1diq h ASN 53 N 0.40 0.31 -0.58 -0.19 4.21 -1.96 -2.55 115.58 115.22 1diq h ASN 53 Ca -0.47 0.02 0.10 0.00 1.21 0.00 0.00 56.30 57.16 1diq h ASN 53 Cb 1.22 -0.05 -0.03 0.00 -1.12 0.00 0.00 38.32 38.34 1diq h ASN 53 CO 0.58 0.16 0.39 0.00 -1.29 0.00 0.00 177.43 177.27 1diq h ALA 54 N 1.67 2.05 0.00 -0.83 0.00 -1.95 -1.60 119.26 118.60 1diq h ALA 54 Ca 0.34 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.23 1diq h ALA 54 Cb 0.85 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.57 1diq h ALA 54 CO -0.09 -0.18 0.00 0.00 0.00 0.00 0.00 179.25 178.98 1diq h ALA 55 N 1.71 1.00 0.00 0.00 0.00 -1.84 -3.11 119.26 117.01 1diq h ALA 55 Ca 0.27 0.00 -0.12 0.00 0.00 0.00 0.00 54.91 55.06 1diq h ALA 55 Cb 0.56 0.00 -0.25 0.00 0.00 0.00 0.00 17.79 18.10 1diq h ALA 55 CO -0.07 0.00 -0.83 0.72 0.00 0.00 0.00 179.25 179.07 1diq n HIS 56 N -2.68 0.00 -2.96 0.00 8.25 -0.65 -3.11 115.22 114.07 1diq n HIS 56 Ca 0.01 -0.75 -0.40 0.00 -0.26 0.00 0.00 57.72 56.32 1diq n HIS 56 Cb 0.25 -0.17 -0.05 0.00 1.12 0.00 0.00 29.99 31.14 1diq n HIS 56 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1diq s ALA 57 N -0.95 3.32 0.64 -1.41 0.00 -0.90 -3.90 121.76 118.56 1diq s ALA 57 Ca 0.33 0.28 -0.11 0.00 0.00 0.00 0.00 51.96 52.46 1diq s ALA 57 Cb 0.36 -3.04 -0.03 0.00 0.00 0.00 0.00 23.12 20.41 1diq s ALA 57 CO -0.13 -0.04 1.04 -1.25 0.00 0.00 0.00 175.76 175.39 1diq s PRO 58 N 0.38 3.41 -0.05 0.00 0.04 -1.26 0.19 135.00 137.71 1diq s PRO 58 Ca 0.40 0.77 0.15 0.00 0.04 0.00 0.00 61.00 62.37 1diq s PRO 58 Cb -0.20 -2.06 -0.22 0.00 0.04 0.00 0.00 34.50 32.07 1diq s PRO 58 CO 0.22 -0.72 0.56 -1.13 0.04 0.00 0.00 177.00 175.98 1diq n SER 59 N -2.85 0.64 -3.57 6.66 3.41 -0.94 -4.72 113.62 112.25 1diq n SER 59 Ca 0.06 0.30 -0.06 0.00 -0.26 0.00 0.00 58.87 58.91 1diq n SER 59 Cb 0.54 0.31 -0.00 0.00 -0.26 0.00 0.00 64.21 64.80 1diq n SER 59 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1diq s ALA 60 N -2.69 -1.29 -0.12 7.33 0.00 -1.26 -4.84 121.76 118.89 1diq s ALA 60 Ca -0.06 -0.28 -0.05 0.00 0.00 0.00 0.00 51.96 51.58 1diq s ALA 60 Cb 0.08 0.74 0.06 0.00 0.00 0.00 0.00 23.12 24.00 1diq s ALA 60 CO 0.83 -1.03 0.25 0.00 0.00 0.00 0.00 175.76 175.80 1diq s ALA 61 N -3.16 -0.54 -0.06 0.00 0.00 -0.48 -1.37 121.76 116.15 1diq s ALA 61 Ca 0.14 0.94 0.04 0.00 0.00 0.00 0.00 51.96 53.08 1diq s ALA 61 Cb -0.04 -0.88 -0.02 0.00 0.00 0.00 0.00 23.12 22.18 1diq s ALA 61 CO 0.06 -0.49 -0.18 0.14 0.00 0.00 0.00 175.76 175.30 1diq s VAL 62 N 2.04 2.76 -0.35 0.00 -7.23 -0.06 -0.45 120.40 117.10 1diq s VAL 62 Ca -0.02 -0.83 -0.03 0.00 -1.81 0.00 0.00 61.98 59.29 1diq s VAL 62 Cb -0.11 -2.06 0.07 0.00 0.56 0.00 0.00 36.38 34.83 1diq s VAL 62 CO -0.08 0.58 0.09 0.42 -0.31 0.00 0.00 175.10 175.80 1diq s THR 63 N -0.50 3.21 0.25 5.32 -4.23 -0.29 -0.80 115.64 118.60 1diq s THR 63 Ca 0.06 -1.61 -0.05 0.00 -1.18 0.00 0.00 61.69 58.91 1diq s THR 63 Cb -0.12 -2.98 -0.05 0.00 1.34 0.00 0.00 72.50 70.69 1diq s THR 63 CO 0.01 -0.34 0.52 0.00 -0.54 0.00 0.00 174.62 174.27 1diq s ALA 64 N 1.23 3.65 0.00 3.99 0.00 -1.24 -4.87 121.76 124.52 1diq s ALA 64 Ca 0.00 -0.53 0.00 0.00 0.00 0.00 0.00 51.96 51.43 1diq s ALA 64 Cb -0.21 -2.28 0.00 0.00 0.00 0.00 0.00 23.12 20.63 1diq s ALA 64 CO -0.02 0.36 0.00 0.25 0.00 0.00 0.00 175.76 176.35 1diq n THR 65 N -0.65 0.00 -4.28 0.00 -2.24 -1.26 -4.16 114.28 101.69 1diq n THR 65 Ca -0.02 -0.07 -0.15 0.00 -2.27 0.00 0.00 64.05 61.54 1diq n THR 65 Cb 0.53 0.51 -0.10 0.00 -2.10 0.00 0.00 70.33 69.17 1diq n THR 65 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 1diq s THR 66 N -1.54 1.33 0.36 4.28 -4.23 -1.26 -4.70 115.64 109.89 1diq s THR 66 Ca 0.00 -2.10 0.06 0.00 -1.18 0.00 0.00 61.69 58.47 1diq s THR 66 Cb 0.00 -1.90 0.18 0.00 1.34 0.00 0.00 72.50 72.12 1diq s THR 66 CO 0.00 -0.70 1.92 0.58 -0.54 0.00 0.00 174.62 175.88 1diq h VAL 67 N 2.72 1.17 -0.34 2.29 2.07 -1.98 -2.27 116.25 119.91 1diq h VAL 67 Ca -0.37 -0.65 -0.03 0.00 0.82 0.00 0.00 66.70 66.47 1diq h VAL 67 Cb 1.20 0.90 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 1diq h VAL 67 CO 0.63 0.23 0.09 -0.33 0.02 0.00 0.00 177.57 178.20 1diq h GLU 68 N 0.46 0.49 -0.05 1.57 3.07 -1.99 -1.46 114.58 116.67 1diq h GLU 68 Ca 0.10 -0.07 -0.21 0.00 -0.50 0.00 0.00 59.36 58.68 1diq h GLU 68 Cb 0.25 -0.09 0.00 0.00 -0.84 0.00 0.00 28.75 28.08 1diq h GLU 68 CO 0.00 0.45 -0.85 1.96 -1.40 0.00 0.00 179.01 179.18 1diq h GLN 69 N 0.49 0.50 -0.51 2.33 4.20 -1.84 -2.02 115.11 118.26 1diq h GLN 69 Ca 0.12 -0.46 -0.11 0.00 0.06 0.00 0.00 58.65 58.26 1diq h GLN 69 Cb 0.18 0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.06 1diq h GLN 69 CO -0.00 1.10 -0.10 0.28 -0.67 0.00 0.00 178.83 179.43 1diq h VAL 70 N 0.31 1.27 -0.38 -0.54 2.07 -1.22 0.51 116.25 118.28 1diq h VAL 70 Ca -0.06 -1.24 -0.03 0.00 0.82 0.00 0.00 66.70 66.19 1diq h VAL 70 Cb 1.46 1.03 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1diq h VAL 70 CO 0.15 0.43 0.10 1.56 0.02 0.00 0.00 177.57 179.84 1diq h GLN 71 N 0.82 0.55 0.02 1.57 4.20 -1.26 -1.72 115.11 119.29 1diq h GLN 71 Ca 0.13 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.75 1diq h GLN 71 Cb 0.66 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.34 1diq h GLN 71 CO 0.05 0.50 -0.01 0.78 -0.67 0.00 0.00 178.83 179.47 1diq h GLY 72 N 0.76 -0.03 0.85 3.46 0.00 -0.75 -2.47 103.07 104.89 1diq h GLY 72 Ca 0.13 0.01 0.09 0.00 0.00 0.00 0.00 47.33 47.56 1diq h GLY 72 CO -0.01 -0.01 0.53 -2.08 0.00 0.00 0.00 176.54 174.97 1diq h VAL 73 N -0.55 0.97 -0.06 4.60 2.07 -0.63 -1.50 116.25 121.15 1diq h VAL 73 Ca -0.00 -0.27 -0.17 0.00 0.82 0.00 0.00 66.70 67.08 1diq h VAL 73 Cb 0.52 0.12 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1diq h VAL 73 CO 0.00 0.14 -0.71 0.58 0.02 0.00 0.00 177.57 177.61 1diq h VAL 74 N 0.79 1.40 -0.34 2.57 2.07 -1.32 -1.35 116.25 120.07 1diq h VAL 74 Ca 0.37 -2.17 -0.10 0.00 0.82 0.00 0.00 66.70 65.62 1diq h VAL 74 Cb 0.39 2.13 -0.01 0.00 -1.52 0.00 0.00 31.29 32.28 1diq h VAL 74 CO -0.14 0.64 -0.17 0.50 0.02 0.00 0.00 177.57 178.42 1diq h LYS 75 N 0.21 0.72 -0.55 1.57 3.64 -0.81 -2.02 116.57 119.32 1diq h LYS 75 Ca -0.02 -0.32 -0.10 0.00 -1.27 0.00 0.00 60.65 58.94 1diq h LYS 75 Cb 1.26 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.05 1diq h LYS 75 CO 0.11 0.92 -0.04 0.82 -2.27 0.00 0.00 179.45 179.00 1diq h ILE 76 N 0.49 1.26 -0.15 2.00 2.04 -1.31 -2.79 117.51 119.05 1diq h ILE 76 Ca 0.07 -1.17 -0.07 0.00 1.00 0.00 0.00 64.86 64.70 1diq h ILE 76 Cb 0.71 0.88 -0.01 0.00 -0.74 0.00 0.00 36.82 37.66 1diq h ILE 76 CO 0.05 0.42 -0.23 0.00 0.00 0.00 0.00 178.15 178.38 1diq h ASN 78 N 0.25 0.33 -0.03 0.00 2.35 -1.21 -0.02 115.58 117.24 1diq h ASN 78 Ca 0.04 -0.22 -0.01 0.00 -0.55 0.00 0.00 56.30 55.57 1diq h ASN 78 Cb 0.55 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 38.82 1diq h ASN 78 CO 0.04 0.94 0.00 -0.33 -1.65 0.00 0.00 177.43 176.43 1diq h GLU 79 N 0.18 0.06 -0.55 0.81 5.08 -1.21 -3.29 114.58 115.66 1diq h GLU 79 Ca -0.03 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1diq h GLU 79 Cb 1.29 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.53 1diq h GLU 79 CO 0.12 0.35 0.00 0.72 -1.00 0.00 0.00 179.01 179.20 1diq n HIS 80 N -4.90 1.50 -4.03 4.33 8.25 -1.06 -4.97 115.22 114.34 1diq n HIS 80 Ca -0.07 -0.68 -0.29 0.00 -0.26 0.00 0.00 57.72 56.42 1diq n HIS 80 Cb 0.18 -0.32 -0.02 0.00 1.12 0.00 0.00 29.99 30.95 1diq n HIS 80 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1diq n LYS 81 N 0.69 -3.42 -3.18 -0.41 4.76 -0.75 -4.90 118.16 110.95 1diq n LYS 81 Ca 0.25 0.41 -0.40 0.00 -2.87 0.00 0.00 58.31 55.70 1diq n LYS 81 Cb 0.95 -4.76 -0.07 0.00 -1.84 0.00 0.00 35.03 29.31 1diq n LYS 81 CO 0.00 0.00 0.00 0.42 -1.37 0.00 0.00 177.40 176.45 1diq s ILE 82 N -3.72 5.05 -0.17 -0.18 -1.09 -0.09 -4.88 121.20 116.11 1diq s ILE 82 Ca 0.26 1.04 -0.27 0.00 -2.23 0.00 0.00 60.65 59.45 1diq s ILE 82 Cb -0.14 -3.89 -0.01 0.00 -1.58 0.00 0.00 42.46 36.85 1diq s ILE 82 CO 0.90 0.10 0.93 -2.16 -1.23 0.00 0.00 174.94 173.48 1diq s PRO 83 N 2.07 4.31 -0.11 2.79 0.04 -1.26 -4.73 135.00 138.11 1diq s PRO 83 Ca 0.25 1.20 -0.04 0.00 0.04 0.00 0.00 61.00 62.45 1diq s PRO 83 Cb -0.16 -3.59 -0.04 0.00 0.04 0.00 0.00 34.50 30.76 1diq s PRO 83 CO 0.09 -0.42 0.05 0.96 0.04 0.00 0.00 177.00 177.72 1diq s ILE 84 N 2.45 4.70 -0.32 0.56 -4.36 -0.00 -1.04 121.20 123.17 1diq s ILE 84 Ca 0.42 -0.10 -0.03 0.00 -0.26 0.00 0.00 60.65 60.68 1diq s ILE 84 Cb -0.16 -3.01 0.05 0.00 1.25 0.00 0.00 42.46 40.59 1diq s ILE 84 CO 0.12 0.60 0.05 0.86 0.24 0.00 0.00 174.94 176.81 1diq s TRP 85 N -0.79 3.30 -0.02 1.37 -0.11 0.19 -0.62 118.94 122.25 1diq s TRP 85 Ca 0.13 -1.80 -0.25 0.00 1.22 0.00 0.00 56.10 55.39 1diq s TRP 85 Cb -0.12 -2.29 -0.04 0.00 -1.50 0.00 0.00 33.47 29.52 1diq s TRP 85 CO 0.03 -0.80 0.78 0.99 -4.62 0.00 0.00 176.95 173.32 1diq s THR 86 N 1.28 4.93 0.10 5.86 2.01 -1.26 -1.52 115.64 127.05 1diq s THR 86 Ca -0.03 1.62 0.07 0.00 0.31 0.00 0.00 61.69 63.66 1diq s THR 86 Cb -0.20 -4.12 -0.03 0.00 0.01 0.00 0.00 72.50 68.16 1diq s THR 86 CO -0.00 0.26 -0.17 0.27 -0.69 0.00 0.00 174.62 174.29 1diq s ILE 87 N 0.63 1.42 0.00 1.82 -4.36 -0.91 -4.96 121.20 114.85 1diq s ILE 87 Ca 0.41 -1.56 0.00 0.00 -0.26 0.00 0.00 60.65 59.24 1diq s ILE 87 Cb -0.19 -1.43 0.00 0.00 1.25 0.00 0.00 42.46 42.09 1diq s ILE 87 CO 0.21 -0.24 0.00 -1.20 0.24 0.00 0.00 174.94 173.95 1diq n SER 88 N 0.90 0.00 -0.00 4.36 7.64 -1.26 -2.22 113.62 123.03 1diq n SER 88 Ca -0.18 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.77 1diq n SER 88 Cb 0.55 -0.26 -0.10 0.00 -1.01 0.00 0.00 64.21 63.40 1diq n SER 88 CO 0.00 0.00 0.00 0.35 -3.01 0.00 0.00 175.04 172.38 1diq n THR 89 N -2.19 0.00 -2.41 0.44 -2.24 -1.26 -3.06 114.28 103.56 1diq n THR 89 Ca 0.00 -0.18 -0.13 0.00 -2.27 0.00 0.00 64.05 61.47 1diq n THR 89 Cb 0.00 0.82 -0.01 0.00 -2.10 0.00 0.00 70.33 69.04 1diq n THR 89 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1diq n GLY 90 N 1.41 -0.45 2.24 3.38 0.00 -1.26 -4.90 105.19 105.62 1diq n GLY 90 Ca 0.02 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.76 1diq n GLY 90 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1diq n ARG 91 N -2.80 2.41 -1.10 1.61 5.12 -1.26 -3.70 116.66 116.93 1diq n ARG 91 Ca -0.16 -3.05 -0.26 0.00 -1.93 0.00 0.00 57.85 52.46 1diq n ARG 91 Cb 0.62 -2.19 -0.08 0.00 -1.16 0.00 0.00 32.46 29.64 1diq n ARG 91 CO 0.00 0.00 0.00 -1.71 -1.93 0.00 0.00 177.63 173.99 1diq n ASN 92 N -0.99 6.84 -4.72 0.55 5.15 -1.25 -4.95 115.26 115.89 1diq n ASN 92 Ca 0.60 -2.48 -0.42 0.00 -0.60 0.00 0.00 54.58 51.67 1diq n ASN 92 Cb 1.20 -1.42 -0.03 0.00 -0.53 0.00 0.00 39.78 39.00 1diq n ASN 92 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1diq s PHE 93 N 1.87 2.96 0.00 1.20 0.08 -1.26 -0.89 117.98 121.94 1diq s PHE 93 Ca 0.64 0.46 0.00 0.00 0.12 0.00 0.00 56.93 58.15 1diq s PHE 93 Cb 0.22 -4.05 0.00 0.00 -0.57 0.00 0.00 43.02 38.62 1diq s PHE 93 CO -0.03 -3.93 0.00 0.41 -0.10 0.00 0.00 175.22 171.57 1diq n GLY 94 N 3.88 0.91 0.04 4.36 0.00 -1.26 -4.83 105.19 108.30 1diq n GLY 94 Ca 0.15 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.18 1diq n GLY 94 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1diq n TYR 95 N -2.00 0.00 0.00 1.61 4.01 -0.19 -3.06 117.16 117.52 1diq n TYR 95 Ca 0.00 -0.37 0.00 0.00 -0.16 0.00 0.00 57.90 57.37 1diq n TYR 95 Cb 0.00 -0.05 0.00 0.00 -0.31 0.00 0.00 39.34 38.98 1diq n TYR 95 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1diq n GLY 96 N -0.42 1.35 7.00 2.72 0.00 -1.11 -2.89 105.19 111.84 1diq n GLY 96 Ca 0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.04 1diq n GLY 96 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1diq n SER 97 N 0.00 0.00 -0.45 1.61 7.64 -0.07 -2.46 113.62 119.89 1diq n SER 97 Ca 0.00 0.00 0.07 0.00 1.01 0.00 0.00 58.87 59.95 1diq n SER 97 Cb 0.00 0.00 0.03 0.00 -1.01 0.00 0.00 64.21 63.23 1diq n SER 97 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1diq n ALA 98 N 12.02 2.78 -1.85 -0.43 0.00 -1.24 -3.95 120.51 127.84 1diq n ALA 98 Ca 0.00 -0.56 -0.37 0.00 0.00 0.00 0.00 53.44 52.52 1diq n ALA 98 Cb 0.00 -0.49 -0.06 0.00 0.00 0.00 0.00 19.45 18.89 1diq n ALA 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1diq s ALA 99 N -1.48 3.25 0.79 0.00 0.00 -1.03 -4.91 121.76 118.39 1diq s ALA 99 Ca 0.14 0.44 -0.12 0.00 0.00 0.00 0.00 51.96 52.43 1diq s ALA 99 Cb 0.12 -3.10 0.07 0.00 0.00 0.00 0.00 23.12 20.21 1diq s ALA 99 CO 0.27 0.21 1.14 -1.25 0.00 0.00 0.00 175.76 176.12 1diq s PRO 100 N -2.04 1.92 0.28 0.00 0.04 -1.25 -4.94 135.00 129.00 1diq s PRO 100 Ca 0.49 1.45 -0.02 0.00 0.04 0.00 0.00 61.00 62.95 1diq s PRO 100 Cb -0.18 -1.84 0.39 0.00 0.04 0.00 0.00 34.50 32.91 1diq s PRO 100 CO 0.23 -1.94 1.89 -0.39 0.04 0.00 0.00 177.00 176.82 1diq h VAL 101 N -1.02 1.22 -3.96 -0.36 -1.51 -1.90 -3.44 116.25 105.28 1diq h VAL 101 Ca -0.45 -0.61 -0.62 0.00 -1.23 0.00 0.00 66.70 63.79 1diq h VAL 101 Cb 1.26 0.31 -0.22 0.00 -2.13 0.00 0.00 31.29 30.50 1diq h VAL 101 CO 0.48 0.26 -0.85 -1.10 -1.23 0.00 0.00 177.57 175.14 1diq s GLN 102 N -5.59 1.29 0.40 5.19 -0.21 -1.26 -4.80 119.66 114.68 1diq s GLN 102 Ca -0.11 -1.22 -0.27 0.00 0.02 0.00 0.00 55.36 53.78 1diq s GLN 102 Cb 0.17 -1.63 -0.10 0.00 1.00 0.00 0.00 33.01 32.44 1diq s GLN 102 CO 0.80 0.39 1.43 0.50 -2.12 0.00 0.00 175.29 176.29 1diq s ARG 103 N -1.87 3.99 0.00 2.91 3.52 -1.18 -3.50 118.95 122.81 1diq s ARG 103 Ca 0.10 2.45 0.00 0.00 -0.13 0.00 0.00 55.73 58.15 1diq s ARG 103 Cb -0.10 -2.86 0.00 0.00 -1.56 0.00 0.00 34.95 30.43 1diq s ARG 103 CO 0.05 -0.58 0.00 0.41 -0.81 0.00 0.00 175.30 174.36 1diq n GLY 104 N 0.55 0.75 3.82 8.12 0.00 0.13 -4.34 105.19 114.22 1diq n GLY 104 Ca 0.02 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.72 1diq n GLY 104 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1diq s GLN 105 N -0.00 3.67 0.02 1.61 -0.21 -1.23 -3.19 119.66 120.33 1diq s GLN 105 Ca 0.00 1.08 -0.21 0.00 0.02 0.00 0.00 55.36 56.26 1diq s GLN 105 Cb 0.00 -2.09 -0.06 0.00 1.00 0.00 0.00 33.01 31.86 1diq s GLN 105 CO 0.00 -0.51 0.60 0.08 -2.12 0.00 0.00 175.29 173.35 1diq s VAL 106 N -2.52 4.85 -0.26 1.09 1.01 -0.21 -2.22 120.40 122.15 1diq s VAL 106 Ca 0.61 1.27 -0.19 0.00 0.00 0.00 0.00 61.98 63.68 1diq s VAL 106 Cb -0.13 -3.94 -0.03 0.00 0.00 0.00 0.00 36.38 32.29 1diq s VAL 106 CO 0.33 0.45 0.55 -0.63 0.00 0.00 0.00 175.10 175.79 1diq s ILE 107 N -0.40 5.05 -0.72 2.22 1.01 -0.47 0.55 121.20 128.43 1diq s ILE 107 Ca 0.31 0.95 -0.19 0.00 0.00 0.00 0.00 60.65 61.72 1diq s ILE 107 Cb -0.19 -3.86 0.11 0.00 0.01 0.00 0.00 42.46 38.54 1diq s ILE 107 CO 0.18 0.08 0.89 -0.22 0.00 0.00 0.00 174.94 175.87 1diq s LEU 108 N 2.32 5.19 -0.42 2.97 2.96 -0.58 -0.89 118.68 130.24 1diq s LEU 108 Ca 0.23 -1.62 -0.23 0.00 -0.22 0.00 0.00 54.13 52.29 1diq s LEU 108 Cb -0.16 -2.35 0.02 0.00 0.50 0.00 0.00 46.19 44.21 1diq s LEU 108 CO 0.09 -1.13 0.77 -0.62 -1.32 0.00 0.00 176.35 174.14 1diq s ASP 109 N 3.50 6.44 -0.41 3.68 3.68 0.02 -2.14 116.67 131.45 1diq s ASP 109 Ca 0.20 0.02 0.05 0.00 2.13 0.00 0.00 52.55 54.96 1diq s ASP 109 Cb -0.16 -2.38 0.66 0.00 -1.45 0.00 0.00 42.92 39.59 1diq s ASP 109 CO 0.01 -0.84 1.85 0.18 0.13 0.00 0.00 175.17 176.50 1diq n LEU 110 N 6.57 6.34 0.15 -1.34 4.77 -0.94 -3.64 117.00 128.91 1diq n LEU 110 Ca 0.02 -3.58 0.00 0.00 -0.03 0.00 0.00 56.01 52.42 1diq n LEU 110 Cb 0.48 -0.80 0.27 0.00 -2.33 0.00 0.00 43.42 41.04 1diq n LEU 110 CO 0.57 1.05 0.64 0.50 -1.33 0.00 0.00 177.39 178.82 1diq h LYS 111 N 1.20 0.06 0.00 3.23 1.63 -1.78 -2.83 116.57 118.09 1diq h LYS 111 Ca 0.54 -0.03 0.00 0.00 -0.85 0.00 0.00 60.65 60.31 1diq h LYS 111 Cb 2.66 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 34.29 1diq h LYS 111 CO 0.97 0.50 0.00 0.87 -3.45 0.00 0.00 179.45 178.34 1diq h LYS 112 N 0.05 0.00 -4.11 1.90 1.79 -1.80 -3.34 116.57 111.07 1diq h LYS 112 Ca 0.00 0.00 -0.72 0.00 -2.18 