#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 4.89 0.25 0.00 0.11 -1.26 -5.06 120.40 119.32 1diq s VAL 8 Ca 0.00 1.37 0.12 0.00 -2.93 0.00 0.00 61.98 60.53 1diq s VAL 8 Cb 0.00 -4.05 -0.05 0.00 -1.53 0.00 0.00 36.38 30.75 1diq s VAL 8 CO 0.00 -0.05 -0.21 -0.76 -3.33 0.00 0.00 175.10 170.75 1diq s LEU 9 N 2.72 2.56 0.50 2.54 2.01 -1.26 -4.56 118.68 123.19 1diq s LEU 9 Ca 0.31 -0.95 -0.21 0.00 0.01 0.00 0.00 54.13 53.28 1diq s LEU 9 Cb -0.15 -1.15 -0.06 0.00 0.01 0.00 0.00 46.19 44.83 1diq s LEU 9 CO 0.08 0.07 1.18 -2.84 1.01 0.00 0.00 176.35 175.85 1diq s PRO 10 N -3.21 3.50 -0.02 1.29 0.02 -1.19 -4.42 135.00 130.98 1diq s PRO 10 Ca 0.27 1.78 -0.31 0.00 0.02 0.00 0.00 61.00 62.76 1diq s PRO 10 Cb -0.06 -2.23 -0.09 0.00 0.02 0.00 0.00 34.50 32.13 1diq s PRO 10 CO 0.13 -0.77 1.98 1.17 -0.33 0.00 0.00 177.00 179.18 1diq n LYS 11 N -0.88 2.63 0.00 5.54 4.81 -1.26 -1.72 118.16 127.28 1diq n LYS 11 Ca 0.09 0.95 0.00 0.00 -0.87 0.00 0.00 58.31 58.48 1diq n LYS 11 Cb 0.49 -2.94 0.00 0.00 0.02 0.00 0.00 35.03 32.60 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 4.64 1.87 3.76 3.14 0.00 -1.26 -5.00 105.19 112.34 1diq n GLY 12 Ca 0.22 0.00 -0.35 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 -2.59 5.43 0.48 1.61 1.01 -0.70 -5.10 120.40 120.53 1diq s VAL 13 Ca 0.00 0.21 -0.12 0.00 0.00 0.00 0.00 61.98 62.08 1diq s VAL 13 Cb 0.00 -3.46 -0.06 0.00 0.00 0.00 0.00 36.38 32.86 1diq s VAL 13 CO 0.00 0.48 0.87 0.42 0.00 0.00 0.00 175.10 176.87 1diq s THR 14 N 0.06 4.72 0.52 3.92 -4.23 -1.26 -4.47 115.64 114.90 1diq s THR 14 Ca 0.10 0.77 0.26 0.00 -1.18 0.00 0.00 61.69 61.63 1diq s THR 14 Cb -0.11 -3.77 0.41 0.00 1.34 0.00 0.00 72.50 70.37 1diq s THR 14 CO -0.00 -0.71 1.95 -0.61 -0.54 0.00 0.00 174.62 174.71 1diq h GLN 15 N 0.78 0.06 -0.04 3.99 5.75 -1.99 -1.85 115.11 121.82 1diq h GLN 15 Ca -0.47 -0.00 -0.04 0.00 -0.15 0.00 0.00 58.65 57.99 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 0.63 0.04 -0.15 0.78 -2.65 0.00 0.00 178.83 177.48 1diq h GLY 16 N 0.06 0.18 1.58 2.39 0.00 -1.99 -2.41 103.07 102.88 1diq h GLY 16 Ca 0.32 -0.25 -0.08 0.00 0.00 0.00 0.00 47.33 47.32 1diq h GLY 16 CO -0.02 0.22 -0.16 0.83 0.00 0.00 0.00 176.54 177.41 1diq h GLU 17 N -0.40 0.50 -0.35 4.80 4.39 -1.84 -2.50 114.58 119.18 1diq h GLU 17 Ca -0.01 -0.16 -0.12 0.00 0.34 0.00 0.00 59.36 59.42 1diq h GLU 17 Cb 0.79 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.38 1diq h GLU 17 CO 0.03 0.65 -0.26 0.35 -1.16 0.00 0.00 179.01 178.62 1diq h PHE 18 N 0.46 0.81 -0.20 4.33 3.57 -1.40 -2.52 116.94 121.98 1diq h PHE 18 Ca 0.08 -0.19 -0.11 0.00 3.53 0.00 0.00 57.97 61.27 1diq h PHE 18 Cb 0.55 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 39.08 1diq h PHE 18 CO 0.02 0.90 -0.37 -0.91 -2.23 0.00 0.00 178.31 175.72 1diq h ASN 19 N 0.61 0.45 0.03 0.41 2.35 -1.01 -1.09 115.58 117.32 1diq h ASN 19 Ca 0.08 -0.18 -0.14 0.00 -0.55 0.00 0.00 56.30 55.50 1diq h ASN 19 Cb 0.76 -0.12 -0.01 0.00 0.05 0.00 0.00 38.32 39.00 1diq h ASN 19 CO 0.06 0.78 -0.47 0.11 -1.65 0.00 0.00 177.43 176.26 1diq h LYS 20 N 0.37 0.51 -0.21 0.81 1.57 -1.35 -1.67 116.57 116.59 1diq h LYS 20 Ca 0.04 -0.29 -0.04 0.00 -1.87 0.00 0.00 60.65 58.49 1diq h LYS 20 Cb 0.81 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 1diq h LYS 20 CO 0.07 0.87 -0.02 0.00 -0.57 0.00 0.00 179.45 179.80 1diq h ALA 21 N 1.08 0.29 -0.09 3.86 0.00 -1.17 -1.63 119.26 121.60 1diq h ALA 21 Ca 0.02 -0.23 -0.07 0.00 0.00 0.00 0.00 54.91 54.64 1diq h ALA 21 Cb 0.98 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.68 1diq h ALA 21 CO 0.09 0.04 -0.24 0.28 0.00 0.00 0.00 179.25 179.41 1diq h VAL 22 N 0.14 1.22 -0.42 0.00 2.07 -1.13 0.87 116.25 119.00 1diq h VAL 22 Ca 0.06 -1.02 -0.13 0.00 0.82 0.00 0.00 66.70 66.42 1diq h VAL 22 Cb 0.44 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.63 1diq h VAL 22 CO 0.02 0.31 -0.26 -0.61 0.02 0.00 0.00 177.57 177.04 1diq h GLN 23 N 0.15 0.91 -0.07 1.57 5.75 -1.07 -1.76 115.11 120.58 1diq h GLN 23 Ca 0.02 -0.42 -0.16 0.00 -0.15 0.00 0.00 58.65 57.94 1diq h GLN 23 Cb 0.52 -0.01 -0.01 0.00 1.07 0.00 0.00 27.48 29.05 1diq h GLN 23 CO 0.04 1.08 -0.67 0.87 -2.65 0.00 0.00 178.83 177.50 1diq h LYS 24 N 0.73 0.30 -0.25 1.69 1.57 -0.76 -2.33 116.57 117.52 1diq h LYS 24 Ca 0.09 -0.23 -0.02 0.00 -1.87 0.00 0.00 60.65 58.62 1diq h LYS 24 Cb 0.83 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.18 1diq h LYS 24 CO 0.07 0.86 0.10 0.74 -0.57 0.00 0.00 179.45 180.65 1diq h PHE 25 N 0.21 0.38 -0.48 -1.35 0.04 -0.69 -2.21 116.94 112.84 1diq h PHE 25 Ca -0.02 -0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.73 1diq h PHE 25 Cb 1.21 -0.11 -0.02 0.00 2.20 0.00 0.00 35.95 39.22 1diq h PHE 25 CO 0.03 0.41 0.31 0.00 -0.60 0.00 0.00 178.31 178.46 1diq h ARG 26 N 0.25 0.64 -0.21 1.51 3.08 -1.23 0.96 114.38 119.38 1diq h ARG 26 Ca 0.08 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 60.05 1diq h ARG 26 Cb 0.19 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 1diq h ARG 26 CO -0.01 0.44 -0.06 0.00 -1.07 0.00 0.00 179.97 179.27 1diq h ALA 27 N 1.17 1.51 0.10 0.04 0.00 -1.33 0.18 119.26 120.94 1diq h ALA 27 Ca 0.18 -0.18 -0.23 0.00 0.00 0.00 0.00 54.91 54.68 1diq h ALA 27 Cb -0.06 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.63 1diq h ALA 27 CO -0.04 0.35 -1.15 1.25 0.00 0.00 0.00 179.25 179.66 1diq h LEU 28 N 0.31 0.33 0.00 0.00 7.12 -1.06 -3.42 115.31 118.59 1diq h LEU 28 Ca 0.07 -0.85 -0.29 0.00 0.13 0.00 0.00 57.88 56.94 1diq h LEU 28 Cb 0.31 -0.11 -0.05 0.00 -0.53 0.00 0.00 40.66 40.28 1diq h LEU 28 CO 0.01 1.51 -2.26 0.18 -0.13 0.00 0.00 178.44 177.76 1diq n LEU 29 N -4.07 0.06 0.00 2.25 4.77 0.30 -5.07 117.00 115.24 1diq n LEU 29 Ca -0.22 0.03 0.00 0.00 -0.03 0.00 0.00 56.01 55.79 1diq n LEU 29 Cb 0.83 0.37 0.00 0.00 -2.33 0.00 0.00 43.42 42.29 1diq n LEU 29 CO 0.40 0.38 0.00 0.61 -1.33 0.00 0.00 177.39 177.45 1diq n GLY 30 N 1.63 2.26 0.12 -0.72 0.00 0.64 -4.66 105.19 104.46 1diq n GLY 30 Ca -0.26 -2.07 -0.11 0.00 0.00 0.00 0.00 46.02 43.59 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 0.32 0.63 1.61 3.32 -1.94 -3.27 116.42 117.08 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 1.12 0.00 -0.90 -1.72 0.00 0.00 179.24 177.74 1diq n ASP 32 N -3.62 0.00 -0.78 6.45 5.75 -1.26 -3.13 116.55 119.96 1diq n ASP 32 Ca -0.05 0.04 0.12 0.00 -0.01 0.00 0.00 54.79 54.89 1diq n ASP 32 Cb 0.86 -0.34 0.09 0.00 -1.03 0.00 0.00 41.12 40.71 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 -1.34 2.59 -4.13 -1.12 3.02 -1.23 -4.84 115.26 108.21 1diq n ASN 33 Ca 0.12 -1.80 -0.33 0.00 -0.03 0.00 0.00 54.58 52.53 1diq n ASN 33 Cb 0.25 0.15 -0.16 0.00 -0.61 0.00 0.00 39.78 39.41 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 -2.16 2.14 -0.29 2.41 1.01 -1.18 -1.14 120.40 121.19 1diq s VAL 34 Ca 0.25 -0.96 -0.04 0.00 0.00 0.00 0.00 61.98 61.23 1diq s VAL 34 Cb 0.19 -1.93 0.03 0.00 0.00 0.00 0.00 36.38 34.68 1diq s VAL 34 CO 0.39 0.49 0.03 -0.76 0.00 0.00 0.00 175.10 175.25 1diq s LEU 35 N 1.29 3.80 0.00 3.92 1.02 0.54 -4.94 118.68 124.30 1diq s LEU 35 Ca 0.04 -1.01 0.00 0.00 0.02 0.00 0.00 54.13 53.18 1diq s LEU 35 Cb -0.14 -1.77 0.00 0.00 0.02 0.00 0.00 46.19 44.30 1diq s LEU 35 CO -0.12 -0.23 0.00 1.33 0.02 0.00 0.00 176.35 177.36 1diq n VAL 36 N 4.73 0.00 -2.80 -1.59 0.24 -1.26 -1.30 118.33 116.34 1diq n VAL 36 Ca -0.14 -0.37 -0.41 0.00 -2.04 0.00 0.00 64.34 61.38 1diq n VAL 36 Cb 0.46 0.89 -0.04 0.00 -1.47 0.00 0.00 33.84 33.67 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 -1.12 4.61 0.62 7.34 2.02 -1.26 -4.94 118.70 125.97 1diq s GLU 37 Ca 0.00 1.32 0.32 0.00 0.02 0.00 0.00 54.97 56.63 1diq s GLU 37 Cb 0.00 -3.39 1.79 0.00 0.10 0.00 0.00 34.13 32.63 1diq s GLU 37 CO 0.00 0.19 2.10 0.66 0.02 0.00 0.00 175.26 178.23 1diq h SER 38 N 5.83 0.00 1.55 -0.19 4.64 -1.97 -0.97 113.55 122.44 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 -0.03 -2.24 -0.87 0.00 0.00 176.83 174.41 1diq h ASP 39 N 0.00 0.00 0.47 4.97 2.03 -2.01 -2.64 116.42 119.24 1diq h ASP 39 Ca 0.06 -0.01 -0.21 0.00 -0.73 0.00 0.00 57.03 56.14 1diq h ASP 39 Cb 0.47 0.00 -0.04 0.00 -0.83 0.00 0.00 39.33 38.93 1diq h ASP 39 CO -0.00 0.00 -1.70 0.00 -1.03 0.00 0.00 179.24 176.52 1diq n GLN 40 N -2.42 0.64 0.16 4.15 6.02 -0.40 -4.12 117.38 121.41 1diq n GLN 40 Ca 0.05 0.16 0.09 0.00 -0.01 0.00 0.00 57.00 57.29 1diq n GLN 40 Cb 0.45 -1.73 0.07 0.00 1.02 0.00 0.00 30.24 30.06 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 -0.96 1.08 4.07 -1.44 -3.39 115.31 114.68 1diq h LEU 41 Ca -0.24 0.00 0.15 0.00 0.08 0.00 0.00 57.88 57.87 1diq h LEU 41 Cb 1.74 0.00 -0.10 0.00 1.08 0.00 0.00 40.66 43.38 1diq h LEU 41 CO 0.05 0.17 0.57 0.58 -1.08 0.00 0.00 178.44 178.72 1diq h VAL 42 N 0.00 0.78 0.00 1.22 2.07 -1.62 -2.31 116.25 116.39 1diq h VAL 42 Ca -0.02 -0.27 0.00 0.00 0.82 0.00 0.00 66.70 67.23 1diq h VAL 42 Cb 1.14 -0.09 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 -0.81 0.02 0.00 0.00 177.57 176.95 1diq n PRO 43 N -4.75 0.19 0.14 1.57 -0.04 -1.26 -2.30 135.00 128.55 1diq n PRO 43 Ca 0.20 0.39 0.08 0.00 -0.04 0.00 0.00 63.50 64.14 1diq n PRO 43 Cb 0.46 -1.85 0.05 0.00 -0.04 0.00 0.00 33.50 32.13 1diq n PRO 43 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1diq h TYR 44 N 0.00 0.00 0.00 0.54 0.05 -1.70 -3.34 116.97 112.51 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 0.39 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.13 1diq h TYR 44 CO 0.00 0.17 0.00 -0.97 -1.05 0.00 0.00 178.16 176.31 1diq h ASN 45 N 0.00 0.00 -2.36 3.88 -0.00 -1.46 -2.84 115.58 112.81 1diq h ASN 45 Ca -0.02 0.00 -0.56 0.00 -0.00 0.00 0.00 56.30 55.71 1diq h ASN 45 Cb 1.15 0.00 -0.00 0.00 -0.00 0.00 0.00 38.32 39.47 1diq h ASN 45 CO 0.02 0.00 1.30 -0.75 -0.00 0.00 0.00 177.43 178.00 1diq s LYS 46 N -3.17 3.63 0.17 6.67 2.20 -1.25 -4.89 119.74 123.11 1diq s LYS 46 Ca 0.08 2.07 0.09 0.00 -0.36 0.00 0.00 55.97 57.86 1diq s LYS 46 Cb 0.08 -4.21 -0.04 0.00 -1.51 0.00 0.00 37.83 32.15 1diq s LYS 46 CO 0.63 -1.52 -0.20 0.96 -0.36 0.00 0.00 175.35 174.86 1diq s ILE 47 N 6.22 1.99 -0.49 5.43 -4.36 -1.26 -4.55 121.20 124.17 1diq s ILE 47 Ca 0.88 -1.95 0.12 0.00 -0.26 0.00 0.00 60.65 59.44 1diq s ILE 47 Cb -0.33 -1.93 0.36 0.00 1.25 0.00 0.00 42.46 41.81 1diq s ILE 47 CO 0.35 -0.25 1.29 0.23 0.24 0.00 0.00 174.94 176.80 1diq n MET 48 N 0.28 2.79 -3.08 0.37 2.81 -1.26 -4.97 117.12 114.07 1diq n MET 48 Ca -0.13 -2.34 -0.32 0.00 -1.81 0.00 0.00 57.70 53.10 1diq n MET 48 Cb 0.57 -1.48 -0.06 0.00 -0.71 0.00 0.00 33.22 31.54 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 -1.83 3.98 -1.20 0.03 -1.94 -1.26 -1.90 119.30 115.17 1diq s MET 49 Ca 0.29 0.67 -0.08 0.00 -1.71 0.00 0.00 55.69 54.86 1diq s MET 49 Cb 0.20 -2.41 -0.10 0.00 2.01 0.00 0.00 34.83 34.54 1diq s MET 49 CO 0.11 0.12 2.78 -0.35 -0.01 0.00 0.00 175.02 177.66 1diq n PRO 50 N -0.51 3.00 -3.62 2.03 -0.04 -1.26 -4.78 135.00 129.81 1diq n PRO 50 Ca 0.04 -1.81 -0.11 0.00 -0.04 0.00 0.00 63.50 61.58 1diq n PRO 50 Cb 0.53 -2.58 -0.04 0.00 -0.04 0.00 0.00 33.50 31.37 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 2.36 0.07 0.53 0.52 0.11 -1.26 -4.83 120.40 117.89 1diq s VAL 51 Ca 0.60 -0.54 -0.18 0.00 -2.93 0.00 0.00 61.98 58.94 1diq s VAL 51 Cb 0.17 -1.15 -0.07 0.00 -1.53 0.00 0.00 36.38 33.81 1diq s VAL 51 CO -0.04 -0.30 1.03 -1.61 -3.33 0.00 0.00 175.10 170.85 1diq s GLU 52 N -3.74 3.67 0.42 1.54 8.01 -1.26 -4.95 118.70 122.38 1diq s GLU 52 Ca 0.02 1.20 0.18 0.00 0.01 0.00 0.00 54.97 56.39 1diq s GLU 52 Cb 0.02 -2.08 1.10 0.00 -4.31 0.00 0.00 34.13 28.85 1diq s GLU 52 CO -0.12 -0.52 1.84 -0.91 0.01 0.00 0.00 175.26 175.56 1diq h ASN 53 N 1.01 0.40 -0.57 -0.19 4.21 -1.96 -2.34 115.58 116.14 1diq h ASN 53 Ca -0.48 0.05 0.12 0.00 1.21 0.00 0.00 56.30 57.20 1diq h ASN 53 Cb 1.21 -0.02 -0.03 