0.00 0.00 60.65 57.75 1diq h LYS 112 Cb 0.81 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.37 1diq h LYS 112 CO 0.06 0.00 2.57 -1.33 -1.08 0.00 0.00 179.45 179.67 1diq n MET 113 N -2.54 3.17 -1.59 3.15 2.81 -1.08 -4.79 117.12 116.24 1diq n MET 113 Ca 0.02 -3.05 -0.28 0.00 -1.81 0.00 0.00 57.70 52.58 1diq n MET 113 Cb 0.28 -3.18 0.07 0.00 -0.71 0.00 0.00 33.22 29.67 1diq n MET 113 CO 0.00 0.00 0.00 0.27 1.51 0.00 0.00 175.97 177.75 1diq n ASN 114 N 5.63 5.98 -4.71 7.83 2.04 -1.25 -0.20 115.26 130.58 1diq n ASN 114 Ca 0.47 -3.77 -0.38 0.00 -0.44 0.00 0.00 54.58 50.46 1diq n ASN 114 Cb 0.39 -0.67 -0.06 0.00 -2.53 0.00 0.00 39.78 36.91 1diq n ASN 114 CO 0.00 0.00 0.00 -0.75 -0.44 0.00 0.00 177.26 176.07 1diq s LYS 115 N -3.67 4.28 -0.50 -3.83 2.20 -1.26 -4.62 119.74 112.34 1diq s LYS 115 Ca 0.57 0.35 -0.22 0.00 -0.36 0.00 0.00 55.97 56.30 1diq s LYS 115 Cb 0.46 -3.47 0.04 0.00 -1.51 0.00 0.00 37.83 33.35 1diq s LYS 115 CO 0.02 0.10 0.80 0.42 -0.36 0.00 0.00 175.35 176.32 1diq s ILE 116 N 0.85 4.62 0.14 5.43 1.01 -1.26 -2.05 121.20 129.94 1diq s ILE 116 Ca 0.23 0.13 -0.07 0.00 0.00 0.00 0.00 60.65 60.94 1diq s ILE 116 Cb -0.15 -4.39 -0.13 0.00 0.01 0.00 0.00 42.46 37.80 1diq s ILE 116 CO 0.09 -0.88 1.37 0.40 0.00 0.00 0.00 174.94 175.91 1diq h ILE 117 N 5.96 1.33 -1.53 2.92 2.04 -1.65 -3.47 117.51 123.11 1diq h ILE 117 Ca -0.26 -2.08 0.08 0.00 1.00 0.00 0.00 64.86 63.60 1diq h ILE 117 Cb 1.08 2.07 -0.27 0.00 -0.74 0.00 0.00 36.82 38.97 1diq h ILE 117 CO 1.00 0.64 0.51 -0.75 0.00 0.00 0.00 178.15 179.55 1diq s LYS 118 N -3.65 0.44 -0.22 2.37 2.20 -1.06 -4.99 119.74 114.82 1diq s LYS 118 Ca -0.08 0.53 -0.03 0.00 -0.36 0.00 0.00 55.97 56.03 1diq s LYS 118 Cb 0.09 0.21 0.07 0.00 -1.51 0.00 0.00 37.83 36.69 1diq s LYS 118 CO 0.87 -0.05 0.07 0.42 -0.36 0.00 0.00 175.35 176.30 1diq s ILE 119 N 0.27 0.36 -0.39 5.43 1.01 -1.26 -1.02 121.20 125.59 1diq s ILE 119 Ca 0.03 -0.62 -0.20 0.00 0.00 0.00 0.00 60.65 59.85 1diq s ILE 119 Cb -0.05 -1.02 0.01 0.00 0.01 0.00 0.00 42.46 41.42 1diq s ILE 119 CO -0.08 -0.37 0.64 -0.62 0.00 0.00 0.00 174.94 174.51 1diq s ASP 120 N 1.92 6.37 0.45 3.58 -1.08 -0.72 -4.97 116.67 122.22 1diq s ASP 120 Ca 0.03 -0.09 0.25 0.00 -0.52 0.00 0.00 52.55 52.22 1diq s ASP 120 Cb -0.17 -2.32 0.82 0.00 -1.46 0.00 0.00 42.92 39.79 1diq s ASP 120 CO -0.15 -0.68 1.78 1.55 0.52 0.00 0.00 175.17 178.19 1diq h PRO 121 N 8.66 0.00 0.02 4.34 0.13 -1.98 -1.59 132.00 141.58 1diq h PRO 121 Ca -0.26 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.77 1diq h PRO 121 Cb 1.10 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.22 1diq h PRO 121 CO 0.86 0.17 -0.52 0.93 -0.23 0.00 0.00 178.00 179.21 1diq h GLU 122 N 0.00 0.03 -0.00 0.86 5.08 -1.98 -3.35 114.58 115.22 1diq h GLU 122 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1diq h GLU 122 Cb 0.82 0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.09 1diq h GLU 122 CO 0.02 1.03 -0.15 -1.33 -1.00 0.00 0.00 179.01 177.57 1diq n MET 123 N -4.49 0.20 -3.36 2.33 2.81 -1.25 -4.99 117.12 108.36 1diq n MET 123 Ca -0.18 -0.06 -0.12 0.00 -1.81 0.00 0.00 57.70 55.54 1diq n MET 123 Cb 0.59 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.60 1diq n MET 123 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1diq s TYR 125 N -2.91 0.32 -0.02 0.00 -0.85 -1.13 -1.74 117.35 111.01 1diq s TYR 125 Ca 0.03 -0.67 -0.03 0.00 -0.52 0.00 0.00 57.07 55.88 1diq s TYR 125 Cb -0.01 0.04 0.00 0.00 0.38 0.00 0.00 41.96 42.38 1diq s TYR 125 CO 0.82 -0.78 0.07 0.00 -1.52 0.00 0.00 175.55 174.13 1diq s ALA 126 N -3.96 -0.16 -0.19 9.51 0.00 0.19 -1.75 121.76 125.39 1diq s ALA 126 Ca 0.17 0.12 0.01 0.00 0.00 0.00 0.00 51.96 52.26 1diq s ALA 126 Cb 0.02 -0.08 0.04 0.00 0.00 0.00 0.00 23.12 23.09 1diq s ALA 126 CO 0.01 -0.05 -0.12 -1.17 0.00 0.00 0.00 175.76 174.43 1diq s LEU 127 N -0.15 2.17 0.32 0.00 2.96 -0.19 -1.04 118.68 122.76 1diq s LEU 127 Ca -0.02 -0.80 0.04 0.00 -0.22 0.00 0.00 54.13 53.13 1diq s LEU 127 Cb -0.02 -1.25 -0.06 0.00 0.50 0.00 0.00 46.19 45.36 1diq s LEU 127 CO 0.00 -0.12 0.04 0.68 -1.32 0.00 0.00 176.35 175.64 1diq s VAL 128 N 1.40 1.29 0.25 1.68 -7.23 -0.34 -1.60 120.40 115.85 1diq s VAL 128 Ca 0.00 -2.01 0.05 0.00 -1.81 0.00 0.00 61.98 58.21 1diq s VAL 128 Cb -0.15 -2.76 -0.03 0.00 0.56 0.00 0.00 36.38 33.99 1diq s VAL 128 CO -0.09 -0.04 0.37 -1.61 -0.31 0.00 0.00 175.10 173.42 1diq s GLU 129 N -3.86 3.43 0.37 4.82 2.02 -0.87 -1.49 118.70 123.11 1diq s GLU 129 Ca 0.35 -0.76 0.12 0.00 0.02 0.00 0.00 54.97 54.71 1diq s GLU 129 Cb 0.08 -2.88 0.93 0.00 0.10 0.00 0.00 34.13 32.36 1diq s GLU 129 CO 0.15 0.40 1.82 -1.35 0.02 0.00 0.00 175.26 176.31 1diq h PRO 130 N 1.14 0.56 -0.00 0.39 0.11 -1.69 -2.71 132.00 129.80 1diq h PRO 130 Ca -0.52 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1diq h PRO 130 Cb 1.23 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.22 1diq h PRO 130 CO 0.61 0.37 0.00 0.41 -0.21 0.00 0.00 178.00 179.17 1diq n GLY 131 N -1.44 -0.97 3.72 -0.55 0.00 0.72 -4.17 105.19 102.49 1diq n GLY 131 Ca 0.21 -0.20 -0.42 0.00 0.00 0.00 0.00 46.02 45.61 1diq n GLY 131 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1diq s VAL 132 N -2.00 3.44 0.26 1.61 1.01 -1.02 -4.61 120.40 119.09 1diq s VAL 132 Ca 0.46 1.04 0.05 0.00 0.00 0.00 0.00 61.98 63.54 1diq s VAL 132 Cb 0.21 -3.67 -0.02 0.00 0.00 0.00 0.00 36.38 32.90 1diq s VAL 132 CO 0.35 0.08 0.38 0.42 0.00 0.00 0.00 175.10 176.34 1diq s THR 133 N 1.04 4.94 0.36 3.92 -4.23 -1.26 -4.12 115.64 116.30 1diq s THR 133 Ca 0.63 -1.00 0.17 0.00 -1.18 0.00 0.00 61.69 60.31 1diq s THR 133 Cb -0.35 -3.74 0.16 0.00 1.34 0.00 0.00 72.50 69.90 1diq s THR 133 CO 0.30 -0.29 1.89 -0.26 -0.54 0.00 0.00 174.62 175.73 1diq h PHE 134 N 1.11 0.00 -0.33 3.99 0.05 -0.91 -2.16 116.94 118.69 1diq h PHE 134 Ca -0.50 0.00 -0.13 0.00 3.82 0.00 0.00 57.97 61.16 1diq h PHE 134 Cb 1.24 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 39.18 1diq h PHE 134 CO 0.45 0.29 -0.30 0.78 -0.18 0.00 0.00 178.31 179.35 1diq h GLY 135 N 1.12 0.85 1.21 -1.45 0.00 -1.71 -0.53 103.07 102.56 1diq h GLY 135 Ca -0.00 -0.85 -0.01 0.00 0.00 0.00 0.00 47.33 46.47 1diq h GLY 135 CO 0.04 0.77 0.43 -1.61 0.00 0.00 0.00 176.54 176.17 1diq h GLN 136 N 0.55 1.04 -0.31 4.80 4.15 -1.72 -1.12 115.11 122.50 1diq h GLN 136 Ca 0.06 -0.10 -0.18 0.00 0.77 0.00 0.00 58.65 59.19 1diq h GLN 136 Cb 0.87 -0.21 -0.00 0.00 0.21 0.00 0.00 27.48 28.35 1diq h GLN 136 CO 0.08 0.75 -0.51 0.52 -1.93 0.00 0.00 178.83 177.73 1diq h MET 137 N 1.06 0.88 -0.77 1.69 2.86 -1.22 -2.63 114.93 116.80 1diq h MET 137 Ca 0.27 -0.54 -0.03 0.00 -2.06 0.00 0.00 59.70 57.35 1diq h MET 137 Cb -0.00 0.05 -0.04 0.00 0.06 0.00 0.00 31.60 31.67 1diq h MET 137 CO -0.05 1.18 0.37 -0.92 1.06 0.00 0.00 176.91 178.55 1diq h TYR 138 N 0.68 1.11 -0.36 -0.22 3.20 -0.55 -0.97 116.97 119.87 1diq h TYR 138 Ca 0.02 -0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.82 1diq h TYR 138 Cb 1.12 -0.34 -0.02 0.00 1.54 0.00 0.00 36.73 39.03 1diq h TYR 138 CO 0.07 0.81 0.14 -0.44 -1.64 0.00 0.00 178.16 177.10 1diq h ASP 139 N 1.09 0.51 -0.69 -2.11 3.45 -1.17 -1.10 116.42 116.38 1diq h ASP 139 Ca 0.26 -0.18 -0.02 0.00 0.43 0.00 0.00 57.03 57.52 1diq h ASP 139 Cb 0.12 -0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 38.72 1diq h ASP 139 CO -0.03 0.54 0.35 0.22 -1.57 0.00 0.00 179.24 178.75 1diq h TYR 140 N 0.44 1.00 -0.02 4.55 5.03 -1.14 0.52 116.97 127.35 1diq h TYR 140 Ca 0.12 -0.04 -0.14 0.00 2.58 0.00 0.00 58.73 61.25 1diq h TYR 140 Cb 0.20 -0.32 -0.02 0.00 1.55 0.00 0.00 36.73 38.15 1diq h TYR 140 CO -0.00 0.73 -0.66 0.82 -1.32 0.00 0.00 178.16 177.73 1diq h ILE 141 N 1.01 1.45 0.17 1.81 2.04 -0.91 -2.45 117.51 120.63 1diq h ILE 141 Ca 0.25 -2.22 -0.30 0.00 1.00 0.00 0.00 64.86 63.60 1diq h ILE 141 Cb 0.09 2.18 0.03 0.00 -0.74 0.00 0.00 36.82 38.39 1diq h ILE 141 CO -0.03 0.64 -1.27 1.56 0.00 0.00 0.00 178.15 179.05 1diq h GLN 142 N 0.05 0.56 -0.20 2.37 1.08 -0.52 -2.68 115.11 115.77 1diq h GLN 142 Ca -0.01 -0.83 -0.03 0.00 -1.45 0.00 0.00 58.65 56.33 1diq h GLN 142 Cb 1.17 0.29 -0.01 0.00 -0.05 0.00 0.00 27.48 28.89 1diq h GLN 142 CO 0.09 1.38 0.02 1.49 -0.95 0.00 0.00 178.83 180.86 1diq h GLU 143 N 0.15 0.34 -0.19 1.46 4.81 -0.97 -3.18 114.58 117.01 1diq h GLU 143 Ca -0.21 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 58.93 1diq h GLU 143 Cb 1.96 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 31.31 1diq h GLU 143 CO 0.24 0.52 0.00 0.09 -0.73 0.00 0.00 179.01 179.13 1diq n ASN 144 N -4.72 1.67 -3.83 1.04 3.02 -0.92 -4.95 115.26 106.57 1diq n ASN 144 Ca -0.04 -1.75 -0.30 0.00 -0.03 0.00 0.00 54.58 52.46 1diq n ASN 144 Cb 0.21 -0.12 0.01 0.00 -0.61 0.00 0.00 39.78 39.27 1diq n ASN 144 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1diq n ASN 145 N 0.34 -4.38 -4.74 6.41 5.15 -1.04 -4.95 115.26 112.04 1diq n ASN 145 Ca 0.15 -0.73 -0.41 0.00 -0.60 0.00 0.00 54.58 52.99 1diq n ASN 145 Cb 0.32 -3.54 -0.04 0.00 -0.53 0.00 0.00 39.78 36.00 1diq n ASN 145 CO 0.00 0.00 0.00 -0.76 1.40 0.00 0.00 177.26 177.90 1diq s LEU 146 N -7.10 4.46 -0.04 1.20 1.43 -1.05 -4.94 118.68 112.64 1diq s LEU 146 Ca 0.62 2.13 -0.00 0.00 -1.03 0.00 0.00 54.13 55.85 1diq s LEU 146 Cb -0.32 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.31 1diq s LEU 146 CO 0.76 -0.30 2.07 -0.81 0.23 0.00 0.00 176.35 178.31 1diq n PRO 147 N 2.56 1.14 -4.27 1.29 -0.04 -1.26 -4.88 135.00 129.55 1diq n PRO 147 Ca 0.04 -0.24 -0.24 0.00 -0.04 0.00 0.00 63.50 63.01 1diq n PRO 147 Cb 0.46 -1.12 -0.08 0.00 -0.04 0.00 0.00 33.50 32.72 1diq n PRO 147 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1diq s VAL 148 N -0.25 3.48 0.05 0.52 -7.23 -1.26 -0.34 120.40 115.37 1diq s VAL 148 Ca 0.07 -1.76 0.08 0.00 -1.81 0.00 0.00 61.98 58.55 1diq s VAL 148 Cb 0.04 -2.81 -0.03 0.00 0.56 0.00 0.00 36.38 34.14 1diq s VAL 148 CO -0.00 -0.27 -0.21 -0.32 -0.31 0.00 0.00 175.10 173.98 1diq s MET 149 N -3.38 1.39 0.22 4.82 1.75 0.28 -4.64 119.30 119.74 1diq s MET 149 Ca 0.29 -0.98 0.04 0.00 -1.25 0.00 0.00 55.69 53.79 1diq s MET 149 Cb -0.07 -1.54 -0.03 0.00 2.84 0.00 0.00 34.83 36.03 1diq s MET 149 CO 0.19 0.39 0.33 -0.51 -0.65 0.00 0.00 175.02 174.77 1diq s LEU 150 N -1.27 4.30 -0.07 4.11 1.43 -1.26 -3.22 118.68 122.69 1diq s LEU 150 Ca 0.08 0.08 0.03 0.00 -1.03 0.00 0.00 54.13 53.29 1diq s LEU 150 Cb -0.09 -2.85 0.01 0.00 0.03 0.00 0.00 46.19 43.29 1diq s LEU 150 CO 0.02 -0.04 -0.16 -0.55 0.23 0.00 0.00 176.35 175.85 1diq s SER 151 N -3.78 2.20 0.18 2.29 0.15 -1.26 -3.94 113.70 109.54 1diq s SER 151 Ca 0.34 -0.38 -0.11 0.00 0.70 0.00 0.00 55.95 56.49 1diq s SER 151 Cb -0.09 -0.99 0.00 0.00 -1.71 0.00 0.00 66.02 63.22 1diq s SER 151 CO 0.29 0.08 0.36 0.72 1.20 0.00 0.00 173.24 175.88 1diq s PHE 152 N 0.53 0.25 0.84 3.44 -0.00 -1.26 -4.97 117.98 116.81 1diq s PHE 152 Ca -0.15 -0.61 -0.12 0.00 -0.00 0.00 0.00 56.93 56.05 1diq s PHE 152 Cb -0.16 0.08 0.10 0.00 -0.00 0.00 0.00 43.02 43.03 1diq s PHE 152 CO 0.05 -0.79 1.10 -1.54 -0.00 0.00 0.00 175.22 174.05 1diq s SER 153 N -2.94 4.04 0.41 1.98 1.04 -1.26 -4.13 113.70 112.85 1diq s SER 153 Ca 0.15 1.33 0.09 0.00 0.48 0.00 0.00 55.95 58.00 1diq s SER 153 Cb 0.02 -2.04 0.88 0.00 0.10 0.00 0.00 66.02 64.99 1diq s SER 153 CO -0.00 -2.26 2.02 0.00 0.98 0.00 0.00 173.24 173.98 1diq h ALA 154 N -1.29 1.79 0.00 5.32 0.00 -1.93 -1.61 119.26 121.54 1diq h ALA 154 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1diq h ALA 154 Cb 1.28 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1diq h ALA 154 CO 0.58 0.15 0.00 -2.30 0.00 0.00 0.00 179.25 177.68 1diq n PRO 155 N -4.47 0.36 0.00 0.00 -0.02 -1.26 -4.56 135.00 125.05 1diq n PRO 155 Ca 0.06 0.05 0.00 0.00 -2.02 0.00 0.00 63.50 61.59 1diq n PRO 155 Cb 0.17 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.15 1diq n PRO 155 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1diq n SER 156 N -1.09 0.00 -0.35 2.55 3.41 -0.61 -1.12 113.62 116.41 1diq n SER 156 Ca 0.09 0.00 0.24 0.00 -0.26 0.00 0.00 58.87 58.94 1diq n SER 156 Cb 0.07 0.00 0.48 0.00 -0.26 0.00 0.00 64.21 64.50 1diq n SER 156 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1diq h ALA 157 N 0.00 2.08 0.00 7.33 0.00 -1.86 -1.40 119.26 125.41 1diq h ALA 157 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.04 1diq h ALA 157 Cb 0.00 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1diq h ALA 157 CO 0.00 -0.61 -1.21 0.44 0.00 0.00 0.00 179.25 177.88 1diq n ILE 158 N -4.86 0.45 -2.62 0.00 -5.35 -0.27 -2.98 119.36 103.73 1diq n ILE 158 Ca 0.30 -0.51 -0.23 0.00 -0.27 0.00 0.00 62.75 62.04 1diq n ILE 158 Cb 0.95 -0.22 0.11 0.00 -1.74 0.00 0.00 39.64 38.74 1diq n ILE 158 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 1diq s ALA 159 N -3.38 3.77 0.10 -1.28 0.00 -0.53 -4.88 121.76 115.57 1diq s ALA 159 Ca -0.02 -1.79 -0.02 0.00 0.00 0.00 0.00 51.96 50.13 1diq s ALA 159 Cb 0.11 -1.96 -0.04 0.00 0.00 0.00 0.00 23.12 21.24 1diq s ALA 159 CO 0.81 -1.46 0.05 0.20 0.00 0.00 0.00 175.76 175.36 1diq s GLY 160 N -4.75 0.72 0.11 0.00 0.00 -1.26 -0.50 107.32 101.64 1diq s GLY 160 Ca 0.67 -1.29 -0.21 0.00 0.00 0.00 0.00 44.72 43.88 1diq s GLY 160 CO 0.44 -1.28 1.73 -2.55 0.00 0.00 0.00 173.10 171.44 1diq h PRO 161 N 2.94 0.05 -0.37 2.90 0.11 -1.91 -2.94 132.00 132.78 1diq h PRO 161 Ca -0.34 -0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.76 1diq h PRO 161 Cb 1.18 -0.01 -0.02 0.00 0.11 0.00 0.00 31.00 32.26 1diq h PRO 161 CO 0.61 0.03 0.22 0.28 -0.21 0.00 0.00 178.00 178.93 1diq h VAL 162 N 0.05 1.12 -0.26 3.15 2.07 -1.86 -2.10 116.25 118.42 1diq h VAL 162 Ca 0.05 -0.27 -0.06 0.00 0.82 0.00 0.00 66.70 67.24 1diq h VAL 162 Cb 0.06 0.64 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1diq h VAL 162 CO -0.08 0.12 -0.07 1.23 0.02 0.00 0.00 177.57 178.78 1diq h GLY 163 N 0.48 0.55 1.22 2.17 0.00 -1.83 -1.94 103.07 103.72 1diq h GLY 163 Ca 0.13 -0.46 -0.08 0.00 0.00 0.00 0.00 47.33 46.92 1diq h GLY 163 CO -0.02 0.42 0.04 -0.57 0.00 0.00 0.00 176.54 176.41 1diq h ASN 164 N 0.25 0.91 1.15 0.19 -0.73 -1.52 -2.80 115.58 113.04 1diq h ASN 164 Ca 0.06 -0.22 -0.12 0.00 1.87 0.00 0.00 56.30 57.89 1diq h ASN 164 Cb 0.55 -0.24 -0.02 0.00 0.27 0.00 0.00 38.32 38.88 1diq h ASN 164 CO 0.03 0.95 -0.58 0.74 -0.37 0.00 0.00 177.43 178.20 1diq h THR 165 N 0.89 1.08 0.00 -3.57 2.02 -1.35 0.37 112.91 112.35 1diq h THR 165 Ca 0.17 -2.27 -0.10 0.00 0.77 0.00 0.00 66.41 64.99 1diq h THR 165 Cb 0.46 2.35 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 1diq h THR 165 CO 0.02 0.57 -0.47 0.24 0.37 0.00 0.00 175.52 176.25 1diq h MET 166 N 0.00 0.00 -0.49 6.66 2.86 -1.16 -1.68 114.93 121.11 1diq h MET 166 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 1diq h MET 166 Cb 1.31 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.97 1diq h MET 166 CO 0.08 0.47 0.00 -3.47 1.06 0.00 0.00 176.91 175.04 1diq n ASP 167 N -3.95 3.16 -3.74 1.22 2.03 -1.07 -0.69 116.55 113.52 1diq n ASP 167 Ca -0.02 -1.96 -0.22 0.00 0.52 0.00 0.00 54.79 53.11 1diq n ASP 167 Cb 0.49 -0.32 0.03 0.00 -0.72 0.00 0.00 41.12 40.60 1diq n ASP 167 CO 0.00 0.00 0.00 0.54 -1.92 0.00 0.00 177.20 175.82 1diq n ARG 168 N 1.25 -4.81 -1.31 -0.67 1.74 -0.63 -4.92 116.66 107.30 1diq n ARG 168 Ca 0.20 0.60 -0.29 0.00 -0.77 0.00 0.00 57.85 57.58 1diq n ARG 168 Cb 0.53 -5.14 0.20 0.00 -1.02 0.00 0.00 32.46 27.02 1diq n ARG 168 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1diq s GLY 169 N -4.30 1.60 0.03 -0.13 0.00 0.12 -4.91 107.32 99.74 1diq s GLY 169 Ca 0.05 -0.77 0.07 0.00 0.00 0.00 0.00 44.72 44.07 1diq s GLY 169 CO 0.82 -0.03 -0.21 -1.34 0.00 0.00 0.00 173.10 172.34 1diq s VAL 170 N -3.18 1.67 0.00 1.40 -7.23 -1.26 -3.59 120.40 108.20 1diq s VAL 170 Ca 0.69 -1.14 0.00 0.00 -1.81 0.00 0.00 61.98 59.71 1diq s VAL 170 Cb -0.12 -1.44 0.00 0.00 0.56 0.00 0.00 36.38 35.38 1diq s VAL 170 CO 0.55 0.26 0.00 0.61 -0.31 0.00 0.00 175.10 176.21 