0.00 -1.12 0.00 0.00 38.32 38.35 1diq h ASN 53 CO 0.59 0.15 0.39 0.00 -1.29 0.00 0.00 177.43 177.27 1diq h ALA 54 N 1.61 2.22 0.00 -0.83 0.00 -1.95 -1.18 119.26 119.13 1diq h ALA 54 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1diq h ALA 54 Cb 1.26 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1diq h ALA 54 CO -0.19 -0.36 0.00 0.00 0.00 0.00 0.00 179.25 178.69 1diq h ALA 55 N 1.72 1.00 0.00 0.00 0.00 -1.81 -3.11 119.26 117.06 1diq h ALA 55 Ca 0.27 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 55.08 1diq h ALA 55 Cb 0.75 0.00 -0.22 0.00 0.00 0.00 0.00 17.79 18.32 1diq h ALA 55 CO -0.05 0.00 -0.78 0.72 0.00 0.00 0.00 179.25 179.14 1diq n HIS 56 N -2.53 0.00 -2.87 0.00 8.25 -0.50 -3.09 115.22 114.49 1diq n HIS 56 Ca 0.02 -0.68 -0.41 0.00 -0.26 0.00 0.00 57.72 56.39 1diq n HIS 56 Cb 0.27 -0.16 -0.04 0.00 1.12 0.00 0.00 29.99 31.18 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 -0.90 3.28 0.63 -1.41 0.00 -0.89 -3.86 121.76 118.62 1diq s ALA 57 Ca 0.30 0.38 -0.11 0.00 0.00 0.00 0.00 51.96 52.53 1diq s ALA 57 Cb 0.32 -3.14 -0.03 0.00 0.00 0.00 0.00 23.12 20.27 1diq s ALA 57 CO -0.11 -0.07 1.04 -1.25 0.00 0.00 0.00 175.76 175.37 1diq s PRO 58 N 0.42 3.48 -0.07 0.00 0.04 -1.26 0.14 135.00 137.75 1diq s PRO 58 Ca 0.44 0.70 0.15 0.00 0.04 0.00 0.00 61.00 62.33 1diq s PRO 58 Cb -0.21 -2.07 -0.22 0.00 0.04 0.00 0.00 34.50 32.04 1diq s PRO 58 CO 0.25 -0.65 0.53 -1.13 0.04 0.00 0.00 177.00 176.04 1diq n SER 59 N -2.79 0.62 -3.61 6.66 3.41 -0.96 -4.72 113.62 112.23 1diq n SER 59 Ca 0.06 0.29 -0.05 0.00 -0.26 0.00 0.00 58.87 58.91 1diq n SER 59 Cb 0.55 0.30 -0.01 0.00 -0.26 0.00 0.00 64.21 64.79 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 -2.64 -1.36 -0.11 7.33 0.00 -1.26 -4.83 121.76 118.88 1diq s ALA 60 Ca -0.06 -0.22 -0.05 0.00 0.00 0.00 0.00 51.96 51.64 1diq s ALA 60 Cb 0.08 0.73 0.06 0.00 0.00 0.00 0.00 23.12 23.98 1diq s ALA 60 CO 0.83 -1.04 0.25 0.00 0.00 0.00 0.00 175.76 175.80 1diq s ALA 61 N -3.19 -0.53 -0.05 0.00 0.00 -0.42 -1.46 121.76 116.11 1diq s ALA 61 Ca 0.14 0.93 0.05 0.00 0.00 0.00 0.00 51.96 53.08 1diq s ALA 61 Cb -0.04 -0.83 -0.02 0.00 0.00 0.00 0.00 23.12 22.23 1diq s ALA 61 CO 0.06 -0.44 -0.20 0.14 0.00 0.00 0.00 175.76 175.32 1diq s VAL 62 N 1.90 2.54 -0.35 0.00 -7.23 -0.12 -0.34 120.40 116.81 1diq s VAL 62 Ca -0.03 -0.90 -0.03 0.00 -1.81 0.00 0.00 61.98 59.20 1diq s VAL 62 Cb -0.11 -1.96 0.07 0.00 0.56 0.00 0.00 36.38 34.93 1diq s VAL 62 CO -0.08 0.58 0.10 0.42 -0.31 0.00 0.00 175.10 175.80 1diq s THR 63 N -0.43 3.27 0.26 5.32 -4.23 -0.29 -0.93 115.64 118.61 1diq s THR 63 Ca 0.04 -1.57 -0.06 0.00 -1.18 0.00 0.00 61.69 58.93 1diq s THR 63 Cb -0.12 -3.00 -0.06 0.00 1.34 0.00 0.00 72.50 70.66 1diq s THR 63 CO 0.02 -0.33 0.53 0.00 -0.54 0.00 0.00 174.62 174.29 1diq s ALA 64 N 1.25 3.63 0.00 3.99 0.00 -1.24 -4.87 121.76 124.52 1diq s ALA 64 Ca 0.00 -0.49 0.00 0.00 0.00 0.00 0.00 51.96 51.47 1diq s ALA 64 Cb -0.21 -2.31 0.00 0.00 0.00 0.00 0.00 23.12 20.60 1diq s ALA 64 CO -0.01 0.36 0.00 0.25 0.00 0.00 0.00 175.76 176.36 1diq n THR 65 N -0.62 0.00 -4.27 0.00 -2.24 -1.26 -4.18 114.28 101.71 1diq n THR 65 Ca -0.01 -0.07 -0.15 0.00 -2.27 0.00 0.00 64.05 61.55 1diq n THR 65 Cb 0.53 0.52 -0.10 0.00 -2.10 0.00 0.00 70.33 69.19 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 -1.57 1.28 0.39 4.28 -4.23 -1.26 -4.69 115.64 109.85 1diq s THR 66 Ca 0.00 -2.09 0.08 0.00 -1.18 0.00 0.00 61.69 58.50 1diq s THR 66 Cb 0.00 -1.90 0.20 0.00 1.34 0.00 0.00 72.50 72.14 1diq s THR 66 CO 0.00 -0.70 1.97 0.58 -0.54 0.00 0.00 174.62 175.93 1diq h VAL 67 N 2.73 1.14 -0.31 2.29 2.07 -1.98 -2.33 116.25 119.86 1diq h VAL 67 Ca -0.37 -0.53 -0.05 0.00 0.82 0.00 0.00 66.70 66.57 1diq h VAL 67 Cb 1.20 0.92 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 1diq h VAL 67 CO 0.63 0.18 -0.01 -0.33 0.02 0.00 0.00 177.57 178.06 1diq h GLU 68 N 0.37 0.47 -0.08 1.57 3.07 -1.99 -1.29 114.58 116.71 1diq h GLU 68 Ca 0.09 -0.10 -0.22 0.00 -0.50 0.00 0.00 59.36 58.63 1diq h GLU 68 Cb 0.20 -0.07 0.00 0.00 -0.84 0.00 0.00 28.75 28.04 1diq h GLU 68 CO 0.00 0.51 -0.83 1.96 -1.40 0.00 0.00 179.01 179.25 1diq h GLN 69 N 0.45 0.56 -0.51 2.33 4.20 -1.85 -1.88 115.11 118.42 1diq h GLN 69 Ca 0.10 -0.50 -0.08 0.00 0.06 0.00 0.00 58.65 58.22 1diq h GLN 69 Cb 0.32 0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.20 1diq h GLN 69 CO 0.01 1.13 -0.01 0.28 -0.67 0.00 0.00 178.83 179.57 1diq h VAL 70 N 0.36 1.26 -0.36 -0.54 2.07 -1.24 0.15 116.25 117.96 1diq h VAL 70 Ca -0.06 -1.11 -0.03 0.00 0.82 0.00 0.00 66.70 66.33 1diq h VAL 70 Cb 1.44 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 32.16 1diq h VAL 70 CO 0.15 0.39 0.11 1.56 0.02 0.00 0.00 177.57 179.81 1diq h GLN 71 N 0.77 0.51 0.05 1.57 4.20 -1.22 -1.59 115.11 119.39 1diq h GLN 71 Ca 0.14 -0.07 -0.00 0.00 0.06 0.00 0.00 58.65 58.78 1diq h GLN 71 Cb 0.54 -0.09 0.00 0.00 0.30 0.00 0.00 27.48 28.23 1diq h GLN 71 CO 0.03 0.45 -0.02 0.78 -0.67 0.00 0.00 178.83 179.40 1diq h GLY 72 N 0.70 -0.07 0.93 3.46 0.00 -0.43 -2.48 103.07 105.19 1diq h GLY 72 Ca 0.12 0.02 0.08 0.00 0.00 0.00 0.00 47.33 47.56 1diq h GLY 72 CO -0.01 -0.02 0.50 -2.08 0.00 0.00 0.00 176.54 174.93 1diq h VAL 73 N -0.56 0.99 -0.06 4.60 2.07 -0.44 -1.58 116.25 121.27 1diq h VAL 73 Ca -0.01 -0.26 -0.17 0.00 0.82 0.00 0.00 66.70 67.08 1diq h VAL 73 Cb 0.50 0.16 -0.01 0.00 -1.52 0.00 0.00 31.29 30.43 1diq h VAL 73 CO 0.01 0.14 -0.72 0.58 0.02 0.00 0.00 177.57 177.60 1diq h VAL 74 N 0.76 1.40 -0.39 2.57 2.07 -1.31 -1.39 116.25 119.97 1diq h VAL 74 Ca 0.34 -2.19 -0.11 0.00 0.82 0.00 0.00 66.70 65.56 1diq h VAL 74 Cb 0.35 2.15 -0.01 0.00 -1.52 0.00 0.00 31.29 32.26 1diq h VAL 74 CO -0.12 0.65 -0.20 0.50 0.02 0.00 0.00 177.57 178.41 1diq h LYS 75 N 0.21 0.83 -0.55 1.57 3.64 -0.82 -2.01 116.57 119.44 1diq h LYS 75 Ca -0.03 -0.37 -0.10 0.00 -1.27 0.00 0.00 60.65 58.88 1diq h LYS 75 Cb 1.28 