1diq n GLY 171 N 1.98 3.60 0.00 2.32 0.00 0.89 -4.06 105.19 109.92 1diq n GLY 171 Ca -0.17 -2.17 0.00 0.00 0.00 0.00 0.00 46.02 43.68 1diq n GLY 171 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1diq n TYR 172 N -0.31 0.00 -2.59 1.61 4.01 -1.26 -4.69 117.16 113.92 1diq n TYR 172 Ca 0.00 -0.04 -0.17 0.00 -0.16 0.00 0.00 57.90 57.53 1diq n TYR 172 Cb 0.00 -0.00 0.08 0.00 -0.31 0.00 0.00 39.34 39.11 1diq n TYR 172 CO 0.00 0.00 0.00 0.25 -0.46 0.00 0.00 176.86 176.65 1diq n THR 173 N -0.04 0.00 0.33 -0.72 -2.24 -1.26 -3.67 114.28 106.67 1diq n THR 173 Ca 0.00 -1.22 0.08 0.00 -2.27 0.00 0.00 64.05 60.64 1diq n THR 173 Cb 0.10 -0.96 0.34 0.00 -2.10 0.00 0.00 70.33 67.71 1diq n THR 173 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1diq n PRO 174 N -2.33 0.08 -1.22 -0.78 -0.02 -1.26 -1.92 135.00 127.54 1diq n PRO 174 Ca 0.12 0.40 -0.24 0.00 -2.02 0.00 0.00 63.50 61.77 1diq n PRO 174 Cb 0.45 -1.68 0.17 0.00 -0.02 0.00 0.00 33.50 32.42 1diq n PRO 174 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 1diq n TYR 175 N -1.83 2.97 -0.29 6.00 0.53 -1.26 -4.75 117.16 118.53 1diq n TYR 175 Ca 0.02 -2.00 -0.05 0.00 -1.02 0.00 0.00 57.90 54.85 1diq n TYR 175 Cb 0.14 -0.99 0.07 0.00 -1.03 0.00 0.00 39.34 37.53 1diq n TYR 175 CO 0.00 0.00 0.00 0.78 -1.02 0.00 0.00 176.86 176.62 1diq h GLY 176 N 1.15 1.15 -7.20 2.72 0.00 -1.66 -3.35 103.07 95.88 1diq h GLY 176 Ca 0.61 -0.50 -0.61 0.00 0.00 0.00 0.00 47.33 46.83 1diq h GLY 176 CO 1.13 0.48 1.32 1.85 0.00 0.00 0.00 176.54 181.31 1diq s GLU 177 N -5.92 3.53 0.33 4.80 2.56 -1.26 -0.08 118.70 122.66 1diq s GLU 177 Ca -0.13 -1.10 0.09 0.00 0.00 0.00 0.00 54.97 53.83 1diq s GLU 177 Cb 0.15 -5.12 0.83 0.00 2.00 0.00 0.00 34.13 31.99 1diq s GLU 177 CO 0.80 -2.12 1.80 0.45 -0.56 0.00 0.00 175.26 175.62 1diq h HIS 178 N 9.67 0.94 0.00 5.30 3.86 -1.69 -2.18 115.15 131.04 1diq h HIS 178 Ca 0.12 0.03 0.00 0.00 -1.16 0.00 0.00 60.37 59.36 1diq h HIS 178 Cb 1.02 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 29.21 1diq h HIS 178 CO 1.23 0.22 0.00 0.35 0.86 0.00 0.00 177.93 180.60 1diq h PHE 179 N 0.68 0.00 -0.01 2.45 3.04 -1.89 -2.74 116.94 118.48 1diq h PHE 179 Ca 0.55 0.00 -0.16 0.00 3.98 0.00 0.00 57.97 62.35 1diq h PHE 179 Cb 0.97 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.46 1diq h PHE 179 CO -0.00 0.00 -0.72 1.98 -2.02 0.00 0.00 178.31 177.55 1diq h MET 180 N 0.00 0.07 -0.02 1.11 4.05 -1.79 -3.13 114.93 115.22 1diq h MET 180 Ca 0.00 -0.06 0.00 0.00 -0.28 0.00 0.00 59.70 59.36 1diq h MET 180 Cb 0.65 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.47 1diq h MET 180 CO 0.00 0.75 -0.03 -1.33 0.23 0.00 0.00 176.91 176.53 1diq n MET 181 N -3.72 1.92 -2.38 0.39 2.81 -1.05 -4.92 117.12 110.17 1diq n MET 181 Ca -0.02 -1.40 -0.38 0.00 -1.81 0.00 0.00 57.70 54.10 1diq n MET 181 Cb 0.70 -1.47 -0.03 0.00 -0.71 0.00 0.00 33.22 31.71 1diq n MET 181 CO 0.00 0.00 0.00 -1.14 1.51 0.00 0.00 175.97 176.34 1diq s GLN 182 N -2.04 4.11 -0.28 0.03 -0.44 -1.08 -0.98 119.66 118.97 1diq s GLN 182 Ca 0.32 1.74 0.01 0.00 -2.50 0.00 0.00 55.36 54.93 1diq s GLN 182 Cb 0.20 -2.66 0.15 0.00 -1.64 0.00 0.00 33.01 29.07 1diq s GLN 182 CO 0.34 -0.24 0.39 0.00 0.50 0.00 0.00 175.29 176.27 1diq n GLY 184 N 5.35 -2.44 3.24 0.00 0.00 -1.25 -3.88 105.19 106.21 1diq n GLY 184 Ca -0.00 -1.10 -0.13 0.00 0.00 0.00 0.00 46.02 44.79 1diq n GLY 184 CO 0.00 0.00 0.00 -3.16 0.00 0.00 0.00 173.32 170.16 1diq s MET 185 N -4.69 0.72 -0.15 1.61 0.23 -1.26 -0.61 119.30 115.15 1diq s MET 185 Ca 0.00 -0.31 -0.03 0.00 -1.03 0.00 0.00 55.69 54.32 1diq s MET 185 Cb 0.00 0.31 -0.03 0.00 -1.53 0.00 0.00 34.83 33.59 1diq s MET 185 CO 0.00 -0.21 -0.05 -2.00 -2.03 0.00 0.00 175.02 170.73 1diq s GLU 186 N -1.78 3.60 -0.03 3.16 2.12 -0.02 -1.34 118.70 124.41 1diq s GLU 186 Ca -0.10 -0.54 0.04 0.00 0.36 0.00 0.00 54.97 54.73 1diq s GLU 186 Cb -0.04 -2.86 -0.01 0.00 0.26 0.00 0.00 34.13 31.48 1diq s GLU 186 CO 0.01 0.25 -0.15 0.08 -0.54 0.00 0.00 175.26 174.92 1diq s VAL 187 N 0.31 1.26 -0.29 3.70 1.01 0.11 -1.27 120.40 125.22 1diq s VAL 187 Ca -0.05 -0.65 -0.13 0.00 0.00 0.00 0.00 61.98 61.15 1diq s VAL 187 Cb -0.14 -1.07 -0.04 0.00 0.00 0.00 0.00 36.38 35.13 1diq s VAL 187 CO 0.03 0.36 0.28 -0.69 0.00 0.00 0.00 175.10 175.09 1diq s VAL 188 N -0.13 5.24 0.80 2.92 1.01 -0.49 -0.28 120.40 129.48 1diq s VAL 188 Ca 0.01 0.24 -0.12 0.00 0.00 0.00 0.00 61.98 62.11 1diq s VAL 188 Cb -0.09 -3.65 0.08 0.00 0.00 0.00 0.00 36.38 32.73 1diq s VAL 188 CO 0.01 0.14 1.17 -0.76 0.00 0.00 0.00 175.10 175.66 1diq s LEU 189 N 1.90 2.53 0.55 3.92 1.43 0.25 -1.56 118.68 127.69 1diq s LEU 189 Ca 0.10 0.75 0.27 0.00 -1.03 0.00 0.00 54.13 54.22 1diq s LEU 189 Cb -0.16 -3.25 1.57 0.00 0.03 0.00 0.00 46.19 44.38 1diq s LEU 189 CO 0.11 -1.89 2.15 0.00 0.23 0.00 0.00 176.35 176.94 1diq h ALA 190 N -1.03 1.44 -0.02 4.21 0.00 -1.82 -2.11 119.26 119.93 1diq h ALA 190 Ca -0.46 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.39 1diq h ALA 190 Cb 1.33 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.11 1diq h ALA 190 CO 0.65 0.09 0.00 0.27 0.00 0.00 0.00 179.25 180.26 1diq n ASN 191 N -3.81 1.00 0.00 0.00 0.23 -1.26 -4.83 115.26 106.59 1diq n ASN 191 Ca -0.02 -1.35 0.00 0.00 -0.53 0.00 0.00 54.58 52.68 1diq n ASN 191 Cb 0.17 -0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.86 1diq n ASN 191 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1diq n GLY 192 N 1.11 3.27 3.76 4.83 0.00 -0.79 -5.03 105.19 112.35 1diq n GLY 192 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1diq n GLY 192 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1diq s ASP 193 N -1.12 5.96 -0.40 1.61 -0.00 -1.26 -4.69 116.67 116.78 1diq s ASP 193 Ca 0.00 2.71 -0.13 0.00 -0.00 0.00 0.00 52.55 55.12 1diq s ASP 193 Cb 0.00 -2.64 0.02 0.00 -0.00 0.00 0.00 42.92 40.31 1diq s ASP 193 CO 0.00 -1.09 0.27 -0.69 -0.00 0.00 0.00 175.17 173.65 1diq s VAL 194 N -1.29 4.99 -0.13 -1.27 1.01 -1.26 -0.58 120.40 121.87 1diq s VAL 194 Ca 0.62 -0.76 -0.06 0.00 0.00 0.00 0.00 61.98 61.78 1diq s VAL 194 Cb -0.39 -3.79 -0.04 0.00 0.00 0.00 0.00 36.38 32.16 1diq s VAL 194 CO 0.49 -0.29 0.08 -0.47 0.00 0.00 0.00 175.10 174.91 1diq s TYR 195 N 1.63 3.37 -0.17 5.22 5.04 0.62 -4.96 117.35 128.10 1diq s TYR 195 Ca 0.04 0.29 0.01 0.00 -2.44 0.00 0.00 57.07 54.97 1diq s TYR 195 Cb -0.19 -1.96 0.02 0.00 0.35 0.00 0.00 41.96 40.18 1diq s TYR 195 CO 0.09 0.47 -0.18 1.03 -1.34 0.00 0.00 175.55 175.61 1diq s ARG 196 N -0.48 2.73 0.90 4.97 0.52 -1.26 0.06 118.95 126.39 1diq s ARG 196 Ca 0.11 -0.73 -0.12 0.00 -0.52 0.00 0.00 55.73 54.47 1diq s ARG 196 Cb -0.12 -2.39 0.13 0.00 0.52 0.00 0.00 34.95 33.09 1diq s ARG 196 CO 0.02 -0.21 1.10 0.95 0.02 0.00 0.00 175.30 177.18 1diq s THR 197 N 1.34 2.55 0.00 0.02 -4.23 -0.45 -3.79 115.64 111.07 1diq s THR 197 Ca 0.04 0.18 0.00 0.00 -1.18 0.00 0.00 61.69 60.73 1diq s THR 197 Cb -0.13 -2.72 0.00 0.00 1.34 0.00 0.00 72.50 70.99 1diq s THR 197 CO -0.12 -0.23 0.00 0.61 -0.54 0.00 0.00 174.62 174.34 1diq n GLY 198 N -1.34 3.94 0.81 3.99 0.00 -1.26 -2.15 105.19 109.18 1diq n GLY 198 Ca 0.07 0.20 0.11 0.00 0.00 0.00 0.00 46.02 46.39 1diq n GLY 198 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1diq n MET 199 N 12.16 2.06 0.19 1.61 2.81 -1.26 -4.38 117.12 130.30 1diq n MET 199 Ca 0.00 -1.60 0.04 0.00 -1.81 0.00 0.00 57.70 54.32 1diq n MET 199 Cb 0.00 -1.44 0.36 0.00 -0.71 0.00 0.00 33.22 31.43 1diq n MET 199 CO 0.00 0.00 0.00 0.78 1.51 0.00 0.00 175.97 178.26 1diq h GLY 200 N 4.83 0.00 2.00 3.03 0.00 -1.64 -2.98 103.07 108.30 1diq h GLY 200 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1diq h GLY 200 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 176.54 175.21 1diq h GLY 201 N 1.39 0.00 -5.33 4.60 0.00 -1.76 -3.43 103.07 98.53 1diq h GLY 201 Ca -0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1diq h GLY 201 CO 0.05 0.00 0.83 0.14 0.00 0.00 0.00 176.54 177.56 1diq s VAL 202 N -3.60 4.57 0.18 4.60 1.01 -1.13 -5.00 120.40 121.02 1diq s VAL 202 Ca 0.01 1.86 -0.31 0.00 0.00 0.00 0.00 61.98 63.54 1diq s VAL 202 Cb 0.09 -4.32 -0.10 0.00 0.00 0.00 0.00 36.38 32.05 1diq s VAL 202 CO 0.47 -0.30 1.53 -2.84 0.00 0.00 0.00 175.10 173.96 1diq s PRO 203 N 3.42 4.23 -0.15 2.72 0.02 -1.26 -2.56 135.00 141.42 1diq s PRO 203 Ca 0.46 2.32 0.00 0.00 0.02 0.00 0.00 61.00 63.80 1diq s PRO 203 Cb -0.14 -3.15 0.00 0.00 0.02 0.00 0.00 34.50 31.22 1diq s PRO 203 CO 0.11 -0.55 0.00 0.41 -0.33 0.00 0.00 177.00 176.63 1diq n GLY 204 N 3.41 0.49 3.76 0.52 0.00 -1.26 -5.02 105.19 107.09 1diq n GLY 204 Ca 0.12 -1.02 -0.39 0.00 0.00 0.00 0.00 46.02 44.73 1diq n GLY 204 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1diq s SER 205 N -2.98 7.26 -0.07 1.61 0.15 -1.06 -4.96 113.70 113.66 1diq s SER 205 Ca 0.00 2.15 0.10 0.00 0.70 0.00 0.00 55.95 58.90 1diq s SER 205 Cb 0.00 -2.61 0.15 0.00 -1.71 0.00 0.00 66.02 61.85 1diq s SER 205 CO 0.00 -0.14 1.07 -0.46 1.20 0.00 0.00 173.24 174.91 1diq n ASN 206 N 1.01 2.07 -0.47 5.45 6.94 -1.26 -4.74 115.26 124.26 1diq n ASN 206 Ca -0.00 -2.55 0.06 0.00 -0.02 0.00 0.00 54.58 52.07 1diq n ASN 206 Cb 0.46 -0.23 0.15 0.00 -2.36 0.00 0.00 39.78 37.80 1diq n ASN 206 CO 0.00 0.00 0.00 0.35 -1.03 0.00 0.00 177.26 176.58 1diq n THR 207 N -0.97 1.56 -0.37 5.53 -2.24 -1.26 -4.76 114.28 111.77 1diq n THR 207 Ca 0.08 -1.51 -0.02 0.00 -2.27 0.00 0.00 64.05 60.34 1diq n THR 207 Cb 0.48 0.13 0.11 0.00 -2.10 0.00 0.00 70.33 68.95 1diq n THR 207 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1diq h TRP 208 N 1.14 1.25 -0.60 4.78 7.01 -1.85 -1.88 115.95 125.81 1diq h TRP 208 Ca 0.00 0.03 0.00 0.00 2.11 0.00 0.00 58.89 61.03 1diq h TRP 208 Cb 0.95 -0.42 0.00 0.00 -2.10 0.00 0.00 29.16 27.59 1diq h TRP 208 CO 0.22 0.78 0.00 1.04 -2.79 0.00 0.00 178.44 177.69 1diq n GLN 209 N -4.40 3.51 -0.09 2.65 3.00 -1.26 -3.74 117.38 117.05 1diq n GLN 209 Ca 0.12 -2.79 -0.18 0.00 -0.01 0.00 0.00 57.00 54.15 1diq n GLN 209 Cb 0.02 -1.80 -0.06 0.00 0.00 0.00 0.00 30.24 28.40 1diq n GLN 209 CO 0.00 0.00 0.00 -0.89 0.00 0.00 0.00 177.06 176.17 1diq n ILE 210 N 0.98 1.27 -4.00 5.09 2.08 -0.74 -4.87 119.36 119.17 1diq n ILE 210 Ca 0.24 -0.13 -0.34 0.00 0.56 0.00 0.00 62.75 63.08 1diq n ILE 210 Cb 0.82 -1.92 -0.15 0.00 -0.75 0.00 0.00 39.64 37.64 1diq n ILE 210 CO 0.00 0.00 0.00 0.12 0.56 0.00 0.00 176.55 177.23 1diq s PHE 211 N -2.50 2.90 0.08 1.39 5.36 -1.00 -5.05 117.98 119.15 1diq s PHE 211 Ca -0.27 -1.15 -0.31 0.00 -0.96 0.00 0.00 56.93 54.24 1diq s PHE 211 Cb 0.09 -2.04 -0.17 0.00 -0.34 0.00 0.00 43.02 40.56 1diq s PHE 211 CO 0.36 -0.62 1.64 0.87 -1.46 0.00 0.00 175.22 176.02 1diq h LYS 212 N 8.01 -0.69 0.14 10.12 1.57 -1.88 -3.40 116.57 130.45 1diq h LYS 212 Ca -0.42 0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 1diq h LYS 212 Cb 1.16 0.16 0.00 0.00 0.08 0.00 0.00 32.23 33.62 1diq h LYS 212 CO 0.61 -0.46 -0.07 -1.49 -0.57 0.00 0.00 179.45 177.47 1diq h TRP 213 N -0.72 -0.18 0.00 -1.35 -0.00 -1.97 -3.38 115.95 108.36 1diq h TRP 213 Ca -0.06 -0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.82 1diq h TRP 213 Cb 0.57 0.06 0.00 0.00 -0.00 0.00 0.00 29.16 29.79 1diq h TRP 213 CO -0.07 0.20 0.00 0.41 -0.00 0.00 0.00 178.44 178.98 1diq n GLY 214 N -0.07 0.55 3.05 1.49 0.00 -1.26 -4.21 105.19 104.75 1diq n GLY 214 Ca -0.09 -0.99 -0.10 0.00 0.00 0.00 0.00 46.02 44.84 1diq n GLY 214 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1diq s TYR 215 N 0.00 0.12 0.00 1.61 6.14 -1.26 -5.02 117.35 118.95 1diq s TYR 215 Ca 0.00 -0.28 0.00 0.00 0.64 0.00 0.00 57.07 57.43 1diq s TYR 215 Cb 0.00 -0.10 0.00 0.00 0.42 0.00 0.00 41.96 42.28 1diq s TYR 215 CO 0.00 -0.25 0.00 0.41 0.64 0.00 0.00 175.55 176.35 1diq n GLY 216 N 1.54 -1.75 3.78 8.97 0.00 -1.26 -4.82 105.19 111.64 1diq n GLY 216 Ca -0.23 -1.34 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 1diq n GLY 216 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1diq s PRO 217 N 0.00 4.11 -0.43 1.61 0.04 -1.26 -4.95 135.00 134.12 1diq s PRO 217 Ca 0.00 2.53 -0.15 0.00 0.04 0.00 0.00 61.00 63.42 1diq s PRO 217 Cb 0.00 -2.96 0.04 0.00 0.04 0.00 0.00 34.50 31.62 1diq s PRO 217 CO 0.00 -0.52 0.32 -0.08 0.04 0.00 0.00 177.00 176.76 1diq s THR 218 N -1.13 5.16 -2.46 1.26 -1.32 -1.26 -4.96 115.64 110.93 1diq s THR 218 Ca 0.53 -0.83 0.24 0.00 -1.21 0.00 0.00 61.69 60.43 1diq s THR 218 Cb -0.46 -3.95 0.47 0.00 -1.51 0.00 0.00 72.50 67.06 1diq s THR 218 CO 0.62 -0.39 1.59 0.18 -2.21 0.00 0.00 174.62 174.41 1diq n LEU 219 N 5.15 1.86 -0.21 9.08 7.99 -1.26 -4.58 117.00 135.03 1diq n LEU 219 Ca -0.11 -0.70 0.02 0.00 -0.01 0.00 0.00 56.01 55.20 1diq n LEU 219 Cb 0.46 -0.06 0.13 0.00 -0.11 0.00 0.00 43.42 43.83 1diq n LEU 219 CO 0.42 0.35 0.93 0.44 -1.51 0.00 0.00 177.39 178.03 1diq h ASP 220 N 2.69 0.04 -0.05 -1.43 3.32 -1.95 -1.76 116.42 117.28 1diq h ASP 220 Ca 0.00 0.11 -0.02 0.00 0.02 0.00 0.00 57.03 57.14 1diq h ASP 220 Cb 0.58 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 40.27 1diq h ASP 220 CO 0.00 0.02 -0.01 1.23 -1.72 0.00 0.00 179.24 178.76 1diq h GLY 221 N 0.29 0.21 1.50 2.75 0.00 -1.95 -2.74 103.07 103.13 1diq h GLY 221 Ca 0.34 -0.10 -0.03 0.00 0.00 0.00 0.00 47.33 47.54 1diq h GLY 221 CO -0.41 0.09 0.17 1.98 0.00 0.00 0.00 176.54 178.37 1diq h MET 222 N 0.19 0.64 0.00 4.80 1.85 -1.62 -2.84 114.93 117.95 1diq h MET 222 Ca 0.05 -0.09 -0.05 0.00 -0.61 0.00 0.00 59.70 59.00 1diq h MET 222 Cb 0.16 -0.12 -0.01 0.00 0.43 0.00 0.00 31.60 32.06 1diq h MET 222 CO 0.00 0.54 -0.42 0.74 -0.40 0.00 0.00 176.91 177.38 1diq h PHE 223 N 0.63 0.00 -3.49 1.39 0.04 -1.48 -3.42 116.94 110.60 1diq h PHE 223 Ca 0.15 0.00 -0.52 0.00 2.80 0.00 0.00 57.97 60.40 1diq h PHE 223 Cb 0.15 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.29 1diq h PHE 223 CO 0.01 0.21 0.40 0.95 -0.60 0.00 0.00 178.31 179.27 1diq s THR 224 N -3.13 4.47 -1.45 -1.55 -4.23 -1.07 -3.06 115.64 105.61 1diq s THR 224 Ca 0.04 1.95 -0.06 0.00 -1.18 0.00 0.00 61.69 62.45 1diq s THR 224 Cb 0.07 -4.25 0.01 0.00 1.34 0.00 0.00 72.50 69.67 1diq s THR 224 CO 0.72 0.25 0.76 0.00 -0.54 0.00 0.00 174.62 175.81 1diq n GLN 225 N 3.12 -5.64 -4.17 3.99 6.02 0.14 -4.98 117.38 115.85 1diq n GLN 225 Ca 0.04 0.86 -0.13 0.00 -0.01 0.00 0.00 57.00 57.76 1diq n GLN 225 Cb 0.49 -5.71 -0.08 0.00 1.02 0.00 0.00 30.24 25.96 1diq n GLN 225 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1diq s ALA 226 N -3.21 0.99 -0.50 -1.58 0.00 -1.17 -4.64 121.76 111.65 1diq s ALA 226 Ca 0.38 -1.60 0.07 0.00 0.00 0.00 0.00 51.96 50.81 1diq s ALA 226 Cb -0.17 1.33 0.37 0.00 0.00 0.00 0.00 23.12 24.65 1diq s ALA 226 CO 0.46 -0.67 0.96 0.27 0.00 0.00 0.00 175.76 176.78 1diq n ASN 227 N -0.59 3.83 -0.42 0.00 0.23 -1.26 -4.78 115.26 112.27 1diq n ASN 227 Ca 0.02 -3.54 0.05 0.00 -0.53 0.00 0.00 54.58 50.58 1diq n ASN 227 Cb 0.64 -0.54 0.07 0.00 -2.08 0.00 0.00 39.78 37.87 1diq n ASN 227 CO 0.00 0.00 0.00 -1.22 -0.93 0.00 0.00 177.26 175.11 1diq n TYR 228 N -0.22 0.13 0.00 -2.53 4.01 -1.26 -4.76 117.16 112.54 1diq n TYR 228 Ca 0.31 -0.18 0.00 0.00 -0.16 0.00 0.00 57.90 57.87 1diq n TYR 228 Cb 0.52 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.54 1diq n TYR 228 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1diq n GLY 229 N 0.45 1.60 3.35 2.72 0.00 -1.26 -4.63 105.19 107.42 1diq n GLY 229 Ca 0.07 -0.79 -0.38 0.00 0.00 0.00 0.00 46.02 44.92 1diq n GLY 229 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1diq s ILE 230 N -2.00 4.17 -0.03 -0.61 1.01 -0.60 -4.91 121.20 118.22 1diq s ILE 230 Ca 0.00 -0.76 -0.30 0.00 0.00 0.00 0.00 60.65 59.59 1diq s ILE 230 Cb 0.00 -3.22 -0.05 0.00 0.01 0.00 0.00 42.46 39.20 1diq s ILE 230 CO 0.00 -0.03 1.44 0.00 0.00 0.00 0.00 174.94 176.35 1diq n THR 232 N 4.93 0.20 -3.80 0.00 -2.24 -0.40 -4.78 114.28 108.19 1diq n THR 232 Ca 0.14 -0.30 -0.13 0.00 -2.27 0.00 0.00 64.05 61.49 1diq n THR 232 Cb 0.44 -0.04 -0.12 0.00 -2.10 0.00 0.00 70.33 68.51 1diq n THR 232 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1diq s LYS 233 N -2.61 0.24 -0.05 -0.78 1.02 -1.20 -3.99 119.74 112.37 1diq s LYS 233 Ca -0.04 0.28 -0.04 0.00 0.02 0.00 0.00 55.97 56.19 1diq s LYS 233 Cb 0.06 0.12 0.02 0.00 -0.52 0.00 0.00 37.83 37.50 1diq s LYS 233 CO 0.44 -0.03 0.12 1.41 -0.92 0.00 0.00 175.35 176.38 1diq s MET 234 N 0.11 0.12 0.07 1.68 1.75 -0.56 -0.84 119.30 121.63 1diq s MET 234 Ca -0.00 0.22 0.06 0.00 -1.25 0.00 0.00 55.69 54.72 1diq s MET 234 Cb -0.01 -0.01 -0.04 0.00 2.84 0.00 0.00 34.83 37.61 1diq s MET 234 CO 0.00 -0.06 -0.11 0.20 -0.65 0.00 0.00 175.02 174.40 1diq s GLY 235 N 0.40 1.73 0.14 2.11 0.00 0.22 -1.20 107.32 110.73 1diq s GLY 235 Ca -0.03 -1.18 -0.15 0.00 0.00 0.00 0.00 44.72 43.36 1diq s GLY 235 CO -0.02 -1.11 0.40 -0.11 0.00 0.00 0.00 173.10 172.26 1diq s PHE 236 N -1.09 -0.08 0.07 1.90 -0.71 -0.21 -0.13 117.98 117.72 1diq s PHE 236 Ca 0.19 -0.26 -0.19 0.00 -1.04 0.00 0.00 56.93 55.63 1diq s PHE 236 Cb -0.11 0.22 -0.07 0.00 -1.21 0.00 0.00 43.02 41.86 1diq s PHE 236 CO 0.10 -0.74 0.55 -1.58 -1.34 0.00 0.00 175.22 172.21 1diq s TRP 237 N -3.85 3.79 -0.05 3.49 0.51 -0.16 -0.64 118.94 122.04 1diq s TRP 237 Ca 0.06 1.23 0.02 0.00 -2.12 0.00 0.00 56.10 55.29 1diq s TRP 237 Cb 0.02 -2.47 -0.03 0.00 -0.81 0.00 0.00 33.47 30.18 1diq s TRP 237 CO -0.08 0.59 -0.07 -0.51 -0.51 0.00 0.00 176.95 176.36 1diq s LEU 238 N -1.15 3.15 0.14 2.99 1.43 -0.71 -4.92 118.68 119.62 1diq s LEU 238 Ca 0.29 -0.07 -0.30 0.00 -1.03 0.00 0.00 54.13 53.02 1diq s LEU 238 Cb -0.19 -1.72 -0.07 0.00 0.03 0.00 0.00 46.19 44.24 1diq s LEU 238 CO 0.18 0.34 0.99 -0.32 0.23 0.00 0.00 176.35 177.78 1diq s MET 239 N -0.99 4.69 0.33 1.70 -2.45 -1.20 -4.65 119.30 116.75 1diq s MET 239 Ca 0.14 1.52 -0.27 0.00 -1.25 0.00 0.00 55.69 55.83 1diq s MET 239 Cb -0.11 -3.34 -0.09 0.00 1.25 0.00 0.00 34.83 32.54 1diq s MET 239 CO 0.03 0.22 1.11 -1.25 1.05 0.00 0.00 175.02 176.18 1diq s PRO 240 N -0.24 4.40 -0.03 4.11 0.04 -1.26 -0.55 135.00 141.46 1diq s PRO 240 Ca 0.47 1.77 -0.31 0.00 0.04 0.00 0.00 61.00 62.97 1diq s PRO 240 Cb -0.25 -2.93 -0.09 0.00 0.04 0.00 0.00 34.50 31.27 1diq s PRO 240 CO 0.31 0.00 2.00 1.17 0.04 0.00 0.00 177.00 180.53 1diq n LYS 241 N 0.65 2.56 -2.83 4.56 4.81 0.54 -4.74 118.16 123.71 1diq n LYS 241 Ca 0.01 0.91 -0.34 0.00 -0.87 0.00 0.00 58.31 58.02 1diq n LYS 241 Cb 0.46 -2.96 -0.07 0.00 0.02 0.00 0.00 35.03 32.48 1diq n LYS 241 CO 0.00 0.00 0.00 -1.25 1.17 0.00 0.00 177.40 177.32 1diq s PRO 242 N 4.72 4.34 0.30 1.64 0.04 -1.26 -4.98 135.00 139.80 1diq s PRO 242 Ca 0.92 1.16 0.02 0.00 0.04 0.00 0.00 61.00 63.14 1diq s PRO 242 Cb -0.48 -2.43 0.56 0.00 0.04 0.00 0.00 34.50 32.20 1diq s PRO 242 CO 0.43 0.10 1.89 -1.00 0.04 0.00 0.00 177.00 178.46 1diq h PRO 243 N 2.40 0.96 -4.93 0.56 0.13 -1.94 -3.43 132.00 125.75 1diq h PRO 243 Ca -0.48 -0.06 -0.45 0.00 -0.87 0.00 0.00 66.00 64.14 1diq h PRO 243 Cb 1.18 -0.22 -0.30 0.00 0.13 0.00 0.00 31.00 31.80 1diq h PRO 243 CO 0.63 0.64 -0.80 0.54 -0.23 0.00 0.00 178.00 178.77 1diq s VAL 244 N -5.89 0.93 -0.14 1.56 0.11 -0.72 -5.02 120.40 111.23 1diq s VAL 244 Ca -0.11 -0.48 0.01 0.00 -2.93 0.00 0.00 61.98 58.47 1diq s VAL 244 Cb 0.21 -0.79 0.02 0.00 -1.53 0.00 0.00 36.38 34.28 1diq s VAL 244 CO 0.80 0.27 -0.17 0.12 -3.33 0.00 0.00 175.10 172.79 1diq s PHE 245 N -0.11 2.32 -0.42 1.54 2.19 -1.26 -2.75 117.98 119.48 1diq s PHE 245 Ca 0.02 -1.23 0.03 0.00 0.33 0.00 0.00 56.93 56.08 1diq s PHE 245 Cb -0.06 -1.65 0.12 0.00 -1.31 0.00 0.00 43.02 40.12 1diq s PHE 245 CO 0.00 -0.62 0.16 0.21 1.83 0.00 0.00 175.22 176.80 1diq s LYS 246 N 1.14 1.57 0.38 10.12 2.20 -0.17 -5.00 119.74 129.97 1diq s LYS 246 Ca -0.01 -2.11 -0.16 0.00 -0.36 0.00 0.00 55.97 53.33 1diq s LYS 246 Cb -0.14 -3.00 -0.09 0.00 -1.51 0.00 0.00 37.83 33.09 1diq s LYS 246 CO -0.06 -1.04 0.82 -1.25 -0.36 0.00 0.00 175.35 173.45 1diq s PRO 247 N 0.43 4.03 0.19 4.03 0.04 -1.26 -1.58 135.00 140.88 1diq s PRO 247 Ca 0.14 0.78 -0.16 0.00 0.04 0.00 0.00 61.00 61.81 1diq s PRO 247 Cb -0.22 -2.34 0.02 0.00 0.04 0.00 0.00 34.50 32.00 1diq s PRO 247 CO -0.05 0.05 0.49 -0.59 0.04 0.00 0.00 177.00 176.93 1diq s PHE 248 N -2.14 -0.03 0.08 0.56 -0.12 -0.93 -4.06 117.98 111.35 1diq s PHE 248 Ca 0.56 -0.32 0.04 0.00 -0.05 0.00 0.00 56.93 57.16 1diq s PHE 248 Cb -0.10 0.32 -0.03 0.00 -0.63 0.00 0.00 43.02 42.58 1diq s PHE 248 CO 0.19 -0.89 -0.12 -2.00 -0.05 0.00 0.00 175.22 172.35 1diq s GLU 249 N -3.89 0.79 -0.20 1.99 2.12 -0.55 -1.63 118.70 117.32 1diq s GLU 249 Ca 0.11 -0.99 -0.03 0.00 0.36 0.00 0.00 54.97 54.42 1diq s GLU 249 Cb -0.00 -0.66 0.06 0.00 0.26 0.00 0.00 34.13 33.79 1diq s GLU 249 CO -0.02 0.13 0.04 0.08 -0.54 0.00 0.00 175.26 174.95 1diq s VAL 250 N -1.65 0.52 -0.15 3.70 1.01 -0.02 -1.61 120.40 122.21 1diq s VAL 250 Ca -0.01 -0.61 -0.20 0.00 0.00 0.00 0.00 61.98 61.16 1diq s VAL 250 Cb -0.08 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.21 1diq s VAL 250 CO 0.01 -0.25 0.58 -0.63 0.00 0.00 0.00 175.10 174.82 1diq s ILE 251 N 1.85 5.08 -0.02 2.22 1.01 0.06 -1.51 121.20 129.90 1diq s ILE 251 Ca -0.00 1.13 0.05 0.00 0.00 0.00 0.00 60.65 61.83 1diq s ILE 251 Cb -0.17 -3.91 -0.03 0.00 0.01 0.00 0.00 42.46 38.36 1diq s ILE 251 CO -0.10 0.20 -0.17 -0.36 0.00 0.00 0.00 174.94 174.52 1diq s PHE 252 N 1.34 2.61 -0.03 3.97 0.08 -0.05 -1.11 117.98 124.79 1diq s PHE 252 Ca 0.29 -0.22 -0.17 0.00 0.12 0.00 0.00 56.93 56.94 1diq s PHE 252 Cb -0.16 -1.56 -0.32 0.00 -0.57 0.00 0.00 43.02 40.41 1diq s PHE 252 CO 0.12 0.18 0.83 0.93 -0.10 0.00 0.00 175.22 177.17 1diq h GLU 253 N 5.12 0.38 -6.03 0.44 3.07 -1.94 0.26 114.58 115.88 1diq h GLU 253 Ca -0.46 -0.65 -0.60 0.00 -0.50 0.00 0.00 59.36 57.15 1diq h GLU 253 Cb 1.15 0.24 -0.04 0.00 -0.84 0.00 0.00 28.75 29.26 1diq h GLU 253 CO 0.49 1.31 -0.40 -0.51 -1.40 0.00 0.00 179.01 178.50 1diq s ASP 254 N -7.22 6.43 0.42 1.42 1.01 -1.26 -3.81 116.67 113.66 1diq s ASP 254 Ca -0.14 0.45 0.18 0.00 0.71 0.00 0.00 52.55 53.76 1diq s ASP 254 Cb 0.03 -2.03 0.92 0.00 1.01 0.00 0.00 42.92 42.84 1diq s ASP 254 CO 0.86 0.12 1.87 -0.08 0.21 0.00 0.00 175.17 178.15 1diq h GLU 255 N 3.03 0.00 -0.00 8.23 4.81 -1.91 -2.64 114.58 126.10 1diq h GLU 255 Ca -0.46 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 58.77 1diq h GLU 255 Cb 1.17 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.55 1diq h GLU 255 CO 0.74 0.30 -0.06 0.00 -0.73 0.00 0.00 179.01 179.25 1diq n ALA 256 N -2.37 2.61 0.39 2.92 0.00 -1.26 -3.65 120.51 119.15 1diq n ALA 256 Ca -0.01 -0.19 0.13 0.00 0.00 0.00 0.00 53.44 53.37 1diq n ALA 256 Cb 0.38 -1.42 0.52 0.00 0.00 0.00 0.00 19.45 18.93 1diq n ALA 256 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1diq h ASP 257 N 0.18 0.00 -1.00 0.00 3.32 -1.88 -3.28 116.42 113.77 1diq h ASP 257 Ca 0.00 0.00 0.21 0.00 0.02 0.00 0.00 57.03 57.26 1diq h ASP 257 Cb 0.34 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 39.79 1diq h ASP 257 CO 0.00 0.00 0.61 -0.29 -1.72 0.00 0.00 179.24 177.84 1diq h ILE 258 N 0.00 0.66 -0.46 0.35 6.09 -1.78 -2.25 117.51 120.12 1diq h ILE 258 Ca 0.00 -0.23 0.01 0.00 -1.37 0.00 0.00 64.86 63.27 1diq h ILE 258 Cb 0.40 -0.06 -0.02 0.00 0.47 0.00 0.00 36.82 37.61 1diq h ILE 258 CO 0.00 0.12 0.30 0.58 -3.07 0.00 0.00 178.15 176.08 1diq h VAL 259 N 0.66 1.11 0.00 2.19 2.07 -1.73 -2.14 116.25 118.42 1diq h VAL 259 Ca 0.58 -0.21 -0.15 0.00 0.82 0.00 0.00 66.70 67.74 1diq h VAL 259 Cb 1.04 0.44 -0.02 0.00 -1.52 0.00 0.00 31.29 31.24 1diq h VAL 259 CO -0.37 0.11 -0.73 -0.33 0.02 0.00 0.00 177.57 176.28 1diq h GLU 260 N 0.62 0.00 0.03 1.57 5.08 -1.68 -2.86 114.58 117.33 1diq h GLU 260 Ca 0.17 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.53 1diq h GLU 260 Cb -0.07 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.18 1diq h GLU 260 CO -0.04 0.73 -0.01 0.82 -1.00 0.00 0.00 179.01 179.50 1diq h ILE 261 N 0.00 1.24 -0.12 3.13 2.04 -1.18 -2.36 117.51 120.27 1diq h ILE 261 Ca -0.01 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 64.97 1diq h ILE 261 Cb 1.47 1.83 -0.01 0.00 -0.74 0.00 0.00 36.82 39.37 1diq h ILE 261 CO 0.09 0.22 0.06 0.58 0.00 0.00 0.00 178.15 179.10 1diq h VAL 262 N -0.43 1.12 0.00 1.67 2.07 -1.48 -0.89 116.25 118.31 1diq h VAL 262 Ca -0.00 -0.33 -0.04 0.00 0.82 0.00 0.00 66.70 67.15 1diq h VAL 262 Cb 0.40 1.13 -0.01 0.00 -1.52 0.00 0.00 31.29 31.29 1diq h VAL 262 CO 0.01 0.10 -0.17 0.44 0.02 0.00 0.00 177.57 177.97 1diq h ASP 263 N 0.07 0.00 0.69 0.57 3.32 -1.57 -1.48 116.42 118.00 1diq h ASP 263 Ca 0.04 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.84 1diq h ASP 263 Cb 0.11 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.62 1diq h ASP 263 CO -0.01 0.17 -1.44 0.00 -1.72 0.00 0.00 179.24 176.24 1diq h ALA 264 N 1.83 0.64 0.02 3.45 0.00 -1.26 -3.36 119.26 120.58 1diq h ALA 264 Ca -0.00 -1.23 -0.21 0.00 0.00 0.00 0.00 54.91 53.47 1diq h ALA 264 Cb 0.40 0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1diq h ALA 264 CO 0.02 1.42 -0.95 1.25 0.00 0.00 0.00 179.25 180.99 1diq h LEU 265 N 0.00 0.25 -0.30 0.00 5.85 -0.71 -3.38 115.31 117.03 1diq h LEU 265 Ca -0.19 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.38 1diq h LEU 265 Cb 1.89 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.78 1diq h LEU 265 CO 0.09 1.06 -0.18 -0.09 -0.34 0.00 0.00 178.44 178.99 1diq h ARG 266 N 0.09 -0.14 0.00 1.25 2.43 -1.43 -1.53 114.38 115.05 1diq h ARG 266 Ca -0.05 0.01 -0.02 0.00 -0.81 0.00 0.00 59.98 59.11 1diq h ARG 266 Cb 1.61 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 31.19 1diq h ARG 266 CO 0.14 -0.09 -0.08 -1.35 -1.51 0.00 0.00 179.97 177.09 1diq h PRO 267 N -0.14 0.00 0.01 0.20 0.11 -1.79 -0.70 132.00 129.69 1diq h PRO 267 Ca 0.16 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.07 1diq h PRO 267 Cb 0.38 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.47 1diq h PRO 267 CO -0.39 0.08 -0.94 -0.07 -0.21 0.00 0.00 178.00 176.47 1diq h LEU 268 N 0.00 0.05 0.21 2.35 3.38 -1.52 -2.45 115.31 117.33 1diq h LEU 268 Ca -0.00 -0.04 -0.29 0.00 0.09 0.00 0.00 57.88 57.64 1diq h LEU 268 Cb 0.24 -0.01 0.03 0.00 0.09 0.00 0.00 40.66 41.01 1diq h LEU 268 CO 0.01 0.96 -1.25 0.03 0.09 0.00 0.00 178.44 178.28 1diq h ARG 269 N 0.01 0.48 -0.34 1.13 2.47 -0.66 -1.05 114.38 116.43 1diq h ARG 269 Ca -0.02 -0.80 -0.09 0.00 -1.26 0.00 0.00 59.98 57.82 1diq h ARG 269 Cb 1.65 0.29 -0.02 0.00 -1.65 0.00 0.00 29.97 30.25 1diq h ARG 269 CO 0.13 1.38 -0.15 1.98 0.56 0.00 0.00 179.97 183.87 1diq h MET 270 N 0.00 0.61 -0.00 0.04 4.05 -1.22 -2.53 114.93 115.88 1diq h MET 270 Ca -0.22 -0.20 0.00 0.00 -0.28 0.00 0.00 59.70 59.01 1diq h MET 270 Cb 1.98 -0.05 0.00 0.00 -0.80 0.00 0.00 31.60 32.73 1diq h MET 270 CO 0.24 0.74 -0.17 -1.13 0.23 0.00 0.00 176.91 176.82 1diq n SER 271 N -4.17 0.54 -0.91 1.39 3.41 -0.92 -4.94 113.62 108.03 1diq n SER 271 Ca 0.01 -0.52 -0.11 0.00 -0.26 0.00 0.00 58.87 57.98 1diq n SER 271 Cb 0.36 -0.04 -0.05 0.00 -0.26 0.00 0.00 64.21 64.23 1diq n SER 271 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1diq n ASN 272 N -0.99 -4.32 0.00 4.04 5.15 -0.95 -4.92 115.26 113.27 1diq n ASN 272 Ca 0.13 0.26 -0.12 0.00 -0.60 0.00 0.00 54.58 54.24 1diq n ASN 272 Cb 0.30 -2.88 -0.08 0.00 -0.53 0.00 0.00 39.78 36.59 1diq n ASN 272 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 1diq h THR 273 N 0.00 1.20 -3.33 -0.44 2.02 -1.48 -3.27 112.91 107.61 1diq h THR 273 Ca -0.24 -0.60 -0.73 0.00 0.77 0.00 0.00 66.41 65.61 1diq h THR 273 Cb 0.78 1.56 -0.24 0.00 -1.74 0.00 0.00 68.15 68.51 1diq h THR 273 CO 0.34 0.16 -0.36 -0.63 0.37 0.00 0.00 175.52 175.40 1diq s ILE 274 N -5.21 4.98 -1.17 3.11 1.01 -0.80 -4.90 121.20 118.21 1diq s ILE 274 Ca -0.14 -1.16 0.27 0.00 0.00 0.00 0.00 60.65 59.61 1diq s ILE 274 Cb 0.04 -4.00 0.18 0.00 0.01 0.00 0.00 42.46 38.69 1diq s ILE 274 CO 0.67 -0.57 1.67 -0.81 0.00 0.00 0.00 174.94 175.90 1diq n PRO 275 N 5.13 0.19 -3.55 2.79 -0.04 -1.24 -4.35 135.00 133.93 1diq n PRO 275 Ca -0.12 -0.08 -0.19 0.00 -0.04 0.00 0.00 63.50 63.07 1diq n PRO 275 Cb 0.43 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.39 1diq n PRO 275 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1diq s ASN 276 N -2.87 5.97 -0.34 3.54 4.22 -1.26 -4.34 114.94 119.86 1diq s ASN 276 Ca 0.16 -0.18 -0.28 0.00 -2.14 0.00 0.00 52.86 50.42 1diq s ASN 276 Cb 0.19 -1.29 -0.01 0.00 1.28 0.00 0.00 41.25 41.42 1diq s ASN 276 CO 0.59 -0.38 1.74 -0.44 -2.04 0.00 0.00 177.10 176.57 1diq s SER 277 N -4.14 5.96 0.19 3.54 0.01 -1.20 -4.93 113.70 113.13 1diq s SER 277 Ca 0.43 1.25 -0.29 0.00 1.31 0.00 0.00 55.95 58.65 1diq s SER 277 Cb -0.09 -2.53 -0.08 0.00 0.21 0.00 0.00 66.02 63.53 1diq s SER 277 CO 0.31 -1.66 0.90 -0.69 0.41 0.00 0.00 173.24 172.51 1diq s VAL 278 N 6.66 4.26 -0.14 3.43 1.01 -1.08 -4.79 120.40 129.74 1diq s VAL 278 Ca 0.77 1.99 -0.02 0.00 0.00 0.00 0.00 61.98 64.72 1diq s VAL 278 Cb -0.21 -4.28 -0.02 0.00 0.00 0.00 0.00 36.38 31.86 1diq s VAL 278 CO 0.34 0.46 -0.07 -0.69 0.00 0.00 0.00 175.10 175.13 1diq s VAL 279 N -0.85 3.56 -0.48 2.92 1.01 -1.03 0.63 120.40 126.17 1diq s VAL 279 Ca 0.41 -0.48 0.01 0.00 0.00 0.00 0.00 61.98 61.92 1diq s VAL 279 Cb -0.25 -2.54 0.13 0.00 0.00 0.00 0.00 36.38 33.73 1diq s VAL 279 CO 0.30 0.51 0.25 -0.63 0.00 0.00 0.00 175.10 175.53 1diq s ILE 280 N 0.33 2.97 -0.04 2.22 1.01 -0.45 -0.65 121.20 126.60 1diq s ILE 280 Ca -0.07 -2.74 -0.20 0.00 0.00 0.00 0.00 60.65 57.64 1diq s ILE 280 Cb -0.15 -3.04 -0.05 0.00 0.01 0.00 0.00 42.46 39.24 1diq s ILE 280 CO 0.04 -0.75 0.56 0.00 0.00 0.00 0.00 174.94 174.79 1diq s ALA 281 N 0.34 3.48 0.84 9.38 0.00 0.55 -1.71 121.76 134.65 1diq s ALA 281 Ca 0.14 -0.03 -0.11 0.00 0.00 0.00 0.00 51.96 51.96 1diq s ALA 281 Cb -0.22 -2.72 0.10 0.00 0.00 0.00 0.00 23.12 20.28 1diq s ALA 281 CO -0.04 0.12 1.10 -1.54 0.00 0.00 0.00 175.76 175.40 1diq s SER 282 N 0.05 3.89 0.25 0.00 1.04 0.01 -0.77 113.70 118.19 1diq s SER 282 Ca 0.30 1.75 -0.03 0.00 0.48 0.00 0.00 55.95 58.45 1diq s SER 282 Cb -0.17 -2.41 0.45 0.00 0.10 0.00 0.00 66.02 63.99 1diq s SER 282 CO 0.15 -2.41 1.80 0.00 0.98 0.00 0.00 173.24 173.77 1diq h THR 283 N -1.39 0.88 -0.08 2.02 1.03 -1.58 -0.37 112.91 113.43 1diq h THR 283 Ca -0.46 -0.27 -0.13 0.00 -0.01 0.00 0.00 66.41 65.54 1diq h THR 283 Cb 1.25 0.02 -0.01 0.00 -1.07 0.00 0.00 68.15 68.34 1diq h THR 283 CO 0.51 0.14 -0.55 -0.07 -0.01 0.00 0.00 175.52 175.55 1diq h LEU 284 N 0.79 0.25 -0.08 0.00 4.07 -1.90 0.76 115.31 119.20 1diq h LEU 284 Ca 0.43 -0.13 -0.04 0.00 0.08 0.00 0.00 57.88 58.22 1diq h LEU 284 Cb 0.44 -0.07 -0.00 0.00 1.08 0.00 0.00 40.66 42.11 1diq h LEU 284 CO -0.27 0.75 -0.09 -0.25 -1.08 0.00 0.00 178.44 177.50 1diq h TRP 285 N 0.17 0.25 -0.70 1.13 2.91 -1.70 -1.72 115.95 116.29 1diq h TRP 285 Ca 0.00 -0.08 0.07 0.00 1.13 0.00 0.00 58.89 60.01 1diq h TRP 285 Cb 1.03 -0.05 -0.06 0.00 -0.51 0.00 0.00 29.16 29.57 1diq h TRP 285 CO 0.02 0.66 0.39 1.49 -1.03 0.00 0.00 178.44 179.97 1diq h GLU 286 N -0.24 0.69 0.06 2.65 4.57 -0.92 -1.89 114.58 119.50 1diq h GLU 286 Ca 0.01 -0.04 -0.00 0.00 -1.18 0.00 0.00 59.36 58.15 1diq h GLU 286 Cb 0.62 -0.16 0.00 0.00 -0.16 0.00 0.00 28.75 29.06 1diq h GLU 286 CO 0.02 0.45 -0.03 0.00 -1.18 0.00 0.00 179.01 178.28 1diq h ALA 287 N 1.37 -0.07 -0.93 2.92 0.00 -0.76 -2.21 119.26 119.58 1diq h ALA 287 Ca 0.32 -0.05 0.07 0.00 0.00 0.00 0.00 54.91 55.25 1diq h ALA 287 Cb 0.22 0.03 -0.06 0.00 0.00 0.00 0.00 17.79 17.98 1diq h ALA 287 CO -0.20 -0.50 0.60 0.78 0.00 0.00 0.00 179.25 179.93 1diq h GLY 288 N -0.16 1.37 2.00 0.00 0.00 -1.05 -1.28 103.07 103.96 1diq h GLY 288 Ca -0.01 -0.42 0.00 0.00 0.00 0.00 0.00 47.33 46.90 1diq h GLY 288 CO 0.01 0.29 0.00 1.48 0.00 0.00 0.00 176.54 178.32 1diq h SER 289 N 1.04 0.00 -0.15 0.19 4.64 -1.07 -2.48 113.55 115.72 1diq h SER 289 Ca 0.41 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.73 1diq h SER 289 Cb 0.23 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.32 