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 33.07 1diq h LYS 75 CO 0.12 1.00 -0.06 0.82 -2.27 0.00 0.00 179.45 179.06 1diq h ILE 76 N 0.63 1.27 -0.09 2.00 2.04 -1.35 -2.80 117.51 119.20 1diq h ILE 76 Ca 0.08 -1.20 -0.06 0.00 1.00 0.00 0.00 64.86 64.68 1diq h ILE 76 Cb 0.76 0.94 -0.01 0.00 -0.74 0.00 0.00 36.82 37.77 1diq h ILE 76 CO 0.06 0.43 -0.21 0.00 0.00 0.00 0.00 178.15 178.43 1diq h ASN 78 N 0.15 0.26 -0.07 0.00 2.35 -1.19 -0.13 115.58 116.94 1diq h ASN 78 Ca 0.03 -0.18 -0.02 0.00 -0.55 0.00 0.00 56.30 55.57 1diq h ASN 78 Cb 0.46 -0.08 -0.00 0.00 0.05 0.00 0.00 38.32 38.75 1diq h ASN 78 CO 0.03 0.93 -0.03 -0.33 -1.65 0.00 0.00 177.43 176.39 1diq h GLU 79 N 0.13 0.15 -0.57 0.81 5.08 -1.21 -3.30 114.58 115.68 1diq h GLU 79 Ca -0.03 -0.06 0.00 0.00 -1.00 0.00 0.00 59.36 58.27 1diq h GLU 79 Cb 1.36 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 30.60 1diq h GLU 79 CO 0.12 0.50 0.00 0.72 -1.00 0.00 0.00 179.01 179.35 1diq n HIS 80 N -4.79 1.44 -4.02 4.33 8.25 -1.03 -4.97 115.22 114.44 1diq n HIS 80 Ca -0.07 -0.66 -0.29 0.00 -0.26 0.00 0.00 57.72 56.44 1diq n HIS 80 Cb 0.24 -0.28 -0.01 0.00 1.12 0.00 0.00 29.99 31.06 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 0.79 -3.63 -3.14 -0.41 4.76 -0.76 -4.90 118.16 110.87 1diq n LYS 81 Ca 0.25 0.43 -0.40 0.00 -2.87 0.00 0.00 58.31 55.71 1diq n LYS 81 Cb 0.91 -4.86 -0.06 0.00 -1.84 0.00 0.00 35.03 29.17 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 -3.65 5.02 -0.18 -0.18 -1.09 -0.13 -4.88 121.20 116.10 1diq s ILE 82 Ca 0.32 1.11 -0.28 0.00 -2.23 0.00 0.00 60.65 59.56 1diq s ILE 82 Cb -0.17 -3.92 -0.00 0.00 -1.58 0.00 0.00 42.46 36.79 1diq s ILE 82 CO 0.89 0.08 0.96 -2.16 -1.23 0.00 0.00 174.94 173.48 1diq s PRO 83 N 2.20 4.31 -0.10 2.79 0.04 -1.26 -4.74 135.00 138.23 1diq s PRO 83 Ca 0.26 1.25 -0.04 0.00 0.04 0.00 0.00 61.00 62.51 1diq s PRO 83 Cb -0.16 -3.60 -0.04 0.00 0.04 0.00 0.00 34.50 30.75 1diq s PRO 83 CO 0.09 -0.46 0.07 0.96 0.04 0.00 0.00 177.00 177.70 1diq s ILE 84 N 2.59 4.87 -0.32 0.56 -4.36 0.09 -1.22 121.20 123.40 1diq s ILE 84 Ca 0.43 -0.03 -0.03 0.00 -0.26 0.00 0.00 60.65 60.75 1diq s ILE 84 Cb -0.16 -3.09 0.05 0.00 1.25 0.00 0.00 42.46 40.51 1diq s ILE 84 CO 0.11 0.61 0.05 0.86 0.24 0.00 0.00 174.94 176.81 1diq s TRP 85 N -0.93 3.30 -0.02 1.37 -0.11 0.15 -0.71 118.94 121.99 1diq s TRP 85 Ca 0.14 -1.80 -0.24 0.00 1.22 0.00 0.00 56.10 55.41 1diq s TRP 85 Cb -0.12 -2.29 -0.04 0.00 -1.50 0.00 0.00 33.47 29.53 1diq s TRP 85 CO 0.03 -0.80 0.74 0.99 -4.62 0.00 0.00 176.95 173.29 1diq s THR 86 N 1.28 4.92 0.10 5.86 2.01 -1.26 -1.48 115.64 127.07 1diq s THR 86 Ca -0.03 1.54 0.06 0.00 0.31 0.00 0.00 61.69 63.58 1diq s THR 86 Cb -0.20 -4.08 -0.03 0.00 0.01 0.00 0.00 72.50 68.20 1diq s THR 86 CO -0.00 0.29 -0.17 0.27 -0.69 0.00 0.00 174.62 174.32 1diq s ILE 87 N 0.46 1.39 0.00 1.82 -4.36 -0.92 -4.96 121.20 114.63 1diq s ILE 87 Ca 0.39 -1.49 0.00 0.00 -0.26 0.00 0.00 60.65 59.28 1diq s ILE 87 Cb -0.19 -1.36 0.00 0.00 1.25 0.00 0.00 42.46 42.16 1diq s ILE 87 CO 0.20 -0.21 0.00 -1.20 0.24 0.00 0.00 174.94 173.97 1diq n SER 88 N 1.02 0.00 -0.00 4.36 7.64 -1.26 -2.27 113.62 123.12 1diq n SER 88 Ca -0.19 0.00 0.08 0.00 1.01 0.00 0.00 58.87 59.77 1diq n SER 88 Cb 0.55 -0.24 -0.10 0.00 -1.01 0.00 0.00 64.21 63.41 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 -2.05 0.00 -2.96 0.44 -2.24 -1.26 -2.96 114.28 103.26 1diq n THR 89 Ca 0.00 -0.18 -0.19 0.00 -2.27 0.00 0.00 64.05 61.41 1diq n THR 89 Cb 0.00 0.80 0.00 0.00 -2.10 0.00 0.00 70.33 69.03 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 1.42 -0.50 2.16 3.38 0.00 -1.26 -4.91 105.19 105.48 1diq n GLY 90 Ca 0.02 0.06 -0.27 0.00 0.00 0.00 0.00 46.02 45.83 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 -3.44 2.49 -0.95 1.61 5.12 -1.26 -3.72 116.66 116.50 1diq n ARG 91 Ca -0.08 -3.22 -0.19 0.00 -1.93 0.00 0.00 57.85 52.42 1diq n ARG 91 Cb 0.58 -2.20 -0.10 0.00 -1.16 0.00 0.00 32.46 29.58 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 -1.02 5.61 -4.71 0.55 5.15 -1.25 -4.94 115.26 114.64 1diq n ASN 92 Ca 0.58 -2.39 -0.42 0.00 -0.60 0.00 0.00 54.58 51.75 1diq n ASN 92 Cb 1.13 -1.28 -0.03 0.00 -0.53 0.00 0.00 39.78 39.06 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 1.78 2.79 0.00 1.20 0.08 -1.26 -0.67 117.98 121.89 1diq s PHE 93 Ca 0.58 0.33 0.00 0.00 0.12 0.00 0.00 56.93 57.96 1diq s PHE 93 Cb 0.23 -4.10 0.00 0.00 -0.57 0.00 0.00 43.02 38.58 1diq s PHE 93 CO -0.02 -4.23 0.00 0.41 -0.10 0.00 0.00 175.22 171.28 1diq n GLY 94 N 3.98 1.03 0.03 4.36 0.00 -1.26 -4.84 105.19 108.49 1diq n GLY 94 Ca 0.16 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.19 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 0.15 -3.16 117.16 117.77 1diq n TYR 95 Ca 0.00 -0.38 0.00 0.00 -0.16 0.00 0.00 57.90 57.36 1diq n TYR 95 Cb 0.00 -0.04 0.00 0.00 -0.31 0.00 0.00 39.34 38.99 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 1.40 7.00 2.72 0.00 -1.11 -2.96 105.19 111.83 1diq n GLY 96 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 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 -0.38 1.61 7.64 -0.39 -2.55 113.62 119.55 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 0.01 0.00 -1.01 0.00 0.00 64.21 63.21 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 12.08 2.98 -1.83 -0.43 0.00 -1.24 -3.92 120.51 128.15 1diq n ALA 98 Ca 0.00 -0.53 -0.36 0.00 0.00 0.00 0.00 53.44 52.55 1diq n ALA 98 Cb 0.00 -0.51 -0.07 0.00 0.00 0.00 0.00 19.45 18.87 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 -1.67 3.19 0.76 0.00 0.00 -1.06 -4.92 121.76 118.06 1diq s ALA 99 Ca 0.13 0.45 -0.13 0.00 0.00 0.00 0.00 51.96 52.41 1diq s ALA 99 Cb 0.12 -3.13 0.05 0.00 0.00 0.00 0.00 23.12 20.16 1diq s ALA 99 CO 0.33 0.18 1.13 -1.25 0.00 0.00 0.00 175.76 176.16 1diq s PRO 100 N -2.32 2.15 0.27 0.00 0.04 -1.25 -4.94 135.00 128.94 1diq s PRO 100 Ca 0.52 1.44 -0.04 0.00 0.04 0.00 0.00 61.00 62.96 1diq s PRO 100 Cb -0.16 -1.87 0.34 0.00 0.04 0.00 0.00 34.50 32.85 1diq s PRO 100 CO 0.21 -1.77 1.91 -0.39 0.04 0.00 0.00 177.00 177.00 1diq h VAL 101 N -0.75 1.24 -4.01 -0.36 -1.51 -1.90 -3.44 116.25 105.53 1diq h VAL 101 Ca -0.45 -0.54 -0.65 0.00 -1.23 0.00 0.00 66.70 63.83 1diq h VAL 101 Cb 1.26 0.07 -0.23 0.00 -2.13 0.00 0.00 31.29 30.26 1diq h VAL 101 CO 0.50 0.25 -0.86 -1.10 -1.23 0.00 0.00 177.57 175.13 1diq s GLN 102 N -5.83 1.41 0.40 5.19 -0.21 -1.26 -4.80 119.66 114.56 1diq s GLN 102 Ca -0.12 -1.23 -0.27 0.00 0.02 0.00 0.00 55.36 53.76 1diq s GLN 102 Cb 0.17 -1.76 -0.10 0.00 1.00 0.00 0.00 33.01 32.32 1diq s GLN 102 CO 0.81 0.43 1.44 0.50 -2.12 0.00 0.00 175.29 176.35 1diq s ARG 103 N -1.80 3.96 0.00 2.91 3.52 -1.18 -3.45 118.95 122.92 1diq s ARG 103 Ca 0.11 2.47 0.00 0.00 -0.13 0.00 0.00 55.73 58.19 1diq s ARG 103 Cb -0.10 -2.85 0.00 0.00 -1.56 0.00 0.00 34.95 30.44 1diq s ARG 103 CO 0.05 -0.61 0.00 0.41 -0.81 0.00 0.00 175.30 174.33 1diq n GLY 104 N 0.53 0.76 3.82 8.12 0.00 0.12 -4.33 105.19 114.21 1diq n GLY 104 Ca 0.02 0.00 -0.33 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 -0.01 3.75 0.00 1.61 -0.21 -1.22 -3.18 119.66 120.40 1diq s GLN 105 Ca 0.00 1.15 -0.21 0.00 0.02 0.00 0.00 55.36 56.32 1diq s GLN 105 Cb 0.00 -2.10 -0.05 0.00 1.00 0.00 0.00 33.01 31.86 1diq s GLN 105 CO 0.00 -0.45 0.60 0.08 -2.12 0.00 0.00 175.29 173.41 1diq s VAL 106 N -2.37 4.89 -0.24 1.09 1.01 -0.36 -2.27 120.40 122.14 1diq s VAL 106 Ca 0.63 1.26 -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 32.28 1diq s VAL 106 CO 0.28 0.42 0.56 -0.63 0.00 0.00 0.00 175.10 175.73 1diq s ILE 107 N -0.24 5.05 -0.72 2.22 1.01 -0.54 0.33 121.20 128.31 1diq s ILE 107 Ca 0.31 0.99 -0.18 0.00 0.00 0.00 0.00 60.65 61.77 1diq s ILE 107 Cb -0.18 -3.87 0.12 0.00 0.01 0.00 0.00 42.46 38.54 1diq s ILE 107 CO 0.18 0.09 0.85 -0.22 0.00 0.00 0.00 174.94 175.83 1diq s LEU 108 N 2.18 5.41 -0.43 2.97 2.96 -0.55 -0.94 118.68 130.28 1diq s LEU 108 Ca 0.24 -1.73 -0.23 0.00 -0.22 0.00 0.00 54.13 52.18 1diq s LEU 108 Cb -0.16 -2.32 0.02 0.00 0.50 0.00 0.00 46.19 44.23 1diq s LEU 108 CO 0.09 -1.06 0.80 -0.62 -1.32 0.00 0.00 176.35 174.25 1diq s ASP 109 N 3.41 6.45 -0.36 3.68 3.68 -0.11 -2.17 116.67 131.25 1diq s ASP 109 Ca 0.19 0.01 0.08 0.00 2.13 0.00 0.00 52.55 54.96 1diq s ASP 109 Cb -0.17 -2.40 0.70 0.00 -1.45 0.00 0.00 42.92 39.61 1diq s ASP 109 CO 0.00 -0.90 1.81 0.18 0.13 0.00 0.00 175.17 176.40 1diq n LEU 110 N 6.72 6.12 0.14 -1.34 4.77 -0.96 -3.63 117.00 128.81 1diq n LEU 110 Ca 0.03 -3.38 0.02 0.00 -0.03 0.00 0.00 56.01 52.65 1diq n LEU 110 Cb 0.48 -0.76 0.35 0.00 -2.33 0.00 0.00 43.42 41.16 1diq n LEU 110 CO 0.59 0.91 0.80 0.50 -1.33 0.00 0.00 177.39 178.85 1diq h LYS 111 N 2.03 0.17 0.00 3.23 1.63 -1.77 -2.84 116.57 119.01 1diq h LYS 111 Ca 0.37 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 60.12 1diq h LYS 111 Cb 2.44 -0.02 0.00 0.00 -0.60 0.00 0.00 32.23 34.05 1diq h LYS 111 CO 0.82 0.42 0.00 0.87 -3.45 0.00 0.00 179.45 178.10 1diq h LYS 112 N 0.15 0.00 -3.91 1.90 1.79 -1.80 -3.33 116.57 111.37 1diq h LYS 112 Ca 0.03 0.00 -0.73 0.00 -2.18 0.00 0.00 60.65 57.77 1diq h LYS 112 Cb 0.53 0.00 -0.09 0.00 -1.58 0.00 0.00 32.23 31.09 1diq h LYS 112 CO 0.04 0.00 2.62 -1.33 -1.08 0.00 0.00 179.45 179.70 1diq n MET 113 N -2.64 3.18 -1.55 3.15 2.81 -1.09 -4.78 117.12 116.20 1diq n MET 113 Ca 0.02 -3.02 -0.28 0.00 -1.81 0.00 0.00 57.70 52.60 1diq n MET 113 Cb 0.28 -3.15 0.07 0.00 -0.71 0.00 0.00 33.22 29.70 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 5.33 6.13 -4.70 7.83 2.04 -1.25 -0.21 115.26 130.43 1diq n ASN 114 Ca 0.47 -3.77 -0.38 0.00 -0.44 0.00 0.00 54.58 50.45 1diq n ASN 114 Cb 0.38 -0.71 -0.06 0.00 -2.53 0.00 0.00 39.78 36.86 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 -3.68 4.27 -0.52 -3.83 2.20 -1.26 -4.60 119.74 112.31 1diq s LYS 115 Ca 0.58 0.42 -0.23 0.00 -0.36 0.00 0.00 55.97 56.38 1diq s LYS 115 Cb 0.46 -3.49 0.04 0.00 -1.51 0.00 0.00 37.83 33.34 1diq s LYS 115 CO 0.01 0.03 0.84 0.42 -0.36 0.00 0.00 175.35 176.30 1diq s ILE 116 N 1.04 4.55 0.14 5.43 1.01 -1.26 -2.08 121.20 130.02 1diq s ILE 116 Ca 0.25 0.12 -0.08 0.00 0.00 0.00 0.00 60.65 60.94 1diq s ILE 116 Cb -0.15 -4.45 -0.12 0.00 0.01 0.00 0.00 42.46 37.75 1diq s ILE 116 CO 0.10 -0.98 1.39 0.40 0.00 0.00 0.00 174.94 175.85 1diq h ILE 117 N 5.98 1.31 -1.54 2.92 2.04 -1.67 -3.47 117.51 123.08 1diq h ILE 117 Ca -0.26 -1.97 0.08 0.00 1.00 0.00 0.00 64.86 63.70 1diq h ILE 117 Cb 1.08 1.95 -0.27 0.00 -0.74 0.00 0.00 36.82 38.84 1diq h ILE 117 CO 1.04 0.62 0.49 -0.75 0.00 0.00 0.00 178.15 179.54 1diq s LYS 118 N -3.79 0.45 -0.21 2.37 2.20 -1.06 -4.99 119.74 114.71 1diq s LYS 118 Ca -0.08 0.55 -0.03 0.00 -0.36 0.00 0.00 55.97 56.05 1diq s LYS 118 Cb 0.10 0.21 0.07 0.00 -1.51 0.00 0.00 37.83 36.70 1diq s LYS 118 CO 0.87 -0.06 0.06 0.42 -0.36 0.00 0.00 175.35 176.29 1diq s ILE 119 N 0.27 0.41 -0.41 5.43 1.01 -1.26 -1.06 121.20 125.59 1diq s ILE 119 Ca 0.03 -0.60 -0.21 0.00 0.00 0.00 0.00 60.65 59.87 1diq s ILE 119 Cb -0.05 -1.02 0.02 0.00 0.01 0.00 0.00 42.46 41.42 1diq s ILE 119 CO -0.08 -0.32 0.64 -0.62 0.00 0.00 0.00 174.94 174.56 1diq s ASP 120 N 1.90 6.35 0.49 3.58 -1.08 -0.65 -4.97 116.67 122.29 1diq s ASP 120 Ca 0.02 -0.21 0.28 0.00 -0.52 0.00 0.00 52.55 52.12 1diq s ASP 120 Cb -0.17 -2.32 1.01 0.00 -1.46 0.00 0.00 42.92 39.98 1diq s ASP 120 CO -0.13 -0.72 1.85 1.55 0.52 0.00 0.00 175.17 178.25 1diq h PRO 121 N 8.76 0.00 0.01 4.34 0.13 -1.98 -1.32 132.00 141.95 1diq h PRO 121 Ca -0.26 0.00 -0.13 0.00 -0.87 0.00 0.00 66.00 64.74 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 0.87 0.09 -0.69 0.93 -0.23 0.00 0.00 178.00 178.97 1diq h GLU 122 N 0.00 0.03 -0.00 0.86 5.08 -1.98 -3.36 114.58 115.21 1diq h GLU 122 Ca -0.00 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.31 1diq h GLU 122 Cb 0.70 