1diq h SER 289 CO -0.16 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.80 1diq n ALA 290 N -2.02 2.50 -2.87 5.18 0.00 -0.53 -4.75 120.51 118.01 1diq n ALA 290 Ca 0.03 -0.63 -0.10 0.00 0.00 0.00 0.00 53.44 52.73 1diq n ALA 290 Cb 0.40 -1.01 0.03 0.00 0.00 0.00 0.00 19.45 18.86 1diq n ALA 290 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 1diq n HIS 291 N 0.72 -1.17 -3.68 0.00 8.25 -0.93 -4.97 115.22 113.44 1diq n HIS 291 Ca 0.17 0.39 -0.37 0.00 -0.26 0.00 0.00 57.72 57.65 1diq n HIS 291 Cb 0.44 -2.73 -0.07 0.00 1.12 0.00 0.00 29.99 28.76 1diq n HIS 291 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1diq s LEU 292 N -3.64 4.32 0.28 2.41 1.43 -0.89 -5.03 118.68 117.56 1diq s LEU 292 Ca 0.22 0.51 0.06 0.00 -1.03 0.00 0.00 54.13 53.89 1diq s LEU 292 Cb -0.10 -2.25 -0.02 0.00 0.03 0.00 0.00 46.19 43.84 1diq s LEU 292 CO 0.28 0.25 0.38 0.42 0.23 0.00 0.00 176.35 177.91 1diq s THR 293 N -0.27 4.69 0.16 5.49 -4.23 -1.26 -4.30 115.64 115.92 1diq s THR 293 Ca 0.15 -1.04 -0.07 0.00 -1.18 0.00 0.00 61.69 59.55 1diq s THR 293 Cb -0.13 -3.63 -0.08 0.00 1.34 0.00 0.00 72.50 70.00 1diq s THR 293 CO 0.04 -0.26 1.45 -0.09 -0.54 0.00 0.00 174.62 175.22 1diq h ARG 294 N 1.10 0.67 -0.02 3.99 2.43 -1.64 -3.24 114.38 117.67 1diq h ARG 294 Ca -0.49 -0.45 0.01 0.00 -0.81 0.00 0.00 59.98 58.24 1diq h ARG 294 Cb 1.24 0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.85 1diq h ARG 294 CO 0.58 1.07 0.05 0.00 -1.51 0.00 0.00 179.97 180.15 1diq h ALA 295 N 0.84 1.31 -0.34 2.80 0.00 -1.81 -0.29 119.26 121.77 1diq h ALA 295 Ca 0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1diq h ALA 295 Cb 1.16 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.95 1diq h ALA 295 CO 0.12 -0.06 0.00 0.00 0.00 0.00 0.00 179.25 179.31 1diq n GLN 296 N -3.43 2.05 0.00 0.00 10.64 -1.22 -4.12 117.38 121.29 1diq n GLN 296 Ca -0.02 -1.33 0.00 0.00 -1.83 0.00 0.00 57.00 53.82 1diq n GLN 296 Cb 0.13 -1.40 0.00 0.00 -0.86 0.00 0.00 30.24 28.11 1diq n GLN 296 CO 0.00 0.00 0.00 0.66 -1.83 0.00 0.00 177.06 175.89 1diq n TYR 297 N 0.49 0.00 -3.60 2.61 4.02 -0.23 -5.05 117.16 115.40 1diq n TYR 297 Ca 0.12 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.90 1diq n TYR 297 Cb 0.39 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.64 1diq n TYR 297 CO 0.00 0.00 0.00 -0.08 -1.01 0.00 0.00 176.86 175.77 1diq s THR 298 N -1.26 0.00 -0.23 -0.72 -1.32 -0.56 -5.04 115.64 106.51 1diq s THR 298 Ca 0.00 0.00 0.02 0.00 -1.21 0.00 0.00 61.69 60.50 1diq s THR 298 Cb 0.00 -1.00 0.03 0.00 -1.51 0.00 0.00 72.50 70.02 1diq s THR 298 CO 0.00 0.00 0.71 0.35 -2.21 0.00 0.00 174.62 173.47 1diq n THR 299 N 1.47 0.31 -2.03 5.08 -2.24 -1.26 -3.87 114.28 111.73 1diq n THR 299 Ca -0.12 -0.65 -0.41 0.00 -2.27 0.00 0.00 64.05 60.60 1diq n THR 299 Cb 0.57 0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 69.66 1diq n THR 299 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1diq s GLU 300 N -0.42 4.29 0.93 -0.78 2.56 -1.26 -5.01 118.70 119.01 1diq s GLU 300 Ca 0.03 2.30 -0.11 0.00 0.00 0.00 0.00 54.97 57.19 1diq s GLU 300 Cb 0.02 -3.06 0.15 0.00 2.00 0.00 0.00 34.13 33.24 1diq s GLU 300 CO 0.03 -0.31 1.09 -1.25 -0.56 0.00 0.00 175.26 174.26 1diq s PRO 301 N -1.47 0.95 1.24 4.30 0.04 -1.26 -4.87 135.00 133.93 1diq s PRO 301 Ca 0.52 0.91 0.00 0.00 0.04 0.00 0.00 61.00 62.48 1diq s PRO 301 Cb -0.41 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.36 1diq s PRO 301 CO 0.52 -2.48 0.00 0.41 0.04 0.00 0.00 177.00 175.49 1diq n GLY 302 N -0.72 -1.83 3.64 0.56 0.00 -1.26 -4.95 105.19 100.63 1diq n GLY 302 Ca 0.07 -1.47 -0.29 0.00 0.00 0.00 0.00 46.02 44.33 1diq n GLY 302 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1diq s HIS 303 N 0.00 1.95 -0.42 1.61 -3.43 -1.18 -4.78 115.29 109.04 1diq s HIS 303 Ca 0.00 1.08 -0.25 0.00 -0.80 0.00 0.00 55.06 55.09 1diq s HIS 303 Cb 0.00 -3.22 0.02 0.00 -1.43 0.00 0.00 32.58 27.95 1diq s HIS 303 CO 0.00 -3.05 0.91 0.99 -2.00 0.00 0.00 174.74 171.58 1diq s THR 304 N -2.85 4.54 0.70 -5.38 2.01 -1.26 -5.02 115.64 108.38 1diq s THR 304 Ca 0.66 0.92 -0.16 0.00 0.31 0.00 0.00 61.69 63.41 1diq s THR 304 Cb -0.20 -4.37 0.01 0.00 0.01 0.00 0.00 72.50 67.95 1diq s THR 304 CO 0.59 -0.68 1.11 -2.65 -0.69 0.00 0.00 174.62 172.30 1diq n PRO 305 N 6.93 0.71 0.08 4.92 -0.02 -1.26 -4.84 135.00 141.51 1diq n PRO 305 Ca 0.06 0.30 0.17 0.00 -2.02 0.00 0.00 63.50 62.01 1diq n PRO 305 Cb 0.48 -2.35 0.70 0.00 -0.02 0.00 0.00 33.50 32.31 1diq n PRO 305 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1diq h ASP 306 N -0.00 0.00 -0.48 2.55 5.19 -1.99 -1.89 116.42 119.79 1diq h ASP 306 Ca -0.49 0.00 -0.11 0.00 -0.62 0.00 0.00 57.03 55.82 1diq h ASP 306 Cb 1.34 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 40.83 1diq h ASP 306 CO 0.49 0.00 -0.12 0.77 -3.12 0.00 0.00 179.24 177.26 1diq h SER 307 N 0.00 0.95 1.79 6.45 4.64 -1.99 -1.35 113.55 124.04 1diq h SER 307 Ca 0.18 -0.36 -0.02 0.00 -0.47 0.00 0.00 61.79 61.11 1diq h SER 307 Cb 0.76 -0.26 -0.00 0.00 -0.31 0.00 0.00 62.40 62.58 1diq h SER 307 CO -0.00 1.09 -0.11 1.62 -0.87 0.00 0.00 176.83 178.56 1diq h VAL 308 N 0.79 0.20 0.05 0.95 3.04 -1.72 -2.16 116.25 117.40 1diq h VAL 308 Ca 0.12 -1.22 -0.27 0.00 -1.01 0.00 0.00 66.70 64.32 1diq h VAL 308 Cb 0.68 2.05 0.02 0.00 -2.01 0.00 0.00 31.29 32.03 1diq h VAL 308 CO 0.05 0.11 -1.11 0.40 -1.01 0.00 0.00 177.57 176.01 1diq h ILE 309 N 0.00 1.31 -0.10 3.17 2.04 -1.30 -0.61 117.51 122.01 1diq h ILE 309 Ca -0.00 -2.39 -0.09 0.00 1.00 0.00 0.00 64.86 63.38 1diq h ILE 309 Cb 1.04 2.52 -0.01 0.00 -0.74 0.00 0.00 36.82 39.62 1diq h ILE 309 CO 0.01 0.73 -0.35 0.11 0.00 0.00 0.00 178.15 178.65 1diq h LYS 310 N 0.32 0.20 -0.25 2.37 1.79 -1.19 -1.80 116.57 118.01 1diq h LYS 310 Ca -0.14 -0.08 -0.20 0.00 -2.18 0.00 0.00 60.65 58.05 1diq h LYS 310 Cb 1.77 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.41 1diq h LYS 310 CO 0.21 0.53 -0.62 0.37 -1.08 0.00 0.00 179.45 178.86 1diq h GLN 311 N 0.17 0.86 -0.50 3.15 5.75 -1.30 -3.01 115.11 120.23 1diq h GLN 311 Ca 0.02 -0.59 -0.00 0.00 -0.15 0.00 0.00 58.65 57.93 1diq h GLN 311 Cb 0.70 0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.32 1diq h GLN 311 CO 0.05 1.22 0.30 0.52 -2.65 0.00 0.00 178.83 178.27 1diq h MET 312 N 0.64 0.68 -0.25 1.69 2.86 -0.58 -2.39 114.93 117.57 1diq h MET 312 Ca -0.01 -0.05 -0.15 0.00 -2.06 0.00 0.00 59.70 57.43 1diq h MET 312 Cb 1.24 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.75 1diq h MET 312 CO 0.14 0.48 -0.46 1.96 1.06 0.00 0.00 176.91 180.08 1diq h GLN 313 N 0.69 0.64 -0.10 1.72 4.20 -1.23 -3.04 115.11 117.99 1diq h GLN 313 Ca 0.18 -0.36 -0.06 0.00 0.06 0.00 0.00 58.65 58.47 1diq h GLN 313 Cb -0.03 0.02 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1diq h GLN 313 CO -0.03 0.97 -0.19 0.87 -0.67 0.00 0.00 178.83 179.78 1diq h LYS 314 N 0.52 0.30 -0.04 1.46 1.57 -1.33 -0.71 116.57 118.34 1diq h LYS 314 Ca 0.03 -0.19 -0.06 0.00 -1.87 0.00 0.00 60.65 58.56 1diq h LYS 314 Cb 1.00 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.32 1diq h LYS 314 CO 0.09 0.78 -0.25 -0.44 -0.57 0.00 0.00 179.45 179.07 1diq h ASP 315 N -0.14 0.06 0.00 0.86 3.32 -1.51 -3.33 116.42 115.68 1diq h ASP 315 Ca 0.00 -0.02 -0.10 0.00 0.02 0.00 0.00 57.03 56.94 1diq h ASP 315 Cb 0.77 -0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 1diq h ASP 315 CO 0.04 0.32 -1.47 1.07 -1.72 0.00 0.00 179.24 177.47 1diq n THR 316 N -4.22 0.38 -0.16 0.35 5.66 -1.15 -5.04 114.28 110.10 1diq n THR 316 Ca -0.02 -0.28 0.00 0.00 -3.05 0.00 0.00 64.05 60.70 1diq n THR 316 Cb 0.32 -0.52 0.00 0.00 -1.55 0.00 0.00 70.33 68.58 1diq n THR 316 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1diq n GLY 317 N 2.42 0.85 3.85 1.09 0.00 -0.28 -5.08 105.19 108.03 1diq n GLY 317 Ca -0.09 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.61 1diq n GLY 317 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1diq s MET 318 N -0.84 3.48 0.33 1.61 -1.94 -1.22 -5.04 119.30 115.68 1diq s MET 318 Ca 0.00 0.85 0.03 0.00 -1.71 0.00 0.00 55.69 54.86 1diq s MET 318 Cb 0.00 -2.06 0.03 0.00 2.01 0.00 0.00 34.83 34.80 1diq s MET 318 CO 0.00 -0.66 0.23 0.41 -0.01 0.00 0.00 175.02 174.99 1diq n GLY 319 N -2.32 2.92 0.16 -0.03 0.00 -1.26 -4.62 105.19 100.03 1diq n GLY 319 Ca 0.07 -2.25 -0.06 0.00 0.00 0.00 0.00 46.02 43.78 1diq n GLY 319 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1diq h ALA 320 N 0.73 0.78 -3.43 4.61 0.00 -0.58 -3.33 119.26 118.04 1diq h ALA 320 Ca -0.21 -0.59 -0.39 0.00 0.00 0.00 0.00 54.91 53.72 1diq h ALA 320 Cb 0.76 -0.08 -0.35 0.00 0.00 0.00 0.00 17.79 18.12 1diq h ALA 320 CO 0.33 0.78 -0.76 -1.58 0.00 0.00 0.00 179.25 178.02 1diq s TRP 321 N -3.61 0.54 -0.25 0.00 0.52 -1.13 -2.33 118.94 112.68 1diq s TRP 321 Ca -0.03 -0.10 0.02 0.00 0.02 0.00 0.00 56.10 56.01 1diq s TRP 321 Cb 0.12 -0.59 0.06 0.00 -1.15 0.00 0.00 33.47 31.91 1diq s TRP 321 CO 0.80 -0.20 -0.09 -0.80 0.02 0.00 0.00 176.95 176.68 1diq s ASN 322 N 1.22 4.20 -0.15 2.95 0.01 0.05 -0.87 114.94 122.35 1diq s ASN 322 Ca -0.07 -1.30 -0.12 0.00 -0.71 0.00 0.00 52.86 50.66 1diq s ASN 322 Cb -0.13 -1.42 -0.05 0.00 0.41 0.00 0.00 41.25 40.05 1diq s ASN 322 CO -0.02 -0.20 0.25 -0.22 -1.51 0.00 0.00 177.10 175.40 1diq s LEU 323 N 1.20 4.27 -0.14 0.60 2.96 -0.57 -0.33 118.68 126.67 1diq s LEU 323 Ca -0.07 0.47 0.02 0.00 -0.22 0.00 0.00 54.13 54.33 1diq s LEU 323 Cb -0.19 -2.29 0.01 0.00 0.50 0.00 0.00 46.19 44.22 1diq s LEU 323 CO -0.06 0.17 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.62 1diq s TYR 324 N 0.15 2.68 0.37 5.38 2.02 0.18 -0.84 117.35 127.29 1diq s TYR 324 Ca 0.15 -1.35 0.06 0.00 -0.37 0.00 0.00 57.07 55.56 1diq s TYR 324 Cb -0.13 -1.83 -0.02 0.00 -0.40 0.00 0.00 41.96 39.58 1diq s TYR 324 CO 0.03 -0.62 0.22 0.00 -1.57 0.00 0.00 175.55 173.62 1diq n ALA 325 N 4.11 0.66 -3.59 3.71 0.00 -0.65 -2.46 120.51 122.29 1diq n ALA 325 Ca -0.20 -2.01 -0.15 0.00 0.00 0.00 0.00 53.44 51.08 1diq n ALA 325 Cb 0.51 1.51 -0.07 0.00 0.00 0.00 0.00 19.45 21.40 1diq n ALA 325 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1diq s ALA 326 N -3.25 -1.76 -0.10 0.00 0.00 -1.26 -2.18 121.76 113.21 1diq s ALA 326 Ca 0.32 1.79 -0.01 0.00 0.00 0.00 0.00 51.96 54.05 1diq s ALA 326 Cb 0.02 -0.79 -0.03 0.00 0.00 0.00 0.00 23.12 22.31 1diq s ALA 326 CO 0.22 -0.35 -0.03 -0.51 0.00 0.00 0.00 175.76 175.09 1diq s LEU 327 N -0.13 3.35 0.13 0.00 1.02 -0.61 -4.31 118.68 118.13 1diq s LEU 327 Ca -0.04 0.02 0.06 0.00 0.02 0.00 0.00 54.13 54.19 1diq s LEU 327 Cb -0.03 -1.77 -0.04 0.00 0.02 0.00 0.00 46.19 44.37 1diq s LEU 327 CO 0.04 0.32 -0.14 -0.31 0.02 0.00 0.00 176.35 176.28 1diq s TYR 328 N -0.53 1.41 -3.49 0.29 2.02 -1.26 -1.00 117.35 114.80 1diq s TYR 328 Ca 0.08 -0.58 0.00 0.00 -0.37 0.00 0.00 57.07 56.21 1diq s TYR 328 Cb -0.12 -0.73 0.00 0.00 -0.40 0.00 0.00 41.96 40.71 1diq s TYR 328 CO 0.02 0.15 0.00 0.41 -1.57 0.00 0.00 175.55 174.57 1diq n GLY 329 N 0.39 0.82 3.90 0.71 0.00 -1.11 -4.65 105.19 105.25 1diq n GLY 329 Ca -0.14 -1.98 -0.28 0.00 0.00 0.00 0.00 46.02 43.62 1diq n GLY 329 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1diq s THR 330 N -2.16 3.79 0.25 2.61 -4.23 -1.26 -1.75 115.64 112.88 1diq s THR 330 Ca 0.00 0.23 -0.03 0.00 -1.18 0.00 0.00 61.69 60.72 1diq s THR 330 Cb 0.00 -3.53 0.23 0.00 1.34 0.00 0.00 72.50 70.55 1diq s THR 330 CO 0.00 -0.60 1.82 -0.61 -0.54 0.00 0.00 174.62 174.69 1diq h GLN 331 N -0.30 0.82 -0.17 3.99 5.75 -1.95 0.02 115.11 123.26 1diq h GLN 331 Ca -0.45 -0.05 -0.13 0.00 -0.15 0.00 0.00 58.65 57.87 1diq h GLN 331 Cb 1.25 -0.18 -0.01 0.00 1.07 0.00 0.00 27.48 29.60 1diq h GLN 331 CO 0.62 0.54 -0.44 0.93 -2.65 0.00 0.00 178.83 177.83 1diq h GLU 332 N 0.84 0.40 -0.29 1.69 3.07 -1.99 -0.06 114.58 118.24 1diq h GLU 332 Ca 0.42 -0.21 -0.09 0.00 -0.50 0.00 0.00 59.36 58.99 1diq h GLU 332 Cb 0.40 0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1diq h GLU 332 CO -0.25 0.77 -0.16 1.96 -1.40 0.00 0.00 179.01 179.92 1diq h GLN 333 N 0.33 0.62 -0.51 2.33 4.20 -1.65 -2.73 115.11 117.70 1diq h GLN 333 Ca 0.02 -0.28 -0.11 0.00 0.06 0.00 0.00 58.65 58.34 1diq h GLN 333 Cb 0.91 -0.01 -0.02 0.00 0.30 0.00 0.00 27.48 28.66 1diq h GLN 333 CO 0.08 0.87 -0.13 0.28 -0.67 0.00 0.00 178.83 179.26 1diq h VAL 334 N 0.37 1.27 -0.59 -0.54 2.07 -0.83 -2.59 116.25 115.41 1diq h VAL 334 Ca 0.06 -1.27 -0.07 0.00 0.82 0.00 0.00 66.70 66.25 1diq h VAL 334 Cb 0.69 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 1diq h VAL 334 CO 0.05 0.44 0.10 0.44 0.02 0.00 0.00 177.57 178.62 1diq h ASP 335 N 0.86 0.88 0.80 0.57 3.32 -0.93 0.13 116.42 122.05 1diq h ASP 335 Ca 0.13 -0.19 -0.19 0.00 0.02 0.00 0.00 57.03 56.80 1diq h ASP 335 Cb 0.68 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.97 1diq h ASP 335 CO 0.05 0.89 -0.91 -0.37 -1.72 0.00 0.00 179.24 177.18 1diq h VAL 336 N 0.89 1.60 -0.01 -1.35 -1.51 -1.45 -2.47 116.25 111.93 1diq h VAL 336 Ca 0.18 -2.94 -0.18 0.00 -1.23 0.00 0.00 66.70 62.53 1diq h VAL 336 Cb 0.38 2.62 -0.01 0.00 -2.13 0.00 0.00 31.29 32.14 1diq h VAL 336 CO 0.01 0.85 -0.78 0.78 -1.23 0.00 0.00 177.57 177.19 1diq h ASN 337 N 0.03 0.19 -0.11 4.19 2.35 -1.26 -2.60 115.58 118.37 1diq h ASN 337 Ca -0.03 -0.14 -0.13 0.00 -0.55 0.00 0.00 56.30 55.45 1diq h ASN 337 Cb 1.58 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 39.88 1diq h ASN 337 CO 0.13 0.90 -0.36 -0.25 -1.65 0.00 0.00 177.43 176.19 1diq h TRP 338 N 0.10 0.74 -0.30 1.19 2.91 -0.67 -1.21 115.95 118.70 1diq h TRP 338 Ca -0.03 -0.20 -0.09 0.00 1.13 0.00 0.00 58.89 59.70 1diq h TRP 338 Cb 1.37 -0.16 -0.01 0.00 -0.51 0.00 0.00 29.16 29.84 1diq h TRP 338 CO 0.02 0.90 -0.21 -0.22 -1.03 0.00 0.00 178.44 177.90 1diq h LYS 339 N 0.52 0.56 -0.13 2.65 3.11 -1.35 -1.08 116.57 120.85 1diq h LYS 339 Ca 0.05 -0.20 -0.08 0.00 -2.81 0.00 0.00 60.65 57.60 1diq h LYS 339 Cb 0.87 -0.04 0.00 0.00 -1.00 0.00 0.00 32.23 32.06 1diq h LYS 339 CO 0.07 0.74 -0.25 0.82 -2.81 0.00 0.00 179.45 178.02 1diq h ILE 340 N 0.50 1.37 -0.34 2.00 2.04 -1.12 -2.61 117.51 119.35 1diq h ILE 340 Ca 0.08 -1.52 -0.04 0.00 1.00 0.00 0.00 64.86 64.38 1diq h ILE 340 Cb 0.64 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.75 1diq h ILE 340 CO 0.05 0.45 0.08 0.58 0.00 0.00 0.00 178.15 179.30 1diq h VAL 341 N -0.01 1.23 -0.62 1.67 2.07 -1.14 -2.77 116.25 116.67 1diq h VAL 341 Ca 0.01 -0.77 0.01 0.00 0.82 0.00 0.00 66.70 66.77 1diq h VAL 341 Cb 0.84 1.07 -0.03 0.00 -1.52 0.00 0.00 31.29 31.65 1diq h VAL 341 CO 0.06 0.26 0.40 0.74 0.02 0.00 0.00 177.57 179.05 1diq h THR 342 N 0.40 1.14 -0.35 2.57 2.02 -1.26 -2.59 112.91 114.84 1diq h THR 342 Ca 0.11 -0.28 -0.08 0.00 0.77 0.00 0.00 66.41 66.93 1diq h THR 342 Cb 0.31 0.25 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1diq h THR 342 CO 0.00 0.15 -0.11 0.44 0.37 0.00 0.00 175.52 176.37 1diq h ASP 343 N 0.82 0.59 -0.48 4.18 3.45 -1.42 -0.99 116.42 122.56 1diq h ASP 343 Ca 0.23 -0.16 -0.04 0.00 0.43 0.00 0.00 57.03 57.48 1diq h ASP 343 Cb -0.07 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 38.52 1diq h ASP 343 CO -0.06 0.74 0.13 0.58 -1.57 0.00 0.00 179.24 179.06 1diq h VAL 344 N 0.56 1.23 -0.02 -1.35 2.07 -1.19 -0.79 116.25 116.76 1diq h VAL 344 Ca 0.10 -0.81 -0.17 0.00 0.82 0.00 0.00 66.70 66.64 1diq h VAL 344 Cb 0.53 0.84 -0.01 0.00 -1.52 0.00 0.00 31.29 31.12 1diq h VAL 344 CO 0.03 0.29 -0.75 -0.26 0.02 0.00 0.00 177.57 176.90 1diq h PHE 345 N 0.65 0.24 -0.21 1.57 0.04 -1.27 -2.80 116.94 115.15 1diq h PHE 345 Ca 0.15 -0.11 -0.06 0.00 2.80 0.00 0.00 57.97 60.75 1diq h PHE 345 Cb 0.31 -0.03 -0.01 0.00 2.20 0.00 0.00 35.95 38.42 1diq h PHE 345 CO 0.02 0.86 -0.11 -0.22 -0.60 0.00 0.00 178.31 178.26 1diq h LYS 346 N 0.11 0.45 0.00 1.51 3.64 -1.03 -2.89 116.57 118.36 1diq h LYS 346 Ca -0.02 -0.20 -0.01 0.00 -1.27 0.00 0.00 60.65 59.15 1diq h LYS 346 Cb 1.32 -0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.13 