0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1diq h GLU 122 CO 0.01 1.02 -0.11 -1.33 -1.00 0.00 0.00 179.01 177.61 1diq n MET 123 N -4.46 0.10 -3.40 2.33 2.81 -1.25 -4.99 117.12 108.25 1diq n MET 123 Ca -0.21 -0.02 -0.14 0.00 -1.81 0.00 0.00 57.70 55.52 1diq n MET 123 Cb 0.61 -1.50 0.01 0.00 -0.71 0.00 0.00 33.22 31.63 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 -3.11 0.64 -0.01 0.00 -0.85 -1.13 -1.49 117.35 111.40 1diq s TYR 125 Ca 0.12 -0.97 -0.02 0.00 -0.52 0.00 0.00 57.07 55.68 1diq s TYR 125 Cb -0.04 -0.19 0.00 0.00 0.38 0.00 0.00 41.96 42.11 1diq s TYR 125 CO 0.81 -0.72 0.05 0.00 -1.52 0.00 0.00 175.55 174.17 1diq s ALA 126 N -4.03 -0.12 -0.19 9.51 0.00 0.12 -1.63 121.76 125.41 1diq s ALA 126 Ca 0.24 0.03 0.01 0.00 0.00 0.00 0.00 51.96 52.24 1diq s ALA 126 Cb 0.04 -0.04 0.04 0.00 0.00 0.00 0.00 23.12 23.16 1diq s ALA 126 CO 0.05 -0.06 -0.09 -1.17 0.00 0.00 0.00 175.76 174.48 1diq s LEU 127 N -0.29 2.11 0.32 0.00 2.96 -0.22 -1.19 118.68 122.37 1diq s LEU 127 Ca -0.03 -0.82 0.04 0.00 -0.22 0.00 0.00 54.13 53.10 1diq s LEU 127 Cb -0.02 -1.16 -0.06 0.00 0.50 0.00 0.00 46.19 45.44 1diq s LEU 127 CO 0.00 -0.15 0.03 0.68 -1.32 0.00 0.00 176.35 175.60 1diq s VAL 128 N 1.45 1.33 0.23 1.68 -7.23 -0.40 -1.64 120.40 115.83 1diq s VAL 128 Ca -0.00 -2.02 0.05 0.00 -1.81 0.00 0.00 61.98 58.20 1diq s VAL 128 Cb -0.16 -2.75 -0.03 0.00 0.56 0.00 0.00 36.38 34.00 1diq s VAL 128 CO -0.08 -0.05 0.34 -1.61 -0.31 0.00 0.00 175.10 173.39 1diq s GLU 129 N -3.85 3.41 0.35 4.82 2.02 -0.88 -1.38 118.70 123.18 1diq s GLU 129 Ca 0.35 -0.76 0.11 0.00 0.02 0.00 0.00 54.97 54.69 1diq s GLU 129 Cb 0.08 -2.88 0.90 0.00 0.10 0.00 0.00 34.13 32.34 1diq s GLU 129 CO 0.15 0.44 1.78 -1.35 0.02 0.00 0.00 175.26 176.30 1diq h PRO 130 N 1.27 0.58 0.00 0.39 0.11 -1.70 -2.65 132.00 130.00 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 32.21 1diq h PRO 130 CO 0.62 0.38 0.00 0.41 -0.21 0.00 0.00 178.00 179.20 1diq n GLY 131 N -1.39 -1.00 3.71 -0.55 0.00 0.70 -4.18 105.19 102.48 1diq n GLY 131 Ca 0.23 -0.18 -0.42 0.00 0.00 0.00 0.00 46.02 45.65 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 -2.07 3.41 0.29 1.61 1.01 -1.00 -4.60 120.40 119.05 1diq s VAL 132 Ca 0.44 0.98 0.04 0.00 0.00 0.00 0.00 61.98 63.44 1diq s VAL 132 Cb 0.21 -3.63 -0.02 0.00 0.00 0.00 0.00 36.38 32.93 1diq s VAL 132 CO 0.37 0.06 0.44 0.42 0.00 0.00 0.00 175.10 176.38 1diq s THR 133 N 1.35 4.90 0.36 3.92 -4.23 -1.26 -4.12 115.64 116.56 1diq s THR 133 Ca 0.64 -0.87 0.21 0.00 -1.18 0.00 0.00 61.69 60.49 1diq s THR 133 Cb -0.36 -3.74 0.20 0.00 1.34 0.00 0.00 72.50 69.95 1diq s THR 133 CO 0.30 -0.33 1.94 -0.26 -0.54 0.00 0.00 174.62 175.72 1diq h PHE 134 N 0.99 0.00 -0.27 3.99 -1.00 -0.95 -2.10 116.94 117.60 1diq h PHE 134 Ca -0.50 0.00 -0.18 0.00 2.81 0.00 0.00 57.97 60.10 1diq h PHE 134 Cb 1.24 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.80 1diq h PHE 134 CO 0.45 0.23 -0.55 0.78 -1.61 0.00 0.00 178.31 177.62 1diq h GLY 135 N 1.12 0.94 1.26 -1.45 0.00 -1.70 -0.94 103.07 102.30 1diq h GLY 135 Ca -0.00 -1.11 -0.03 0.00 0.00 0.00 0.00 47.33 46.18 1diq h GLY 135 CO 0.03 1.00 0.29 -1.61 0.00 0.00 0.00 176.54 176.25 1diq h GLN 136 N 0.63 0.95 -0.24 4.80 4.15 -1.70 -1.08 115.11 122.62 1diq h GLN 136 Ca 0.01 -0.14 -0.19 0.00 0.77 0.00 0.00 58.65 59.10 1diq h GLN 136 Cb 1.16 -0.17 0.00 0.00 0.21 0.00 0.00 27.48 28.68 1diq h GLN 136 CO 0.12 0.75 -0.60 0.52 -1.93 0.00 0.00 178.83 177.70 1diq h MET 137 N 0.94 0.80 -0.81 1.69 2.86 -1.27 -2.62 114.93 116.52 1diq h MET 137 Ca 0.23 -0.54 -0.04 0.00 -2.06 0.00 0.00 59.70 57.28 1diq h MET 137 Cb 0.14 0.08 -0.04 0.00 0.06 0.00 0.00 31.60 31.84 1diq h MET 137 CO -0.03 1.16 0.33 -0.92 1.06 0.00 0.00 176.91 178.52 1diq h TYR 138 N 0.60 1.22 -0.32 -0.22 3.20 -0.61 -1.07 116.97 119.78 1diq h TYR 138 Ca -0.00 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.76 1diq h TYR 138 Cb 1.20 -0.37 -0.01 0.00 1.54 0.00 0.00 36.73 39.09 1diq h TYR 138 CO 0.07 0.92 0.10 -0.44 -1.64 0.00 0.00 178.16 177.17 1diq h ASP 139 N 1.18 0.46 -0.75 -2.11 3.45 -1.16 -1.18 116.42 116.31 1diq h ASP 139 Ca 0.27 -0.20 -0.02 0.00 0.43 0.00 0.00 57.03 57.51 1diq h ASP 139 Cb 0.20 -0.12 -0.04 0.00 -0.56 0.00 0.00 39.33 38.82 1diq h ASP 139 CO -0.02 0.54 0.41 0.22 -1.57 0.00 0.00 179.24 178.81 1diq h TYR 140 N 0.36 1.04 -0.02 4.55 5.03 -1.19 0.38 116.97 127.12 1diq h TYR 140 Ca 0.10 -0.02 -0.14 0.00 2.58 0.00 0.00 58.73 61.25 1diq h TYR 140 Cb 0.24 -0.33 -0.02 0.00 1.55 0.00 0.00 36.73 38.17 1diq h TYR 140 CO 0.01 0.73 -0.63 0.82 -1.32 0.00 0.00 178.16 177.76 1diq h ILE 141 N 1.06 1.43 0.18 1.81 2.04 -0.96 -2.43 117.51 120.64 1diq h ILE 141 Ca 0.27 -2.12 -0.31 0.00 1.00 0.00 0.00 64.86 63.70 1diq h ILE 141 Cb 0.04 2.13 0.03 0.00 -0.74 0.00 0.00 36.82 38.28 1diq h ILE 141 CO -0.04 0.61 -1.31 1.56 0.00 0.00 0.00 178.15 178.97 1diq h GLN 142 N 0.06 0.58 -0.14 2.37 1.08 -0.53 -2.67 115.11 115.86 1diq h GLN 142 Ca -0.01 -0.86 -0.02 0.00 -1.45 0.00 0.00 58.65 56.32 1diq h GLN 142 Cb 1.13 0.30 -0.00 0.00 -0.05 0.00 0.00 27.48 28.85 1diq h GLN 142 CO 0.09 1.40 0.00 1.49 -0.95 0.00 0.00 178.83 180.86 1diq h GLU 143 N 0.18 0.24 -0.22 1.46 4.81 -0.99 -3.19 114.58 116.87 1diq h GLU 143 Ca -0.21 -0.08 0.00 0.00 -0.13 0.00 0.00 59.36 58.94 1diq h GLU 143 Cb 2.00 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 31.36 1diq h GLU 143 CO 0.25 0.47 0.00 0.09 -0.73 0.00 0.00 179.01 179.09 1diq n ASN 144 N -4.77 1.63 -3.66 1.04 3.02 -0.92 -4.95 115.26 106.66 1diq n ASN 144 Ca -0.06 -1.80 -0.28 0.00 -0.03 0.00 0.00 54.58 52.42 1diq n ASN 144 Cb 0.21 -0.14 0.00 0.00 -0.61 0.00 0.00 39.78 39.24 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 0.33 -4.16 -4.73 6.41 5.15 -1.06 -4.95 115.26 112.25 1diq n ASN 145 Ca 0.14 -0.61 -0.41 0.00 -0.60 0.00 0.00 54.58 53.10 1diq n ASN 145 Cb 0.30 -3.38 -0.03 0.00 -0.53 0.00 0.00 39.78 36.14 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 -6.88 4.44 -0.01 1.20 1.43 -1.03 -4.94 118.68 112.88 1diq s LEU 146 Ca 0.54 2.21 -0.00 0.00 -1.03 0.00 0.00 54.13 55.85 1diq s LEU 146 Cb -0.28 -3.60 0.01 0.00 0.03 0.00 0.00 46.19 42.35 1diq s LEU 146 CO 0.66 -0.40 1.80 -0.81 0.23 0.00 0.00 176.35 177.84 1diq n PRO 147 N 2.76 1.03 -4.20 1.29 -0.04 -1.26 -4.87 135.00 129.71 1diq n PRO 147 Ca 0.05 -0.06 -0.25 0.00 -0.04 0.00 0.00 63.50 63.20 1diq n PRO 147 Cb 0.45 -1.02 -0.07 0.00 -0.04 0.00 0.00 33.50 32.82 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 -0.08 3.85 0.03 0.52 -7.23 -1.26 -0.05 120.40 116.19 1diq s VAL 148 Ca 0.01 -1.50 0.08 0.00 -1.81 0.00 0.00 61.98 58.76 1diq s VAL 148 Cb 0.01 -2.99 -0.02 0.00 0.56 0.00 0.00 36.38 33.93 1diq s VAL 148 CO 0.00 -0.21 -0.22 -0.32 -0.31 0.00 0.00 175.10 174.04 1diq s MET 149 N -3.27 1.57 0.25 4.82 1.75 0.32 -4.66 119.30 120.08 1diq s MET 149 Ca 0.30 -0.95 0.05 0.00 -1.25 0.00 0.00 55.69 53.83 1diq s MET 149 Cb -0.08 -1.67 -0.03 0.00 2.84 0.00 0.00 34.83 35.89 1diq s MET 149 CO 0.20 0.43 0.37 -0.51 -0.65 0.00 0.00 175.02 174.86 1diq s LEU 150 N -1.06 4.30 -0.07 4.11 1.43 -1.26 -3.25 118.68 122.88 1diq s LEU 150 Ca 0.09 0.05 0.03 0.00 -1.03 0.00 0.00 54.13 53.27 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 0.01 -0.09 -0.15 -0.55 0.23 0.00 0.00 176.35 175.81 1diq s SER 151 N -3.99 2.02 0.20 2.29 0.15 -1.26 -3.91 113.70 109.19 1diq s SER 151 Ca 0.35 -0.34 -0.11 0.00 0.70 0.00 0.00 55.95 56.54 1diq s SER 151 Cb -0.09 -0.89 -0.00 0.00 -1.71 0.00 0.00 66.02 63.33 1diq s SER 151 CO 0.29 0.07 0.38 0.72 1.20 0.00 0.00 173.24 175.89 1diq s PHE 152 N 0.54 0.34 0.82 3.44 -0.00 -1.26 -4.97 117.98 116.89 1diq s PHE 152 Ca -0.14 -0.69 -0.12 0.00 -0.00 0.00 0.00 56.93 55.98 1diq s PHE 152 Cb -0.16 0.07 0.09 0.00 -0.00 0.00 0.00 43.02 43.02 1diq s PHE 152 CO 0.04 -0.83 1.10 -1.54 -0.00 0.00 0.00 175.22 173.99 1diq s SER 153 N -2.98 4.24 0.42 1.98 1.04 -1.26 -4.10 113.70 113.05 1diq s SER 153 Ca 0.18 1.30 0.10 0.00 0.48 0.00 0.00 55.95 58.01 1diq s SER 153 Cb 0.02 -2.01 0.94 0.00 0.10 0.00 0.00 66.02 65.07 1diq s SER 153 CO 0.03 -2.13 2.03 0.00 0.98 0.00 0.00 173.24 174.15 1diq h ALA 154 N -1.20 1.83 0.00 5.32 0.00 -1.93 -1.51 119.26 121.78 1diq h ALA 154 Ca -0.48 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.41 1diq h ALA 154 Cb 1.28 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1diq h ALA 154 CO 0.59 0.10 0.00 -2.30 0.00 0.00 0.00 179.25 177.64 1diq n PRO 155 N -4.48 0.49 0.00 0.00 -0.02 -1.26 -4.55 135.00 125.18 1diq n PRO 155 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1diq n PRO 155 Cb 0.18 -1.49 0.00 0.00 -0.02 0.00 0.00 33.50 32.17 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 -0.99 0.00 -0.34 2.55 3.41 -0.57 -0.97 113.62 116.71 1diq n SER 156 Ca 0.11 0.00 0.20 0.00 -0.26 0.00 0.00 58.87 58.92 1diq n SER 156 Cb 0.05 0.00 0.42 0.00 -0.26 0.00 0.00 64.21 64.42 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 1.88 0.00 7.33 0.00 -1.85 -1.51 119.26 125.11 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 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1diq h ALA 157 CO 0.00 -0.38 -1.08 0.44 0.00 0.00 0.00 179.25 178.23 1diq n ILE 158 N -4.89 0.42 -2.60 0.00 -5.35 -0.14 -2.98 119.36 103.81 1diq n ILE 158 Ca 0.28 -0.45 -0.23 0.00 -0.27 0.00 0.00 62.75 62.08 1diq n ILE 158 Cb 0.82 -0.16 0.11 0.00 -1.74 0.00 0.00 39.64 38.66 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 -3.33 3.74 0.08 -1.28 0.00 -0.57 -4.88 121.76 115.53 1diq s ALA 159 Ca 0.00 -1.74 -0.01 0.00 0.00 0.00 0.00 51.96 50.21 1diq s ALA 159 Cb 0.12 -1.99 -0.04 0.00 0.00 0.00 0.00 23.12 21.21 1diq s ALA 159 CO 0.80 -1.43 0.01 0.20 0.00 0.00 0.00 175.76 175.33 1diq s GLY 160 N -4.73 0.65 0.12 0.00 0.00 -1.26 -0.57 107.32 101.53 1diq s GLY 160 Ca 0.66 -1.29 -0.20 0.00 0.00 0.00 0.00 44.72 43.90 1diq s GLY 160 CO 0.44 -1.32 1.75 -2.55 0.00 0.00 0.00 173.10 171.42 1diq h PRO 161 N 3.03 0.16 -0.26 2.90 0.11 -1.91 -2.87 132.00 133.16 1diq h PRO 161 Ca -0.34 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.75 1diq h PRO 161 Cb 1.16 -0.04 -0.01 0.00 0.11 0.00 0.00 31.00 32.23 1diq h PRO 161 CO 0.63 0.11 0.13 0.28 -0.21 0.00 0.00 178.00 178.93 1diq h VAL 162 N 0.16 1.14 -0.27 3.15 2.07 -1.86 -2.19 116.25 118.45 1diq h VAL 162 Ca 0.08 -0.39 -0.04 0.00 0.82 0.00 0.00 66.70 67.17 1diq h VAL 162 Cb 0.05 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1diq h VAL 162 CO -0.08 0.14 -0.00 1.23 0.02 0.00 0.00 177.57 178.88 1diq h GLY 163 N 0.29 0.51 1.09 2.17 0.00 -1.83 -1.71 103.07 103.59 1diq h GLY 163 Ca 0.09 -0.38 -0.06 0.00 0.00 0.00 0.00 47.33 46.98 1diq h GLY 163 CO -0.01 0.35 0.22 -0.57 0.00 0.00 0.00 176.54 176.53 1diq h ASN 164 N 0.26 1.07 1.08 0.19 -0.73 -1.52 -2.81 115.58 113.12 1diq h ASN 164 Ca 0.08 -0.20 -0.12 0.00 1.87 0.00 0.00 56.30 57.92 1diq h ASN 164 Cb 0.42 -0.28 -0.02 0.00 0.27 0.00 0.00 38.32 38.72 1diq h ASN 164 CO 0.01 0.99 -0.58 0.74 -0.37 0.00 0.00 177.43 178.23 1diq h THR 165 N 1.09 1.12 -0.01 -3.57 2.02 -1.36 0.38 112.91 112.58 1diq h THR 165 Ca 0.24 -2.24 -0.09 0.00 0.77 0.00 0.00 66.41 65.09 1diq h THR 165 Cb 0.31 2.32 -0.01 0.00 -1.74 0.00 0.00 68.15 69.03 1diq h THR 165 CO -0.01 0.57 -0.41 0.24 0.37 0.00 0.00 175.52 176.28 1diq h MET 166 N 0.00 0.02 -0.45 6.66 2.86 -1.06 -1.86 114.93 121.10 1diq h MET 166 Ca -0.01 -0.01 0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1diq h MET 166 Cb 1.28 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.94 1diq h MET 166 CO 0.08 0.43 0.00 -3.47 1.06 0.00 0.00 176.91 175.01 1diq n ASP 167 N -4.05 3.11 -3.72 1.22 2.03 -1.09 -0.42 116.55 113.64 1diq n ASP 167 Ca -0.02 -1.95 -0.23 0.00 0.52 0.00 0.00 54.79 53.11 1diq n ASP 167 Cb 0.44 -0.29 0.04 0.00 -0.72 0.00 0.00 41.12 40.59 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 1.23 -5.24 -1.18 -0.67 1.74 -0.70 -4.92 116.66 106.92 