1diq h LYS 346 CO 0.11 0.74 -0.02 0.87 -2.27 0.00 0.00 179.45 178.87 1diq h LYS 347 N 0.15 0.00 0.05 1.90 1.57 -1.12 -1.85 116.57 117.27 1diq h LYS 347 Ca 0.05 0.00 -0.26 0.00 -1.87 0.00 0.00 60.65 58.57 1diq h LYS 347 Cb 0.60 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.93 1diq h LYS 347 CO 0.03 0.02 -1.07 -0.07 -0.57 0.00 0.00 179.45 177.79 1diq h LEU 348 N 0.00 0.65 0.33 2.94 3.38 -1.29 -3.48 115.31 117.83 1diq h LEU 348 Ca -0.00 -0.56 -0.14 0.00 0.09 0.00 0.00 57.88 57.27 1diq h LEU 348 Cb 0.10 -0.20 0.01 0.00 0.09 0.00 0.00 40.66 40.67 1diq h LEU 348 CO 0.00 1.38 -0.21 0.61 0.09 0.00 0.00 178.44 180.31 1diq n GLY 349 N 1.15 0.20 3.17 0.83 0.00 -0.70 -5.04 105.19 104.81 1diq n GLY 349 Ca -0.09 -0.50 -0.12 0.00 0.00 0.00 0.00 46.02 45.31 1diq n GLY 349 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1diq s LYS 350 N -4.76 0.56 0.14 1.61 1.02 -1.26 -5.13 119.74 111.91 1diq s LYS 350 Ca 0.07 -0.22 0.00 0.00 0.02 0.00 0.00 55.97 55.84 1diq s LYS 350 Cb -0.03 0.24 0.00 0.00 -0.52 0.00 0.00 37.83 37.52 1diq s LYS 350 CO 0.09 -0.14 0.00 0.41 -0.92 0.00 0.00 175.35 174.79 1diq n GLY 351 N 1.51 -3.51 3.77 -3.33 0.00 -1.26 -4.86 105.19 97.52 1diq n GLY 351 Ca -0.21 -1.00 -0.38 0.00 0.00 0.00 0.00 46.02 44.43 1diq n GLY 351 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1diq s ARG 352 N -5.01 4.17 -0.24 1.61 3.52 -0.26 -4.87 118.95 117.86 1diq s ARG 352 Ca 0.00 0.43 -0.13 0.00 -0.13 0.00 0.00 55.73 55.90 1diq s ARG 352 Cb 0.00 -3.34 -0.04 0.00 -1.56 0.00 0.00 34.95 30.01 1diq s ARG 352 CO 0.00 0.40 0.29 0.42 -0.81 0.00 0.00 175.30 175.60 1diq s ILE 353 N -0.15 5.26 -0.12 4.11 1.01 -1.26 -0.76 121.20 129.29 1diq s ILE 353 Ca 0.25 0.44 0.03 0.00 0.00 0.00 0.00 60.65 61.36 1diq s ILE 353 Cb -0.16 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 38.69 1diq s ILE 353 CO 0.12 0.26 -0.22 0.54 0.00 0.00 0.00 174.94 175.64 1diq s VAL 354 N 1.44 2.20 0.56 2.92 0.11 -0.63 -5.02 120.40 121.98 1diq s VAL 354 Ca 0.13 -0.95 0.09 0.00 -2.93 0.00 0.00 61.98 58.31 1diq s VAL 354 Cb -0.15 -1.87 0.07 0.00 -1.53 0.00 0.00 36.38 32.91 1diq s VAL 354 CO 0.08 0.55 0.69 0.42 -3.33 0.00 0.00 175.10 173.50 1diq s THR 355 N 0.56 2.04 0.41 5.04 -4.23 -1.26 -1.48 115.64 116.71 1diq s THR 355 Ca -0.13 -1.13 0.27 0.00 -1.18 0.00 0.00 61.69 59.52 1diq s THR 355 Cb -0.17 -2.17 0.29 0.00 1.34 0.00 0.00 72.50 71.79 1diq s THR 355 CO 0.04 0.00 2.06 -0.61 -0.54 0.00 0.00 174.62 175.57 1diq h GLN 356 N 0.34 0.00 0.01 3.99 4.15 -1.98 -2.61 115.11 119.01 1diq h GLN 356 Ca -0.32 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 58.96 1diq h GLN 356 Cb 1.29 0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.99 1diq h GLN 356 CO 0.45 0.13 -0.57 0.93 -1.93 0.00 0.00 178.83 177.83 1diq h GLU 357 N 0.00 0.37 -0.24 1.69 4.39 -1.95 -0.87 114.58 117.97 1diq h GLU 357 Ca -0.00 -0.41 0.00 0.00 0.34 0.00 0.00 59.36 59.29 1diq h GLU 357 Cb 0.35 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.12 1diq h GLU 357 CO 0.02 1.09 0.00 -0.85 -1.16 0.00 0.00 179.01 178.11 1diq n GLU 358 N -4.25 1.83 0.00 2.33 0.28 -1.16 -4.37 120.64 115.31 1diq n GLU 358 Ca -0.11 -1.26 0.00 0.00 -0.16 0.00 0.00 57.16 55.63 1diq n GLU 358 Cb 0.66 -1.38 0.00 0.00 1.43 0.00 0.00 31.44 32.15 1diq n GLU 358 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1diq n ALA 359 N 0.49 2.99 0.00 -1.84 0.00 -1.00 -4.92 120.51 116.23 1diq n ALA 359 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.60 1diq n ALA 359 Cb 0.35 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.02 1diq n ALA 359 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1diq n GLY 360 N 2.15 0.25 0.30 0.00 0.00 -0.33 -1.25 105.19 106.31 1diq n GLY 360 Ca 0.00 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.16 1diq n GLY 360 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1diq n ASP 361 N 0.51 1.05 -4.86 1.61 10.43 -1.26 -4.39 116.55 119.64 1diq n ASP 361 Ca 0.00 -1.08 -0.32 0.00 2.57 0.00 0.00 54.79 55.96 1diq n ASP 361 Cb 0.00 0.04 -0.05 0.00 1.84 0.00 0.00 41.12 42.94 1diq n ASP 361 CO 0.00 0.00 0.00 0.28 -1.07 0.00 0.00 177.20 176.41 1diq s THR 362 N -2.27 4.70 0.15 -3.53 -1.32 -0.38 -4.88 115.64 108.11 1diq s THR 362 Ca 0.32 0.87 -0.02 0.00 -1.21 0.00 0.00 61.69 61.64 1diq s THR 362 Cb 0.20 -3.65 -0.05 0.00 -1.51 0.00 0.00 72.50 67.50 1diq s THR 362 CO 0.43 -0.29 0.35 -1.10 -2.21 0.00 0.00 174.62 171.80 1diq s GLN 363 N -3.26 3.55 0.00 7.08 -1.52 -1.26 -1.81 119.66 122.45 1diq s GLN 363 Ca 0.54 -0.24 0.30 0.00 -1.95 0.00 0.00 55.36 54.01 1diq s GLN 363 Cb -0.10 -2.87 1.49 0.00 -0.22 0.00 0.00 33.01 31.30 1diq s GLN 363 CO 0.22 0.46 2.00 -0.35 -0.25 0.00 0.00 175.29 177.37 1diq n PRO 364 N -0.16 1.00 -0.24 2.91 -0.04 -1.26 -4.91 135.00 132.30 1diq n PRO 364 Ca -0.04 -0.27 0.02 0.00 -0.04 0.00 0.00 63.50 63.17 1diq n PRO 364 Cb 0.52 -1.49 0.14 0.00 -0.04 0.00 0.00 33.50 32.63 1diq n PRO 364 CO 0.00 0.00 0.00 0.35 -0.04 0.00 0.00 175.50 175.81 1diq h PHE 365 N 0.67 0.53 -0.33 0.54 3.57 -1.94 -2.70 116.94 117.28 1diq h PHE 365 Ca 0.00 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.58 1diq h PHE 365 Cb 0.24 -0.13 -0.04 0.00 2.79 0.00 0.00 35.95 38.80 1diq h PHE 365 CO 0.00 0.15 0.07 -0.22 -2.23 0.00 0.00 178.31 176.08 1diq h LYS 366 N 0.50 0.18 -0.17 1.11 3.64 -1.56 -1.72 116.57 118.55 1diq h LYS 366 Ca 0.35 -0.01 -0.15 0.00 -1.27 0.00 0.00 60.65 59.57 1diq h LYS 366 Cb 0.44 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.21 1diq h LYS 366 CO -0.31 0.12 -0.53 0.10 -2.27 0.00 0.00 179.45 176.56 1diq h TYR 367 N 0.19 0.59 -0.51 1.91 -0.00 -1.78 -2.13 116.97 115.24 1diq h TYR 367 Ca 0.16 -0.20 -0.12 0.00 0.00 0.00 0.00 58.73 58.56 1diq h TYR 367 Cb 0.17 -0.11 -0.02 0.00 0.00 0.00 0.00 36.73 36.77 1diq h TYR 367 CO -0.18 0.90 -0.16 0.00 -0.00 0.00 0.00 178.16 178.73 1diq h ARG 368 N 0.37 1.00 -0.36 0.10 3.08 -1.41 0.60 114.38 117.77 1diq h ARG 368 Ca 0.01 -0.40 -0.06 0.00 0.07 0.00 0.00 59.98 59.60 1diq h ARG 368 Cb 1.05 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 31.03 1diq h ARG 368 CO 0.10 1.08 -0.05 0.00 -1.07 0.00 0.00 179.97 180.03 1diq h ALA 369 N 0.92 1.25 -0.21 0.04 0.00 -1.21 -0.93 119.26 119.12 1diq h ALA 369 Ca 0.13 -0.24 -0.13 0.00 0.00 0.00 0.00 54.91 54.67 1diq h ALA 369 Cb 0.73 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1diq h ALA 369 CO 0.06 0.49 -0.36 1.96 0.00 0.00 0.00 179.25 181.40 1diq h GLN 370 N 0.55 0.62 -0.36 0.00 4.20 -1.01 -3.01 115.11 116.09 1diq h GLN 370 Ca 0.11 -0.38 -0.05 0.00 0.06 0.00 0.00 58.65 58.39 1diq h GLN 370 Cb 0.42 0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.22 1diq h GLN 370 CO 0.02 0.99 0.01 -0.07 -0.67 0.00 0.00 178.83 179.11 1diq h LEU 371 N 0.30 0.52 -0.01 1.46 4.07 -0.48 0.25 115.31 121.43 1diq h LEU 371 Ca 0.01 -0.10 0.00 0.00 0.08 0.00 0.00 57.88 57.87 1diq h LEU 371 Cb 0.95 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.56 1diq h LEU 371 CO 0.08 0.59 -0.00 0.23 -1.08 0.00 0.00 178.44 178.26 1diq n MET 372 N -4.27 0.52 -0.06 1.13 2.81 -0.39 -3.20 117.12 113.65 1diq n MET 372 Ca 0.02 -0.01 0.02 0.00 -1.81 0.00 0.00 57.70 55.92 1diq n MET 372 Cb 0.25 -1.50 0.03 0.00 -0.71 0.00 0.00 33.22 31.29 1diq n MET 372 CO 0.00 0.00 0.00 -1.13 1.51 0.00 0.00 175.97 176.35 1diq n SER 373 N -1.23 1.53 -1.28 7.83 3.41 -0.84 -4.58 113.62 118.45 1diq n SER 373 Ca 0.16 -2.08 -0.10 0.00 -0.26 0.00 0.00 58.87 56.58 1diq n SER 373 Cb 0.22 -0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.05 1diq n SER 373 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1diq n GLY 374 N -0.59 -0.00 3.37 5.00 0.00 -0.77 -4.77 105.19 107.42 1diq n GLY 374 Ca 0.04 -0.43 -0.36 0.00 0.00 0.00 0.00 46.02 45.27 1diq n GLY 374 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1diq s VAL 375 N -2.61 3.91 0.44 1.61 1.01 0.01 -4.60 120.40 120.17 1diq s VAL 375 Ca 0.04 -0.45 -0.25 0.00 0.00 0.00 0.00 61.98 61.33 1diq s VAL 375 Cb -0.02 -2.88 -0.08 0.00 0.00 0.00 0.00 36.38 33.40 1diq s VAL 375 CO 0.06 0.28 1.29 -2.84 0.00 0.00 0.00 175.10 173.88 1diq s PRO 376 N 1.53 3.79 -0.12 2.72 0.02 -1.26 -3.96 135.00 137.72 1diq s PRO 376 Ca 0.05 2.10 -0.30 0.00 0.02 0.00 0.00 61.00 62.87 1diq s PRO 376 Cb -0.16 -2.61 0.11 0.00 0.02 0.00 0.00 34.50 31.87 1diq s PRO 376 CO 0.01 -0.62 0.92 0.54 -0.33 0.00 0.00 177.00 177.53 1diq s ASN 377 N -0.88 -0.43 -0.24 2.53 2.20 -1.26 -4.97 114.94 111.89 1diq s ASN 377 Ca 0.60 0.43 0.12 0.00 -0.94 0.00 0.00 52.86 53.08 1diq s ASN 377 Cb -0.37 0.36 0.48 0.00 -2.00 0.00 0.00 41.25 39.72 1diq s ASN 377 CO 0.46 -0.42 1.40 0.18 -2.94 0.00 0.00 177.10 175.78 1diq n LEU 378 N 0.69 3.77 -0.27 3.54 4.32 -1.26 -4.59 117.00 123.19 1diq n LEU 378 Ca -0.12 -3.53 0.09 0.00 -0.02 0.00 0.00 56.01 52.43 1diq n LEU 378 Cb 0.58 -0.58 0.33 0.00 -1.62 0.00 0.00 43.42 42.13 1diq n LEU 378 CO 0.17 1.07 1.23 -0.61 -1.22 0.00 0.00 177.39 178.03 1diq h GLN 379 N 1.10 0.78 0.00 3.23 5.75 -1.95 -2.04 115.11 121.97 1diq h GLN 379 Ca 0.13 -0.05 0.00 0.00 -0.15 0.00 0.00 58.65 58.58 1diq h GLN 379 Cb 1.49 -0.18 0.00 0.00 1.07 0.00 0.00 27.48 29.86 1diq h GLN 379 CO 0.28 0.51 0.00 -1.91 -2.65 0.00 0.00 178.83 175.06 1diq n GLU 380 N -4.54 0.00 0.00 1.69 2.13 -1.26 -2.54 120.64 116.12 1diq n GLU 380 Ca 0.16 0.36 0.09 0.00 0.66 0.00 0.00 57.16 58.43 1diq n GLU 380 Cb 0.36 -1.50 0.51 0.00 0.27 0.00 0.00 31.44 31.08 1diq n GLU 380 CO 0.00 0.00 0.00 1.19 -0.41 0.00 0.00 177.13 177.91 1diq n PHE 381 N -1.49 0.00 0.34 4.31 3.72 -0.77 -2.51 117.46 121.06 1diq n PHE 381 Ca 0.02 0.00 0.13 0.00 -0.05 0.00 0.00 57.45 57.55 1diq n PHE 381 Cb 0.09 -0.11 0.57 0.00 -0.94 0.00 0.00 39.48 39.10 1diq n PHE 381 CO 0.00 0.00 0.00 0.78 -0.05 0.00 0.00 176.76 177.49 1diq h GLY 382 N 2.88 0.00 2.00 1.37 0.00 -1.68 -2.21 103.07 105.42 1diq h GLY 382 Ca 0.00 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.31 1diq h GLY 382 CO 0.00 0.00 -0.08 1.41 0.00 0.00 0.00 176.54 177.87 1diq h LEU 383 N 0.00 0.00 -0.14 3.11 3.38 -1.54 -0.29 115.31 119.82 1diq h LEU 383 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1diq h LEU 383 Cb 0.33 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1diq h LEU 383 CO 0.00 0.08 -0.08 -1.22 0.09 0.00 0.00 178.44 177.31 1diq n TYR 384 N -4.01 0.00 0.99 1.13 4.01 -0.83 -2.95 117.16 115.49 1diq n TYR 384 Ca -0.03 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.82 1diq n TYR 384 Cb 0.17 -0.22 -0.12 0.00 -0.31 0.00 0.00 39.34 38.86 1diq n TYR 384 CO 0.00 0.00 0.00 0.09 -0.46 0.00 0.00 176.86 176.49 1diq n ASN 385 N -1.09 0.98 -0.30 7.72 3.02 -0.13 -2.63 115.26 122.82 1diq n ASN 385 Ca 0.14 -0.98 0.01 0.00 -0.03 0.00 0.00 54.58 53.73 1diq n ASN 385 Cb 0.27 1.01 0.15 0.00 -0.61 0.00 0.00 39.78 40.59 1diq n ASN 385 CO 0.00 0.00 0.00 -0.25 -2.62 0.00 0.00 177.26 174.39 1diq h TRP 386 N 0.00 0.94 0.00 3.10 2.91 -1.41 -3.31 115.95 118.17 1diq h TRP 386 Ca 0.00 0.03 0.00 0.00 1.13 0.00 0.00 58.89 60.05 1diq h TRP 386 Cb 0.51 -0.30 0.00 0.00 -0.51 0.00 0.00 29.16 28.86 1diq h TRP 386 CO 0.00 0.44 -0.55 0.54 -1.03 0.00 0.00 178.44 177.84 1diq n ARG 387 N -4.67 2.56 0.00 2.65 1.74 -1.26 -1.85 116.66 115.83 1diq n ARG 387 Ca 0.13 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.21 1diq n ARG 387 Cb 0.21 -0.76 0.00 0.00 -1.02 0.00 0.00 32.46 30.89 1diq n ARG 387 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1diq n GLY 388 N 1.42 -0.79 1.93 -0.13 0.00 -1.08 -4.81 105.19 101.73 1diq n GLY 388 Ca 0.00 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.91 1diq n GLY 388 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1diq n GLY 389 N 0.00 3.04 2.10 -0.02 0.00 -1.26 -4.02 105.19 105.02 1diq n GLY 389 Ca 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 46.02 45.98 1diq n GLY 389 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1diq n GLY 390 N -2.00 0.38 3.32 -0.02 0.00 -1.26 -3.06 105.19 102.55 1diq n GLY 390 Ca 0.00 -0.77 -0.35 0.00 0.00 0.00 0.00 46.02 44.89 1diq n GLY 390 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1diq s GLY 391 N -2.86 1.65 -0.20 -0.02 0.00 -1.08 -4.44 107.32 100.36 1diq s GLY 391 Ca 0.00 -1.22 -0.13 0.00 0.00 0.00 0.00 44.72 43.37 1diq s GLY 391 CO 0.00 0.47 0.51 -0.45 0.00 0.00 0.00 173.10 173.63 1diq s SER 392 N 1.49 -0.64 0.01 1.64 0.15 -0.79 -1.85 113.70 113.71 1diq s SER 392 Ca 0.05 1.09 0.02 0.00 0.70 0.00 0.00 55.95 57.81 1diq s SER 392 Cb -0.15 1.00 -0.01 0.00 -1.71 0.00 0.00 66.02 65.15 1diq s SER 392 CO -0.02 -0.20 -0.05 -0.04 1.20 0.00 0.00 173.24 174.13 1diq s MET 393 N 1.22 0.41 -0.30 5.44 -1.94 -0.79 -4.21 119.30 119.13 1diq s MET 393 Ca -0.08 -0.38 -0.12 0.00 -1.71 0.00 0.00 55.69 53.41 1diq s MET 393 Cb -0.06 -0.30 -0.04 0.00 2.01 0.00 0.00 34.83 36.44 1diq s MET 393 CO -0.12 0.07 0.20 -1.58 -0.01 0.00 0.00 175.02 173.59 1diq s TRP 394 N -0.60 3.22 -0.36 -0.03 0.52 -1.17 -1.05 118.94 119.48 1diq s TRP 394 Ca -0.03 0.00 -0.11 0.00 0.02 0.00 0.00 56.10 55.98 1diq s TRP 394 Cb -0.05 -2.41 0.01 0.00 -1.15 0.00 0.00 33.47 29.87 1diq s TRP 394 CO -0.00 -0.23 0.21 0.12 0.02 0.00 0.00 176.95 177.07 1diq s PHE 395 N 1.74 3.22 -0.57 -1.98 5.36 0.07 -4.75 117.98 121.07 1diq s PHE 395 Ca 0.07 -0.70 0.05 0.00 -0.96 0.00 0.00 56.93 55.39 1diq s PHE 395 Cb -0.16 -2.44 0.20 0.00 -0.34 0.00 0.00 43.02 40.27 1diq s PHE 395 CO 0.11 -0.55 0.52 0.00 -1.46 0.00 0.00 175.22 173.84 1diq n ALA 396 N 5.03 3.28 -1.35 11.12 0.00 -1.26 -0.29 120.51 137.05 1diq n ALA 396 Ca -0.12 -4.06 -0.30 0.00 0.00 0.00 0.00 53.44 48.95 1diq n ALA 396 Cb 0.48 -0.90 0.10 0.00 0.00 0.00 0.00 19.45 19.12 1diq n ALA 396 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 1diq s PRO 397 N -1.27 2.06 -0.12 0.00 0.04 -1.10 -2.67 135.00 131.93 1diq s PRO 397 Ca 0.32 0.94 -0.04 0.00 0.04 0.00 0.00 61.00 62.26 1diq s PRO 397 Cb 0.05 -1.89 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 1diq s PRO 397 CO -0.13 -1.72 0.03 0.08 0.04 0.00 0.00 177.00 175.30 1diq s VAL 398 N -2.98 4.53 0.11 -0.36 1.01 -1.05 -1.56 120.40 120.10 1diq s VAL 398 Ca 0.61 -0.15 -0.01 0.00 0.00 0.00 0.00 61.98 62.43 1diq s VAL 398 Cb -0.16 -2.95 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 1diq s VAL 398 CO 0.56 0.56 0.02 -0.94 0.00 0.00 0.00 175.10 175.30 1diq s SER 399 N -0.50 0.46 0.34 3.32 1.04 -0.97 -4.74 113.70 112.65 1diq s SER 399 Ca 0.09 -1.13 -0.27 0.00 0.48 0.00 0.00 55.95 55.12 1diq s SER 399 Cb -0.12 0.25 -0.09 0.00 0.10 0.00 0.00 66.02 66.15 1diq s SER 399 CO 0.02 -0.67 1.16 -0.70 0.98 0.00 0.00 173.24 174.03 1diq s GLU 400 N -3.99 4.34 -1.38 4.02 2.12 -1.26 -0.45 118.70 122.09 1diq s GLU 400 Ca 0.18 1.87 -0.09 0.00 0.36 0.00 0.00 54.97 57.29 1diq s GLU 400 Cb 0.07 -2.93 -0.11 0.00 0.26 0.00 0.00 34.13 31.43 1diq s GLU 400 CO -0.02 -0.08 2.98 0.00 -0.54 0.00 0.00 175.26 177.60 1diq n ALA 401 N 0.62 7.22 -3.62 6.30 0.00 -0.30 -4.62 120.51 126.11 1diq n ALA 401 Ca 0.01 -3.21 -0.27 0.00 0.00 0.00 0.00 53.44 49.97 1diq n ALA 401 Cb 0.45 -3.23 -0.17 0.00 0.00 0.00 0.00 19.45 16.51 1diq n ALA 401 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 1diq s ARG 402 N 2.12 2.03 0.31 0.00 3.52 -1.26 -4.77 118.95 120.89 1diq s ARG 402 Ca 0.67 -0.50 0.07 0.00 -0.13 0.00 0.00 55.73 55.85 1diq s ARG 402 Cb 0.19 -1.74 0.81 0.00 -1.56 0.00 0.00 34.95 32.65 1diq s ARG 402 CO -0.05 -0.06 1.73 0.78 -0.81 0.00 0.00 175.30 176.89 1diq h GLY 403 N 7.37 1.79 1.76 8.12 0.00 -1.86 -2.26 103.07 117.98 1diq h GLY 403 Ca -0.31 -0.29 -0.07 0.00 0.00 0.00 0.00 47.33 46.67 1diq h GLY 403 CO 0.48 -0.21 -0.21 1.48 0.00 0.00 0.00 176.54 178.08 1diq h SER 404 N 0.58 0.28 0.00 0.19 4.64 -1.93 -2.42 113.55 114.90 1diq h SER 404 Ca 0.61 -0.08 -0.19 0.00 -0.47 0.00 0.00 61.79 61.66 1diq h SER 404 Cb 1.10 -0.08 -0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1diq h SER 404 CO -0.46 0.51 -0.65 -0.33 -0.87 0.00 0.00 176.83 175.02 1diq h GLU 405 N 0.27 0.62 -0.41 4.77 4.39 -1.74 -1.66 114.58 120.81 1diq h GLU 405 Ca 0.05 -0.45 -0.11 0.00 0.34 0.00 0.00 59.36 59.19 1diq h GLU 405 Cb 0.52 0.07 -0.01 0.00 -0.10 0.00 0.00 28.75 29.24 1diq h GLU 405 CO 0.04 1.07 -0.19 0.00 -1.16 0.00 0.00 179.01 178.76 1diq h LYS 407 N 0.67 0.97 -0.30 0.00 3.64 -1.40 -0.92 116.57 119.23 1diq h LYS 407 Ca 0.09 -0.26 -0.03 0.00 -1.27 0.00 0.00 60.65 59.18 1diq h LYS 407 Cb 0.75 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 32.44 1diq h LYS 407 CO 0.06 0.92 0.06 -0.22 -2.27 0.00 0.00 179.45 178.00 1diq h LYS 408 N 0.87 0.49 -0.39 1.90 3.64 -1.16 -2.25 116.57 119.69 1diq h LYS 408 Ca 0.18 -0.13 -0.10 0.00 -1.27 0.00 0.00 60.65 59.33 1diq h LYS 408 Cb 0.41 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 32.16 1diq h LYS 408 CO 0.01 0.58 -0.17 1.96 -2.27 0.00 0.00 179.45 179.56 1diq h GLN 409 N 0.33 0.73 -0.14 1.90 4.20 -1.14 -2.19 115.11 118.80 1diq h GLN 409 Ca 0.09 -0.26 -0.01 0.00 0.06 0.00 0.00 58.65 58.54 1diq h GLN 409 Cb 0.31 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.04 1diq h GLN 409 CO 0.00 0.85 0.06 0.00 -0.67 0.00 0.00 178.83 179.08 1diq h ALA 410 N 1.16 0.18 -0.68 3.87 0.00 -1.08 -1.74 119.26 120.96 1diq h ALA 410 Ca 0.10 -0.08 -0.08 0.00 0.00 0.00 0.00 54.91 54.85 1diq h ALA 410 Cb 0.65 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 1diq h ALA 410 CO 0.05 -0.25 0.13 0.00 0.00 0.00 0.00 179.25 179.17 1diq h ALA 411 N 0.93 0.93 -0.44 0.00 0.00 -1.34 -1.44 119.26 117.89 1diq h ALA 411 Ca 0.05 -0.27 -0.04 0.00 0.00 0.00 0.00 54.91 54.65 1diq h ALA 411 Cb 0.13 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.64 1diq h ALA 411 CO -0.01 0.67 0.11 0.52 0.00 0.00 0.00 179.25 180.55 1diq h MET 412 N 1.05 0.70 0.10 0.00 2.07 -1.27 -2.60 114.93 114.98 1diq h MET 412 Ca 0.21 -0.16 -0.01 0.00 -2.07 0.00 0.00 59.70 57.67 1diq h MET 412 Cb 0.42 -0.09 0.00 0.00 -1.87 0.00 0.00 31.60 30.06 1diq h MET 412 CO 0.01 0.70 -0.05 0.00 1.07 0.00 0.00 176.91 178.64 1diq h ALA 413 N 0.97 -0.14 -1.00 6.32 0.00 -1.19 -3.03 119.26 121.20 1diq h ALA 413 Ca 0.14 -0.16 0.17 0.00 0.00 0.00 0.00 54.91 55.06 1diq h ALA 413 Cb 0.31 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 18.05 1diq h ALA 413 CO 0.00 -0.42 0.61 -0.22 0.00 0.00 0.00 179.25 179.22 1diq h LYS 414 N -0.45 0.79 0.04 0.00 3.64 -1.26 -1.24 116.57 118.09 1diq h LYS 414 Ca -0.01 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.32 1diq h LYS 414 Cb 0.37 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1diq h LYS 414 CO 0.02 0.52 -0.02 -0.09 -2.27 0.00 0.00 179.45 177.61 1diq h ARG 415 N 0.81 -0.06 -0.12 1.90 2.43 -1.47 -1.69 114.38 116.18 1diq h ARG 415 Ca 0.56 0.00 -0.08 0.00 -0.81 0.00 0.00 59.98 59.65 1diq h ARG 415 Cb 0.79 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.34 1diq h ARG 415 CO -0.36 0.29 -0.29 0.28 -1.51 0.00 0.00 179.97 178.39 1diq h VAL 416 N -0.42 1.26 -0.17 0.20 2.07 -1.31 -2.40 116.25 115.47 1diq h VAL 416 Ca -0.01 -1.21 -0.11 0.00 0.82 0.00 0.00 66.70 66.19 1diq h VAL 416 Cb 0.38 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 31.64 1diq h VAL 416 CO 0.01 0.37 -0.33 -0.07 0.02 0.00 0.00 177.57 177.57 1diq h LEU 417 N 0.20 0.59 -1.35 2.57 3.38 -1.22 -3.14 115.31 116.35 1diq h LEU 417 Ca 0.03 -0.55 -0.04 0.00 0.09 0.00 0.00 57.88 57.42 1diq h LEU 417 Cb 0.63 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.19 1diq h LEU 417 CO 0.05 1.02 0.02 0.45 0.09 0.00 0.00 178.44 180.07 1diq h HIS 418 N 0.18 0.46 -0.52 1.13 3.86 -1.18 -0.03 115.15 119.05 1diq h HIS 418 Ca 0.01 -0.04 0.08 0.00 -1.16 0.00 0.00 60.37 59.27 1diq h HIS 418 Cb 0.92 -0.14 -0.03 0.00 1.06 0.00 0.00 27.41 29.22 1diq h HIS 418 CO 0.09 0.45 0.35 -0.22 0.86 0.00 0.00 177.93 179.46 1diq h LYS 419 N 0.44 0.35 -0.54 2.45 3.64 -1.38 0.72 116.57 122.24 1diq h LYS 419 Ca 0.10 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1diq h LYS 419 Cb 0.26 -0.08 0.00 0.00 -0.41 0.00 0.00 32.23 32.01 1diq h LYS 419 CO 0.01 0.23 0.00 0.66 -2.27 0.00 0.00 179.45 178.08 1diq n TYR 420 N -4.47 1.18 -1.92 1.91 4.01 -0.79 -4.94 117.16 112.13 1diq n TYR 420 Ca 0.08 -0.62 -0.13 0.00 -0.16 0.00 0.00 57.90 57.07 1diq n TYR 420 Cb 0.33 -0.19 -0.02 0.00 -0.31 0.00 0.00 39.34 39.14 1diq n TYR 420 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1diq n GLY 421 N 0.82 0.39 3.84 2.72 0.00 0.25 -4.89 105.19 108.32 1diq n GLY 421 Ca 0.22 -0.39 -0.22 0.00 0.00 0.00 0.00 46.02 45.64 1diq n GLY 421 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1diq s LEU 422 N -3.34 3.35 0.29 0.99 2.01 -0.09 -3.10 118.68 118.80 1diq s LEU 422 Ca 0.00 -0.79 0.06 0.00 0.01 0.00 0.00 54.13 53.41 1diq s LEU 422 Cb 0.00 -1.94 -0.02 0.00 0.01 0.00 0.00 46.19 44.24 1diq s LEU 422 CO 0.00 -0.60 0.41 -1.81 1.01 0.00 0.00 176.35 175.37 1diq s ASP 423 N -4.07 6.11 -0.70 2.29 -0.00 -1.26 -3.49 116.67 115.56 1diq s ASP 423 Ca 0.46 -0.08 -0.13 0.00 -0.00 0.00 0.00 52.55 52.80 1diq s ASP 423 Cb -0.02 -1.52 0.18 0.00 -0.00 0.00 0.00 42.92 41.56 1diq s ASP 423 CO 0.27 -0.26 0.62 -0.47 -0.00 0.00 0.00 175.17 175.33 1diq s TYR 424 N -2.09 3.56 -0.36 4.23 6.14 -1.26 -4.81 117.35 122.77 1diq s TYR 424 Ca 0.40 -1.86 -0.00 0.00 0.64 0.00 0.00 57.07 56.24 1diq s TYR 424 Cb -0.09 -3.72 0.09 0.00 0.42 0.00 0.00 41.96 38.66 1diq s TYR 424 CO 0.30 -0.98 0.10 0.54 0.64 0.00 0.00 175.55 176.14 1diq s VAL 425 N 0.64 2.87 0.19 3.14 0.11 -1.26 -4.67 120.40 121.42 1diq s VAL 425 Ca 0.13 -1.98 -0.06 0.00 -2.93 0.00 0.00 61.98 57.14 1diq s VAL 425 Cb -0.18 -2.92 -0.02 0.00 -1.53 0.00 0.00 36.38 31.72 1diq s VAL 425 CO -0.04 -0.50 0.23 0.00 -3.33 0.00 0.00 175.10 171.46 1diq s ALA 426 N 1.09 0.49 0.01 1.54 0.00 -1.26 -1.17 121.76 122.45 1diq s ALA 426 Ca 0.05 -1.25 -0.19 0.00 0.00 0.00 0.00 51.96 50.57 1diq s ALA 426 Cb -0.21 1.08 0.04 0.00 0.00 0.00 0.00 23.12 24.03 1diq s ALA 426 CO -0.05 -0.64 0.41 -1.83 0.00 0.00 0.00 175.76 173.65 1diq s GLU 427 N -4.06 0.84 -0.18 0.00 -1.05 -0.58 -0.81 118.70 112.87 1diq s GLU 427 Ca 0.27 -0.19 -0.05 0.00 -0.15 0.00 0.00 54.97 54.84 1diq s GLU 427 Cb 0.04 0.38 -0.03 0.00 -0.44 0.00 0.00 34.13 34.08 1diq s GLU 427 CO 0.06 -0.26 0.01 -0.06 0.95 0.00 0.00 175.26 175.96 1diq s PHE 428 N -1.81 3.10 -0.32 4.83 0.08 -0.69 -0.70 117.98 122.47 1diq s PHE 428 Ca -0.09 -0.22 -0.09 0.00 0.12 0.00 0.00 56.93 56.65 1diq s PHE 428 Cb -0.02 -2.04 0.00 0.00 -0.57 0.00 0.00 43.02 40.38 1diq s PHE 428 CO 0.02 -0.04 0.15 0.42 -0.10 0.00 0.00 175.22 175.67 1diq s ILE 429 N 0.58 4.49 -0.20 0.64 1.01 -0.39 -1.34 121.20 125.99 1diq s ILE 429 Ca -0.00 -0.52 -0.11 0.00 0.00 0.00 0.00 60.65 60.02 1diq s ILE 429 Cb -0.14 -3.32 -0.05 0.00 0.01 0.00 0.00 42.46 38.96 1diq s ILE 429 CO 0.02 0.03 0.17 0.68 0.00 0.00 0.00 174.94 175.84 1diq s VAL 430 N 1.59 5.38 0.48 2.92 -7.23 0.21 -1.48 120.40 122.26 1diq s VAL 430 Ca 0.04 0.27 0.06 0.00 -1.81 0.00 0.00 61.98 60.54 1diq s VAL 430 Cb -0.17 -3.51 -0.00 0.00 0.56 0.00 0.00 36.38 33.25 1diq s VAL 430 CO 0.06 0.41 0.31 0.00 -0.31 0.00 0.00 175.10 175.57 1diq s ALA 431 N 0.52 4.11 0.23 1.32 0.00 -0.47 -2.64 121.76 124.82 1diq s ALA 431 Ca 0.10 -1.55 -0.06 0.00 0.00 0.00 0.00 51.96 50.44 1diq s ALA 431 Cb -0.12 -0.63 0.33 0.00 0.00 0.00 0.00 23.12 22.70 1diq s ALA 431 CO 0.00 -0.30 1.81 -1.35 0.00 0.00 0.00 175.76 175.92 1diq h PRO 432 N 1.03 0.72 0.00 0.00 0.11 -1.93 -3.34 132.00 128.58 1diq h PRO 432 Ca -0.40 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.67 1diq h PRO 432 Cb 1.28 -0.16 0.00 0.00 0.11 0.00 0.00 31.00 32.23 1diq h PRO 432 CO 0.62 0.47 -1.01 0.54 -0.21 0.00 0.00 178.00 178.42 1diq n ARG 433 N -4.77 1.36 -4.41 1.05 1.74 -1.26 -4.66 116.66 105.72 1diq n ARG 433 Ca 0.11 -0.04 -0.22 0.00 -0.77 0.00 0.00 57.85 56.94 1diq n ARG 433 Cb 0.23 -1.03 -0.10 0.00 -1.02 0.00 0.00 32.46 30.54 1diq n ARG 433 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 1diq s ASP 434 N -2.34 3.08 -0.03 0.55 -4.77 -1.26 -1.15 116.67 110.76 1diq s ASP 434 Ca -0.01 -1.01 0.07 0.00 -3.30 0.00 0.00 52.55 48.30 1diq s ASP 434 Cb 0.03 -0.22 -0.02 0.00 -1.09 0.00 0.00 42.92 41.63 1diq s ASP 434 CO 0.22 -0.05 -0.24 -0.04 0.70 0.00 0.00 175.17 175.75 1diq s MET 435 N -3.50 2.05 -0.59 2.11 -1.94 0.40 -1.37 119.30 116.46 1diq s MET 435 Ca 0.26 -0.86 -0.14 0.00 -1.71 0.00 0.00 55.69 53.24 1diq s MET 435 Cb -0.03 -1.92 0.15 0.00 2.01 0.00 0.00 34.83 35.03 1diq s MET 435 CO 0.11 0.48 0.53 -1.01 -0.01 0.00 0.00 175.02 175.12 1diq s HIS 436 N -0.47 3.38 -0.81 -0.03 3.76 -0.55 -2.30 115.29 118.28 1diq s HIS 436 Ca 0.06 -1.56 -0.26 0.00 -0.15 0.00 0.00 55.06 53.16 1diq s HIS 436 Cb -0.10 -3.74 0.04 0.00 1.11 0.00 0.00 32.58 29.88 1diq s HIS 436 CO 0.00 -1.01 1.31 -1.58 -0.85 0.00 0.00 174.74 172.61 1diq s HIS 437 N 1.23 2.38 -0.37 1.40 2.46 -0.60 -1.27 115.29 120.52 1diq s HIS 437 Ca 0.07 -0.31 -0.18 0.00 0.47 0.00 0.00 55.06 55.11 1diq s HIS 437 Cb -0.25 -4.63 0.00 0.00 -0.13 0.00 0.00 32.58 27.57 1diq s HIS 437 CO -0.00 -2.01 0.49 0.08 -2.47 0.00 0.00 174.74 170.83 1diq s VAL 438 N 5.41 5.03 -0.15 0.89 1.01 0.12 -2.72 120.40 129.99 1diq s VAL 438 Ca 0.37 0.14 -0.02 0.00 0.00 0.00 0.00 61.98 62.47 1diq s VAL 438 Cb -0.06 -3.98 -0.02 0.00 0.00 0.00 0.00 36.38 32.31 1diq s VAL 438 CO 0.08 -0.28 -0.09 -0.63 0.00 0.00 0.00 175.10 174.18 1diq s ILE 439 N 2.34 3.40 -0.49 2.22 1.01 0.60 -1.52 121.20 128.76 1diq s ILE 439 Ca 0.17 -0.53 -0.16 0.00 0.00 0.00 0.00 60.65 60.13 1diq s ILE 439 Cb -0.16 -2.47 0.08 0.00 0.01 0.00 0.00 42.46 39.92 1diq s ILE 439 CO 0.14 0.50 0.46 -0.62 0.00 0.00 0.00 174.94 175.42 1diq s ASP 440 N 0.48 6.17 -0.76 3.58 3.68 -0.32 -0.75 116.67 128.76 1diq s ASP 440 Ca -0.06 -1.32 -0.24 0.00 2.13 0.00 0.00 52.55 53.05 1diq s ASP 440 Cb -0.15 -2.21 0.06 0.00 -1.45 0.00 0.00 42.92 39.17 1diq s ASP 440 CO 0.04 -0.74 1.15 0.68 0.13 0.00 0.00 175.17 176.43 1diq s VAL 441 N 1.85 4.11 -0.09 1.11 -7.23 -0.21 -4.43 120.40 115.52 1diq s VAL 441 Ca 0.06 -0.27 -0.13 0.00 -1.81 0.00 0.00 61.98 59.83 1diq s VAL 441 Cb -0.24 -4.82 -0.05 0.00 0.56 0.00 0.00 36.38 31.83 1diq s VAL 441 CO 0.07 -1.66 0.33 -0.76 -0.31 0.00 0.00 175.10 172.77 1diq s LEU 442 N 4.61 4.36 0.28 1.32 1.43 -1.26 -1.88 118.68 127.54 1diq s LEU 442 Ca 0.31 0.71 -0.17 0.00 -1.03 0.00 0.00 54.13 53.95 1diq s LEU 442 Cb -0.11 -2.44 0.01 0.00 0.03 0.00 0.00 46.19 43.69 1diq s LEU 442 CO 0.07 0.23 0.62 -0.72 0.23 0.00 0.00 176.35 176.79 1diq s TYR 443 N -0.36 0.09 -0.41 0.29 1.13 -0.77 -4.68 117.35 112.62 1diq s TYR 443 Ca 0.20 -0.52 -0.19 0.00 -1.41 0.00 0.00 57.07 55.15 1diq s TYR 443 Cb -0.14 0.49 0.02 0.00 -1.10 0.00 0.00 41.96 41.23 1diq s TYR 443 CO 0.08 -1.17 0.53 0.34 -2.51 0.00 0.00 175.55 172.82 1diq s ASP 444 N -2.98 6.26 0.35 -0.18 -1.08 -1.26 -2.64 116.67 115.15 1diq s ASP 444 Ca 0.16 -0.43 0.26 0.00 -0.52 0.00 0.00 52.55 52.03 1diq s ASP 444 Cb -0.04 -2.27 0.86 0.00 -1.46 0.00 0.00 42.92 40.01 1diq s ASP 444 CO 0.09 -0.64 1.76 -0.09 0.52 0.00 0.00 175.17 176.81 1diq h ARG 445 N 8.74 0.00 0.00 4.34 2.43 -1.78 -3.06 114.38 125.05 1diq h ARG 445 Ca -0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 1diq h ARG 445 Cb 1.11 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1diq h ARG 445 CO 0.83 0.00 -0.11 0.25 -1.51 0.00 0.00 179.97 179.42 1diq n THR 446 N -2.63 0.46 -3.32 0.20 -2.24 -1.26 -4.57 114.28 100.92 1diq n THR 446 Ca 0.03 -0.24 -0.44 0.00 -2.27 0.00 0.00 64.05 61.14 1diq n THR 446 Cb 0.38 -0.48 -0.08 0.00 -2.10 0.00 0.00 70.33 68.06 1diq n THR 446 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1diq s ASN 447 N -4.23 6.17 0.56 3.42 3.84 -1.15 -4.98 114.94 118.57 1diq s ASN 447 Ca 0.10 -1.08 0.25 0.00 0.21 0.00 0.00 52.86 52.35 1diq s ASN 447 Cb 0.14 -2.22 1.63 0.00 -0.55 0.00 0.00 41.25 40.24 1diq s ASN 447 CO 0.61 -0.69 2.21 1.55 -2.79 0.00 0.00 177.10 177.99 1diq h PRO 448 N 8.81 0.00 -0.03 0.43 0.13 -1.85 -2.66 132.00 136.83 1diq h PRO 448 Ca -0.28 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.61 1diq h PRO 448 Cb 1.11 0.00 0.02 0.00 0.13 0.00 0.00 31.00 32.25 1diq h PRO 448 CO 0.88 0.02 -0.93 1.49 -0.23 0.00 0.00 178.00 179.22 1diq h GLU 449 N 0.00 0.68 0.00 0.86 4.22 -1.93 -2.94 114.58 115.47 1diq h GLU 449 Ca -0.00 -0.70 -0.07 0.00 0.08 0.00 0.00 59.36 58.68 1diq h GLU 449 Cb 0.04 0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1diq h GLU 449 CO 0.00 1.29 -0.32 1.49 -2.18 0.00 0.00 179.01 179.29 1diq h GLU 450 N 0.35 0.00 0.04 1.92 4.81 -1.77 -2.29 114.58 117.64 1diq h GLU 450 Ca -0.11 0.00 -0.25 0.00 -0.13 0.00 0.00 59.36 58.87 1diq h GLU 450 Cb 1.59 0.00 0.01 0.00 0.63 0.00 0.00 28.75 30.98 1diq h GLU 450 CO 0.19 0.32 -1.05 1.79 -0.73 0.00 0.00 179.01 179.53 1diq h THR 451 N 0.00 1.39 -0.32 0.32 1.35 -1.50 -1.43 112.91 112.71 1diq h THR 451 Ca -0.00 -2.53 -0.06 0.00 -0.55 0.00 0.00 66.41 63.27 1diq h THR 451 Cb 0.80 2.54 -0.02 0.00 -1.73 0.00 0.00 68.15 69.74 1diq h THR 451 CO 0.04 0.76 -0.04 0.50 -0.25 0.00 0.00 175.52 176.52 1diq h LYS 452 N 0.23 0.51 -0.19 4.72 1.63 -1.34 -1.47 116.57 120.65 1diq h LYS 452 Ca -0.11 -0.12 -0.14 0.00 -0.85 0.00 0.00 60.65 59.43 1diq h LYS 452 Cb 1.70 -0.07 0.00 0.00 -0.60 0.00 0.00 32.23 33.27 1diq h LYS 452 CO 0.19 0.57 -0.43 0.00 -3.45 0.00 0.00 179.45 176.32 1diq h ARG 453 N 0.48 0.63 -0.73 1.90 3.08 -1.34 -2.91 114.38 115.49 1diq h ARG 453 Ca 0.10 -0.42 -0.01 0.00 0.07 0.00 0.00 59.98 59.71 1diq h ARG 453 Cb 0.38 0.06 -0.04 0.00 0.08 0.00 0.00 29.97 30.46 1diq h ARG 453 CO 0.02 1.04 0.40 0.00 -1.07 0.00 0.00 179.97 180.36 1diq h ALA 454 N 0.59 1.33 -0.45 0.04 0.00 -0.83 0.11 119.26 120.05 1diq h ALA 454 Ca 0.00 -0.11 -0.11 0.00 0.00 0.00 0.00 54.91 54.70 1diq h ALA 454 Cb 1.04 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1diq h ALA 454 CO 0.09 0.55 -0.13 0.22 0.00 0.00 0.00 179.25 179.98 1diq h ASP 455 N 1.02 0.89 -0.28 0.00 3.58 -1.30 -1.24 116.42 119.10 1diq h ASP 455 Ca 0.26 -0.37 -0.15 0.00 0.42 0.00 0.00 57.03 57.19 1diq h ASP 455 Cb 0.02 -0.24 -0.01 0.00 1.72 0.00 0.00 39.33 40.82 1diq h ASP 455 CO -0.04 1.06 -0.36 0.00 -2.88 0.00 0.00 179.24 177.01 1diq h ALA 456 N 0.86 0.70 -0.71 -0.78 0.00 -1.26 -2.36 119.26 115.71 1diq h ALA 456 Ca 0.11 -0.44 -0.05 0.00 0.00 0.00 0.00 54.91 54.53 1diq h ALA 456 Cb 0.68 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 18.32 1diq h ALA 456 CO 0.05 0.66 0.25 0.00 0.00 0.00 0.00 179.25 180.21 1diq h PHE 458 N 1.04 0.94 -0.36 0.00 3.57 -1.07 -0.85 116.94 120.21 1diq h PHE 458 Ca 0.23 -0.20 -0.03 0.00 3.53 0.00 0.00 57.97 61.50 1diq h PHE 458 Cb 0.27 -0.23 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1diq h PHE 458 CO 0.02 0.94 0.10 -0.91 -2.23 0.00 0.00 178.31 176.23 1diq h ASN 459 N 0.74 0.53 0.10 0.41 4.21 -1.05 -2.36 115.58 118.17 1diq h ASN 459 Ca 0.11 -0.22 -0.09 0.00 1.21 0.00 0.00 56.30 57.32 1diq h ASN 459 Cb 0.68 -0.14 -0.01 0.00 -1.12 0.00 0.00 38.32 37.73 1diq h ASN 459 CO 0.05 0.61 -0.29 -0.08 -1.29 0.00 0.00 177.43 176.43 1diq h GLU 460 N 0.43 0.31 -0.65 0.81 4.81 -1.08 -0.48 114.58 118.72 1diq h GLU 460 Ca 0.11 -0.11 -0.06 0.00 -0.13 0.00 0.00 59.36 59.17 1diq h GLU 460 Cb 0.27 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 29.61 1diq h GLU 460 CO -0.00 0.57 0.18 -0.07 -0.73 0.00 0.00 179.01 178.97 1diq h LEU 461 N 0.27 0.96 -0.33 1.64 4.07 -0.99 0.25 115.31 121.17 1diq h LEU 461 Ca 0.04 -0.22 -0.19 0.00 0.08 0.00 0.00 57.88 57.59 1diq h LEU 461 Cb 0.66 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 42.15 1diq h LEU 461 CO 0.05 0.92 -0.61 -0.07 -1.08 0.00 0.00 178.44 177.66 1diq h LEU 462 N 0.94 0.85 -0.26 1.67 3.38 -0.95 -2.05 115.31 118.89 1diq h LEU 462 Ca 0.21 -0.48 -0.07 0.00 0.09 0.00 0.00 57.88 57.62 1diq h LEU 462 Cb 0.32 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.82 1diq h LEU 462 CO -0.00 1.26 -0.13 0.44 0.09 0.00 0.00 178.44 180.10 1diq h ASP 463 N 0.56 0.56 -0.68 -0.43 3.45 -0.80 -1.89 116.42 117.20 1diq h ASP 463 Ca -0.00 -0.41 -0.05 0.00 0.43 0.00 0.00 57.03 56.99 1diq h ASP 463 Cb 1.20 -0.15 -0.03 0.00 -0.56 0.00 0.00 39.33 39.79 1diq h ASP 463 CO 0.13 0.85 0.23 -0.33 -1.57 0.00 0.00 179.24 178.54 1diq h GLU 464 N 0.27 1.05 -0.04 3.56 4.39 -0.51 -2.78 114.58 120.52 1diq h GLU 464 Ca 0.06 -0.22 -0.20 0.00 0.34 0.00 0.00 59.36 59.34 1diq h GLU 464 Cb 0.64 -0.16 -0.00 0.00 -0.10 0.00 0.00 28.75 29.13 1diq h GLU 464 CO 0.04 0.90 -0.81 0.74 -1.16 0.00 0.00 179.01 178.72 1diq h PHE 465 N 0.99 0.51 -0.28 4.33 -1.00 -1.37 -3.21 116.94 116.90 1diq h PHE 465 Ca 0.22 -0.25 -0.09 0.00 2.81 0.00 0.00 57.97 60.67 1diq h PHE 465 Cb 0.28 -0.07 -0.01 0.00 3.61 0.00 0.00 35.95 39.75 1diq h PHE 465 CO 0.02 1.03 -0.19 1.49 -1.61 0.00 0.00 178.31 179.04 1diq h GLU 466 N 0.23 0.51 -0.53 1.51 4.81 -1.11 0.21 114.58 120.21 1diq h GLU 466 Ca -0.05 -0.17 -0.05 0.00 -0.13 0.00 0.00 59.36 58.97 1diq h GLU 466 Cb 1.41 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.72 1diq h GLU 466 CO 0.14 0.68 0.14 -0.22 -0.73 0.00 0.00 179.01 179.02 1diq h LYS 467 N 0.46 0.79 -0.45 1.92 3.64 -1.51 -1.16 116.57 120.26 1diq h LYS 467 Ca 0.08 -0.15 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1diq h LYS 467 Cb 0.60 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.29 1diq h LYS 467 CO 0.04 0.71 0.00 0.39 -2.27 0.00 0.00 179.45 178.32 1diq n GLU 468 N -4.29 2.08 -0.87 1.90 -0.58 -0.96 -4.91 120.64 113.02 1diq n GLU 468 Ca 0.04 -1.47 0.00 0.00 -0.42 0.00 0.00 57.16 55.31 1diq n GLU 468 Cb 0.21 -1.39 0.00 0.00 -0.57 0.00 0.00 31.44 29.69 1diq n GLU 468 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1diq n GLY 469 N 1.03 0.51 3.74 0.62 0.00 -0.44 -5.06 105.19 105.59 1diq n GLY 469 Ca 0.14 -0.48 -0.34 0.00 0.00 0.00 0.00 46.02 45.34 1diq n GLY 469 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1diq s TYR 470 N -2.00 3.23 0.17 1.61 4.12 0.69 -4.97 117.35 120.20 1diq s TYR 470 Ca 0.00 0.21 0.02 0.00 0.02 0.00 0.00 57.07 57.32 1diq s TYR 470 Cb 0.00 -1.76 -0.05 0.00 -1.52 0.00 0.00 41.96 38.63 1diq s TYR 470 CO 0.00 0.52 0.00 0.00 0.02 0.00 0.00 175.55 176.10 1diq s ALA 471 N -1.05 1.32 0.35 3.71 0.00 -1.26 -2.67 121.76 122.16 1diq s ALA 471 Ca 0.18 -1.58 -0.05 0.00 0.00 0.00 0.00 51.96 50.51 1diq s ALA 471 Cb -0.12 0.56 -0.05 0.00 0.00 0.00 0.00 23.12 23.51 1diq s ALA 471 CO 0.08 -0.33 0.62 0.14 0.00 0.00 0.00 175.76 176.28 1diq s VAL 472 N -3.68 4.98 -0.53 0.00 -7.23 -1.26 -2.52 120.40 110.17 1diq s VAL 472 Ca 0.24 0.07 0.23 0.00 -1.81 0.00 0.00 61.98 60.71 1diq s VAL 472 Cb 0.06 -3.78 -0.06 0.00 0.56 0.00 0.00 36.38 33.16 1diq s VAL 472 CO 0.04 -0.48 1.08 0.00 -0.31 0.00 0.00 175.10 175.43 1diq n TYR 473 N -1.36 0.45 -3.58 2.82 0.18 -1.09 -4.93 117.16 109.65 1diq n TYR 473 Ca -0.01 0.13 -0.13 0.00 1.88 0.00 0.00 57.90 59.77 1diq n TYR 473 Cb 0.54 -0.59 -0.06 0.00 -0.38 0.00 0.00 39.34 38.86 1diq n TYR 473 CO 0.00 0.00 0.00 0.50 -2.08 0.00 0.00 176.86 175.28 1diq s ARG 474 N -3.23 0.76 0.19 -3.48 3.52 -1.26 -5.04 118.95 110.40 1diq s ARG 474 Ca 0.03 0.37 -0.13 0.00 -0.13 0.00 0.00 55.73 55.87 1diq s ARG 474 Cb 0.13 0.36 0.01 0.00 -1.56 0.00 0.00 34.95 33.89 1diq s ARG 474 CO 0.78 -0.20 0.40 0.54 -0.81 0.00 0.00 175.30 176.01 1diq s VAL 475 N -0.71 0.04 0.78 7.11 0.11 -1.26 -4.59 120.40 121.88 1diq s VAL 475 Ca -0.04 -1.17 -0.11 0.00 -2.93 0.00 0.00 61.98 57.74 1diq s VAL 475 Cb -0.02 -1.80 0.06 0.00 -1.53 0.00 0.00 36.38 33.09 1diq s VAL 475 CO 0.03 -0.19 1.09 0.54 -3.33 0.00 0.00 175.10 173.24 1diq s ASN 476 N -2.94 4.44 0.43 3.54 4.22 -1.26 -4.81 114.94 118.56 1diq s ASN 476 Ca 0.15 1.79 0.16 0.00 -2.14 0.00 0.00 52.86 52.82 1diq s ASN 476 Cb 0.01 -2.49 1.06 0.00 1.28 0.00 0.00 41.25 41.11 1diq s ASN 476 CO 0.00 -2.07 1.92 0.71 -2.04 0.00 0.00 177.10 175.62 1diq h THR 477 N -1.15 0.79 0.00 0.54 1.35 -1.90 -1.49 112.91 111.05 1diq h THR 477 Ca -0.44 -0.14 -0.11 0.00 -0.55 0.00 0.00 66.41 65.17 1diq h THR 477 Cb 1.23 0.34 -0.02 0.00 -1.73 0.00 0.00 68.15 67.98 1diq h THR 477 CO 0.52 0.07 -0.51 -0.09 -0.25 0.00 0.00 175.52 175.26 1diq h ARG 478 N 0.41 0.00 -0.37 4.72 2.43 -1.91 -3.20 114.38 116.47 1diq h ARG 478 Ca 0.37 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.54 1diq h ARG 478 Cb 0.86 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.41 1diq h ARG 478 CO -0.12 0.51 0.00 1.19 -1.51 0.00 0.00 179.97 180.04 1diq n PHE 479 N -3.90 0.66 -0.13 2.20 3.72 -0.63 -4.70 117.46 114.68 1diq n PHE 479 Ca -0.01 -0.59 -0.01 0.00 -0.05 0.00 0.00 57.45 56.78 1diq n PHE 479 Cb 0.53 -0.10 0.23 0.00 -0.94 0.00 0.00 39.48 39.20 1diq n PHE 479 CO 0.00 0.00 0.00 1.96 -0.05 0.00 0.00 176.76 178.67 1diq h GLN 480 N 2.21 0.82 -0.08 -1.08 4.20 -1.38 -1.69 115.11 118.10 1diq h GLN 480 Ca 0.00 -0.13 -0.22 0.00 0.06 0.00 0.00 58.65 58.36 1diq h GLN 480 Cb 0.94 -0.14 0.01 0.00 0.30 0.00 0.00 27.48 28.59 1diq h GLN 480 CO 0.06 0.68 -0.83 0.22 -0.67 0.00 0.00 178.83 178.29 1diq h ASP 481 N 0.80 0.71 -0.31 1.46 3.58 -1.84 -2.75 116.42 118.08 1diq h ASP 481 Ca 0.19 -0.50 0.00 0.00 0.42 0.00 0.00 57.03 57.14 1diq h ASP 481 Cb 0.17 -0.21 -0.02 0.00 1.72 0.00 0.00 39.33 41.00 1diq h ASP 481 CO -0.02 1.28 0.20 -0.09 -2.88 0.00 0.00 179.24 177.73 1diq h ARG 482 N 0.37 0.41 0.00 0.28 9.65 -1.78 -2.60 114.38 120.71 1diq h ARG 482 Ca -0.06 -0.03 -0.09 0.00 -1.10 0.00 0.00 59.98 58.70 1diq h ARG 482 Cb 1.45 -0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.93 1diq h ARG 482 CO 0.16 0.28 -0.42 0.28 2.80 0.00 0.00 179.97 183.07 1diq h VAL 483 N 0.41 1.21 -0.06 0.20 2.07 -1.34 -2.49 116.25 116.25 1diq h VAL 483 Ca 0.11 -1.47 -0.01 0.00 0.82 0.00 0.00 66.70 66.16 1diq h VAL 483 Cb -0.03 1.81 -0.00 0.00 -1.52 0.00 0.00 31.29 31.54 1diq h VAL 483 CO -0.02 0.41 0.01 0.00 0.02 0.00 0.00 177.57 177.98 1diq h ALA 484 N 1.58 1.91 0.00 1.67 0.00 -1.15 -1.29 119.26 121.98 1diq h ALA 484 Ca -0.00 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.80 1diq h ALA 484 Cb 0.78 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.53 1diq h ALA 484 CO 0.05 0.08 -0.33 1.96 0.00 0.00 0.00 179.25 181.01 1diq h GLN 485 N 0.08 0.00 0.00 0.00 4.20 -1.34 -2.84 115.11 115.21 1diq h GLN 485 Ca 0.02 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.71 1diq h GLN 485 Cb 0.05 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.82 1diq h GLN 485 CO -0.00 0.33 -0.11 0.77 -0.67 0.00 0.00 178.83 179.15 1diq h SER 486 N 0.00 0.00 -0.57 1.46 0.02 -1.32 -2.95 113.55 110.19 1diq h SER 486 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1diq h SER 486 Cb 0.70 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.24 1diq h SER 486 CO 0.04 0.11 0.00 -1.22 -1.14 0.00 0.00 176.83 174.63 1diq n TYR 487 N -3.48 0.99 0.00 3.45 4.01 -1.07 -5.04 117.16 116.03 1diq n TYR 487 Ca -0.01 -0.44 0.00 0.00 -0.16 0.00 0.00 57.90 57.29 1diq n TYR 487 Cb 0.26 -0.10 0.00 0.00 -0.31 0.00 0.00 39.34 39.19 1diq n TYR 487 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1diq n GLY 488 N 1.23 -2.07 0.28 2.72 0.00 -1.12 -4.52 105.19 101.72 1diq n GLY 488 Ca 0.20 -1.49 -0.10 0.00 0.00 0.00 0.00 46.02 44.64 1diq n GLY 488 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1diq h PRO 489 N 0.00 0.97 -0.93 1.61 0.13 -1.91 -3.26 132.00 128.61 1diq h PRO 489 Ca 0.00 -0.39 0.06 0.00 -0.87 0.00 0.00 66.00 64.80 1diq h PRO 489 Cb 0.00 -0.05 -0.06 0.00 0.13 0.00 0.00 31.00 31.02 1diq h PRO 489 CO 0.00 1.06 0.59 0.28 -0.23 0.00 0.00 178.00 179.70 1diq h VAL 490 N 0.85 1.07 -0.17 1.56 2.07 -1.99 -0.19 116.25 119.44 1diq h VAL 490 Ca 0.12 -0.37 -0.01 0.00 0.82 0.00 0.00 66.70 67.26 1diq h VAL 490 Cb 0.74 -0.10 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1diq h VAL 490 CO 0.06 0.20 0.08 0.50 0.02 0.00 0.00 177.57 178.42 1diq h LYS 491 N 1.07 0.25 -0.54 1.57 3.64 -1.79 -1.25 116.57 119.51 1diq h LYS 491 Ca 0.40 -0.04 -0.05 0.00 -1.27 0.00 0.00 60.65 59.69 1diq h LYS 491 Cb 0.17 -0.04 -0.02 0.00 -0.41 0.00 0.00 32.23 31.92 1diq h LYS 491 CO -0.17 0.30 0.12 0.00 -2.27 0.00 0.00 179.45 177.43 1diq h ARG 492 N 0.14 0.85 -0.30 1.90 3.08 -1.49 -0.93 114.38 117.62 1diq h ARG 492 Ca 0.06 -0.18 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1diq h ARG 492 Cb 0.14 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.05 1diq h ARG 492 CO -0.01 0.77 0.12 -0.22 -1.07 0.00 0.00 179.97 179.57 1diq h LYS 493 N 0.81 0.44 -0.73 0.04 3.64 -0.83 -1.17 116.57 118.77 1diq h LYS 493 Ca 0.18 -0.08 -0.06 0.00 -1.27 0.00 0.00 60.65 59.42 1diq h LYS 493 Cb 0.32 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.04 1diq h LYS 493 CO 0.00 0.45 0.21 1.25 -2.27 0.00 0.00 179.45 179.09 1diq h LEU 494 N 0.33 1.06 -1.23 5.20 6.46 -0.76 -2.04 115.31 124.34 1diq h LEU 494 Ca 0.10 -0.21 -0.08 0.00 -0.12 0.00 0.00 57.88 57.58 1diq h LEU 494 Cb 0.17 -0.28 -0.01 0.00 -0.73 0.00 0.00 40.66 39.81 1diq h LEU 494 CO -0.01 1.00 -0.36 -0.33 -0.62 0.00 0.00 178.44 178.11 1diq h GLU 495 N 1.08 0.00 0.00 1.25 5.08 -0.82 -2.45 114.58 118.72 1diq h GLU 495 Ca 0.23 0.00 -0.13 0.00 -1.00 0.00 0.00 59.36 58.47 1diq h GLU 495 Cb 0.32 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.55 1diq h GLU 495 CO -0.00 0.36 -0.82 0.45 -1.00 0.00 0.00 179.01 178.00 1diq h HIS 496 N 0.00 0.00 -0.21 4.33 3.86 -0.87 -2.56 115.15 119.69 1diq h HIS 496 Ca -0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.13 1diq h HIS 496 Cb 0.71 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.17 1diq h HIS 496 CO 0.00 0.52 -0.18 0.00 0.86 0.00 0.00 177.93 179.13 1diq h ALA 497 N 1.48 0.31 -0.42 2.45 0.00 -1.10 -1.24 119.26 120.74 1diq h ALA 497 Ca -0.06 -0.34 -0.10 0.00 0.00 0.00 0.00 54.91 54.41 1diq h ALA 497 Cb 1.45 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 19.15 1diq h ALA 497 CO 0.06 0.23 -0.13 0.82 0.00 0.00 0.00 179.25 180.23 1diq h ILE 498 N 0.19 1.26 -0.67 0.00 2.04 -1.52 -2.80 117.51 116.00 1diq h ILE 498 Ca 0.04 -1.20 -0.08 0.00 1.00 0.00 0.00 64.86 64.62 1diq h ILE 498 Cb 0.72 1.07 -0.03 0.00 -0.74 0.00 0.00 36.82 37.85 1diq h ILE 498 CO 0.05 0.41 0.10 0.50 0.00 0.00 0.00 178.15 179.20 1diq h LYS 499 N 0.70 1.12 -0.28 2.37 1.63 -1.27 -1.49 116.57 119.36 1diq h LYS 499 Ca 0.11 -0.31 -0.08 0.00 -0.85 0.00 0.00 60.65 59.53 1diq h LYS 499 Cb 0.61 -0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 32.10 1diq h LYS 499 CO 0.04 1.03 -0.16 -0.09 -3.45 0.00 0.00 179.45 176.83 1diq h ARG 500 N 1.05 0.48 -0.03 1.90 2.43 -1.10 0.81 114.38 119.92 1diq h ARG 500 Ca 0.20 -0.15 -0.18 0.00 -0.81 0.00 0.00 59.98 59.05 1diq h ARG 500 Cb 0.46 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.95 1diq h ARG 500 CO 0.02 0.63 -0.77 0.00 -1.51 0.00 0.00 179.97 178.34 1diq h ALA 501 N 1.40 0.63 0.00 2.80 0.00 -1.20 -3.02 119.26 119.87 1diq h ALA 501 Ca 0.08 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.34 1diq h ALA 501 Cb 0.53 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1diq h ALA 501 CO 0.03 0.82 -1.35 1.33 0.00 0.00 0.00 179.25 180.09 1diq n VAL 502 N -3.76 0.00 -3.09 0.00 0.24 -0.60 -4.74 118.33 106.39 1diq n VAL 502 Ca -0.03 -0.28 -0.19 0.00 -2.04 0.00 0.00 64.34 61.79 1diq n VAL 502 Cb 0.73 0.43 -0.03 0.00 -1.47 0.00 0.00 33.84 33.49 1diq n VAL 502 CO 0.00 0.00 0.00 -0.67 -2.14 0.00 0.00 176.83 174.02 1diq n ASP 503 N -1.79 -0.39 0.07 -1.34 4.64 0.27 -3.98 116.55 114.03 1diq n ASP 503 Ca -0.01 -2.91 0.08 0.00 -1.38 0.00 0.00 54.79 50.56 1diq n ASP 503 Cb 0.32 -0.06 0.53 0.00 -1.04 0.00 0.00 41.12 40.87 1diq n ASP 503 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1diq h PRO 504 N 3.77 0.30 -0.02 -0.67 0.13 -1.65 -2.24 132.00 131.62 1diq h PRO 504 Ca 0.03 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1diq h PRO 504 Cb 0.93 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.00 1diq h PRO 504 CO 0.43 0.20 0.00 0.09 -0.23 0.00 0.00 178.00 178.49 1diq n ASN 505 N -4.49 0.48 -3.28 1.44 3.02 -1.26 -4.94 115.26 106.22 1diq n ASN 505 Ca 0.03 -1.29 -0.24 0.00 -0.03 0.00 0.00 54.58 53.04 1diq n ASN 505 Cb 0.15 -0.01 0.03 0.00 -0.61 0.00 0.00 39.78 39.34 1diq n ASN 505 CO 0.00 0.00 0.00 -3.20 -2.62 0.00 0.00 177.26 171.44 1diq n ASN 506 N -0.57 -5.44 0.06 6.41 5.15 -0.84 -4.93 115.26 115.10 1diq n ASN 506 Ca 0.19 -0.40 0.00 0.00 -0.60 0.00 0.00 54.58 53.78 1diq n ASN 506 Cb 0.17 -4.39 -0.06 0.00 -0.53 0.00 0.00 39.78 34.97 1diq n ASN 506 CO 0.00 0.00 0.00 0.16 1.40 0.00 0.00 177.26 178.82 1diq h ILE 507 N -1.54 0.61 -3.18 -1.44 3.07 -1.85 -3.41 117.51 109.77 1diq h ILE 507 Ca -0.52 -2.07 -0.59 0.00 1.55 0.00 0.00 64.86 63.23 1diq h ILE 507 Cb 1.35 2.14 -0.10 0.00 -0.27 0.00 0.00 36.82 39.94 1diq h ILE 507 CO 0.57 0.35 0.72 -0.76 -1.05 0.00 0.00 178.15 177.98 1diq s LEU 508 N -5.97 3.85 -0.53 0.16 1.43 -1.26 -0.82 118.68 115.55 1diq s LEU 508 Ca -0.01 -0.19 -0.14 0.00 -1.03 0.00 0.00 54.13 52.76 1diq s LEU 508 Cb 0.08 -2.94 0.02 0.00 0.03 0.00 0.00 46.19 43.38 1diq s LEU 508 CO 0.80 -1.33 0.30 0.00 0.23 0.00 0.00 176.35 176.35 1diq n ALA 509 N 7.85 -1.75 -1.72 4.21 0.00 0.21 -4.82 120.51 124.48 1diq n ALA 509 Ca 0.04 -0.25 -0.42 0.00 0.00 0.00 0.00 53.44 52.81 1diq n ALA 509 Cb 0.48 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.88 1diq n ALA 509 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1diq n PRO 510 N -2.60 2.74 0.00 0.00 -0.04 -1.26 -2.00 135.00 131.84 1diq n PRO 510 Ca -0.07 0.99 0.00 0.00 -0.04 0.00 0.00 63.50 64.38 1diq n PRO 510 Cb 0.27 -2.82 0.00 0.00 -0.04 0.00 0.00 33.50 30.90 1diq n PRO 510 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1diq n GLY 511 N 3.70 2.38 3.68 0.55 0.00 0.67 -4.69 105.19 111.48 1diq n GLY 511 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1diq n GLY 511 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1diq s ARG 512 N -0.52 4.15 -1.72 1.61 6.06 -0.84 -1.66 118.95 126.03 1diq s ARG 512 Ca 0.00 2.52 0.00 0.00 -2.50 0.00 0.00 55.73 55.75 1diq s ARG 512 Cb 0.00 -3.84 0.00 0.00 0.06 0.00 0.00 34.95 31.17 1diq s ARG 512 CO 0.00 -0.87 0.00 0.43 -2.50 0.00 0.00 175.30 172.36 1diq n SER 513 N 6.47 -4.70 -0.25 -2.12 7.64 -1.26 -1.26 113.62 118.14 1diq n SER 513 Ca 0.18 0.32 -0.03 0.00 1.01 0.00 0.00 58.87 60.35 1diq n SER 513 Cb 0.40 -4.14 -0.01 0.00 -1.01 0.00 0.00 64.21 59.45 1diq n SER 513 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1diq n GLY 514 N -0.51 0.58 3.44 0.23 0.00 -0.66 -4.72 105.19 103.55 1diq n GLY 514 Ca -0.18 -0.92 -0.40 0.00 0.00 0.00 0.00 46.02 44.52 1diq n GLY 514 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1diq s ILE 515 N -2.12 4.81 -0.21 -0.61 1.01 -0.39 -4.90 121.20 118.79 1diq s ILE 515 Ca 0.00 -0.56 -0.12 0.00 0.00 0.00 0.00 60.65 59.96 1diq s ILE 515 Cb 0.00 -3.57 0.07 0.00 0.01 0.00 0.00 42.46 38.97 1diq s ILE 515 CO 0.00 -0.10 0.52 -0.62 0.00 0.00 0.00 174.94 174.74 1diq s ASP 516 N 1.62 -0.68 0.14 3.58 3.68 -1.26 -0.24 116.67 123.52 1diq s ASP 516 Ca 0.04 1.13 0.19 0.00 2.13 0.00 0.00 52.55 56.04 1diq s ASP 516 Cb -0.18 1.02 0.80 0.00 -1.45 0.00 0.00 42.92 43.10 1diq s ASP 516 CO 0.08 -0.21 1.58 0.18 0.13 0.00 0.00 175.17 176.93 1diq n LEU 517 N 4.20 0.35 -0.04 -1.34 4.77 -1.26 -2.23 117.00 121.46 1diq n LEU 517 Ca -0.22 0.59 0.10 0.00 -0.03 0.00 0.00 56.01 56.46 1diq n LEU 517 Cb 0.57 -0.55 0.57 0.00 -2.33 0.00 0.00 43.42 41.68 1diq n LEU 517 CO 0.04 -0.44 0.87 0.59 -1.33 0.00 0.00 177.39 177.13 1diq n ASN 518 N -1.90 0.11 -4.95 -1.43 3.02 -1.26 -4.79 115.26 104.06 1diq n ASN 518 Ca 0.03 -1.40 -0.23 0.00 -0.03 0.00 0.00 54.58 52.95 1diq n ASN 518 Cb 0.19 -0.01 -0.00 0.00 -0.61 0.00 0.00 39.78 39.35 1diq n ASN 518 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1diq s ASN 519 N -1.62 6.09 -1.13 6.41 0.02 -0.95 -5.04 114.94 118.73 1diq s ASN 519 Ca 0.30 0.27 -0.08 0.00 -1.02 0.00 0.00 52.86 52.33 1diq s ASN 519 Cb 0.14 -1.73 0.27 0.00 0.02 0.00 0.00 41.25 39.95 1diq s ASN 519 CO 0.23 -0.44 1.29 0.47 0.02 0.00 0.00 177.10 178.67 1diq n ASP 520 N -1.84 5.72 0.00 -1.22 8.00 -1.26 -5.05 116.55 120.89 1diq n ASP 520 Ca -0.02 -3.14 0.00 0.00 0.71 0.00 0.00 54.79 52.34 1diq n ASP 520 Cb 0.57 -1.38 0.00 0.00 -0.02 0.00 0.00 41.12 40.29 1diq n ASP 520 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30