1diq n ARG 168 Ca 0.19 0.64 -0.29 0.00 -0.77 0.00 0.00 57.85 57.62 1diq n ARG 168 Cb 0.53 -5.30 0.20 0.00 -1.02 0.00 0.00 32.46 26.87 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 -4.15 1.58 0.06 -0.13 0.00 0.12 -4.90 107.32 99.90 1diq s GLY 169 Ca 0.14 -0.65 0.08 0.00 0.00 0.00 0.00 44.72 44.29 1diq s GLY 169 CO 0.81 0.08 -0.22 -1.34 0.00 0.00 0.00 173.10 172.43 1diq s VAL 170 N -3.03 1.76 0.00 1.40 -7.23 -1.26 -3.63 120.40 108.41 1diq s VAL 170 Ca 0.68 -1.32 0.00 0.00 -1.81 0.00 0.00 61.98 59.53 1diq s VAL 170 Cb -0.14 -1.55 0.00 0.00 0.56 0.00 0.00 36.38 35.25 1diq s VAL 170 CO 0.57 0.16 0.00 0.61 -0.31 0.00 0.00 175.10 176.13 1diq n GLY 171 N 1.63 4.15 0.00 2.32 0.00 0.53 -4.04 105.19 109.79 1diq n GLY 171 Ca -0.18 -2.18 0.00 0.00 0.00 0.00 0.00 46.02 43.66 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 -0.14 0.00 -2.65 1.61 4.01 -1.26 -4.70 117.16 114.03 1diq n TYR 172 Ca 0.00 -0.07 -0.19 0.00 -0.16 0.00 0.00 57.90 57.48 1diq n TYR 172 Cb 0.00 -0.01 0.09 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 -0.07 0.00 0.28 -0.72 -2.24 -1.26 -3.67 114.28 106.59 1diq n THR 173 Ca 0.00 -1.38 0.10 0.00 -2.27 0.00 0.00 64.05 60.50 1diq n THR 173 Cb 0.10 -0.90 0.48 0.00 -2.10 0.00 0.00 70.33 67.92 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 -2.46 0.14 -1.24 -0.78 -0.02 -1.26 -1.83 135.00 127.56 1diq n PRO 174 Ca 0.14 0.51 -0.26 0.00 -2.02 0.00 0.00 63.50 61.87 1diq n PRO 174 Cb 0.50 -1.86 0.16 0.00 -0.02 0.00 0.00 33.50 32.28 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 -2.15 3.07 -0.26 6.00 0.53 -1.26 -4.73 117.16 118.36 1diq n TYR 175 Ca 0.01 -2.08 -0.05 0.00 -1.02 0.00 0.00 57.90 54.76 1diq n TYR 175 Cb 0.13 -1.05 0.06 0.00 -1.03 0.00 0.00 39.34 37.45 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 1.24 1.04 -7.17 2.72 0.00 -1.64 -3.34 103.07 95.92 1diq h GLY 176 Ca 0.63 -0.42 -0.61 0.00 0.00 0.00 0.00 47.33 46.93 1diq h GLY 176 CO 1.20 0.41 1.38 1.85 0.00 0.00 0.00 176.54 181.37 1diq s GLU 177 N -6.03 3.55 0.30 4.80 2.56 -1.26 -0.34 118.70 122.28 1diq s GLU 177 Ca -0.13 -1.11 0.06 0.00 0.00 0.00 0.00 54.97 53.79 1diq s GLU 177 Cb 0.15 -5.20 0.76 0.00 2.00 0.00 0.00 34.13 31.83 1diq s GLU 177 CO 0.78 -2.15 1.75 0.45 -0.56 0.00 0.00 175.26 175.53 1diq h HIS 178 N 9.71 0.98 0.00 5.30 3.86 -1.69 -2.18 115.15 131.14 1diq h HIS 178 Ca 0.15 0.04 0.00 0.00 -1.16 0.00 0.00 60.37 59.40 1diq h HIS 178 Cb 1.02 -0.29 0.00 0.00 1.06 0.00 0.00 27.41 29.20 1diq h HIS 178 CO 1.25 0.15 0.00 0.35 0.86 0.00 0.00 177.93 180.54 1diq h PHE 179 N 0.66 0.00 -0.02 2.45 3.04 -1.89 -2.66 116.94 118.53 1diq h PHE 179 Ca 0.58 0.00 -0.14 0.00 3.98 0.00 0.00 57.97 62.39 1diq h PHE 179 Cb 0.98 0.00 -0.02 0.00 2.56 0.00 0.00 35.95 39.47 1diq h PHE 179 CO -0.03 0.00 -0.64 1.98 -2.02 0.00 0.00 178.31 177.60 1diq h MET 180 N 0.00 0.09 -0.02 1.11 4.05 -1.79 -3.11 114.93 115.26 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 0.60 0.01 0.00 0.00 -0.80 0.00 0.00 31.60 31.41 1diq h MET 180 CO 0.00 0.70 -0.14 -1.33 0.23 0.00 0.00 176.91 176.37 1diq n MET 181 N -3.80 1.61 -2.30 0.39 2.81 -1.03 -4.93 117.12 109.88 1diq n MET 181 Ca -0.02 -1.16 -0.38 0.00 -1.81 0.00 0.00 57.70 54.33 1diq n MET 181 Cb 0.64 -1.48 -0.02 0.00 -0.71 0.00 0.00 33.22 31.65 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 -2.19 4.00 -0.28 0.03 -0.44 -1.04 -1.11 119.66 118.62 1diq s GLN 182 Ca 0.29 1.81 0.01 0.00 -2.50 0.00 0.00 55.36 54.97 1diq s GLN 182 Cb 0.20 -2.61 0.15 0.00 -1.64 0.00 0.00 33.01 29.11 1diq s GLN 182 CO 0.41 -0.36 0.40 0.00 0.50 0.00 0.00 175.29 176.24 1diq n GLY 184 N 5.35 -2.15 3.23 0.00 0.00 -1.24 -3.91 105.19 106.47 1diq n GLY 184 Ca -0.00 -1.10 -0.12 0.00 0.00 0.00 0.00 46.02 44.80 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 -4.51 0.70 -0.13 1.61 0.23 -1.26 -0.66 119.30 115.28 1diq s MET 185 Ca 0.00 -0.35 -0.02 0.00 -1.03 0.00 0.00 55.69 54.29 1diq s MET 185 Cb 0.00 0.30 -0.03 0.00 -1.53 0.00 0.00 34.83 33.58 1diq s MET 185 CO 0.00 -0.20 -0.06 -2.00 -2.03 0.00 0.00 175.02 170.72 1diq s GLU 186 N -1.82 3.43 -0.03 3.16 2.12 0.15 -1.41 118.70 124.29 1diq s GLU 186 Ca -0.10 -0.56 0.03 0.00 0.36 0.00 0.00 54.97 54.70 1diq s GLU 186 Cb -0.04 -2.79 0.00 0.00 0.26 0.00 0.00 34.13 31.57 1diq s GLU 186 CO 0.01 0.32 -0.12 0.08 -0.54 0.00 0.00 175.26 175.01 1diq s VAL 187 N 0.12 1.05 -0.30 3.70 1.01 0.80 -1.43 120.40 125.35 1diq s VAL 187 Ca -0.02 -0.51 -0.16 0.00 0.00 0.00 0.00 61.98 61.29 1diq s VAL 187 Cb -0.14 -0.92 -0.03 0.00 0.00 0.00 0.00 36.38 35.29 1diq s VAL 187 CO 0.03 0.32 0.41 -0.69 0.00 0.00 0.00 175.10 175.17 1diq s VAL 188 N 0.15 5.13 0.79 2.92 1.01 -0.42 -0.45 120.40 129.53 1diq s VAL 188 Ca -0.04 0.46 -0.12 0.00 0.00 0.00 0.00 61.98 62.28 1diq s VAL 188 Cb -0.10 -3.78 0.07 0.00 0.00 0.00 0.00 36.38 32.56 1diq s VAL 188 CO 0.01 0.03 1.16 -0.76 0.00 0.00 0.00 175.10 175.54 1diq s LEU 189 N 2.14 2.58 0.56 3.92 1.43 0.50 -1.60 118.68 128.20 1diq s LEU 189 Ca 0.16 0.88 0.29 0.00 -1.03 0.00 0.00 54.13 54.42 1diq s LEU 189 Cb -0.16 -3.44 1.67 0.00 0.03 0.00 0.00 46.19 44.29 1diq s LEU 189 CO 0.11 -1.80 2.18 0.00 0.23 0.00 0.00 176.35 177.07 1diq h ALA 190 N -0.98 1.43 -0.03 4.21 0.00 -1.83 -2.04 119.26 120.02 1diq h ALA 190 Ca -0.46 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1diq h ALA 190 Cb 1.31 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 19.09 1diq h ALA 190 CO 0.65 0.06 0.00 0.27 0.00 0.00 0.00 179.25 180.24 1diq n ASN 191 N -3.78 1.12 0.00 0.00 0.23 -1.26 -4.83 115.26 106.74 1diq n ASN 191 Ca -0.03 -1.42 0.00 0.00 -0.53 0.00 0.00 54.58 52.61 1diq n ASN 191 Cb 0.14 -0.02 0.00 0.00 -2.08 0.00 0.00 39.78 37.83 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 3.33 3.76 4.83 0.00 -0.77 -5.03 105.19 112.42 1diq n GLY 192 Ca 0.19 0.00 -0.38 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 -1.07 5.79 -0.37 1.61 -0.00 -1.26 -4.69 116.67 116.69 1diq s ASP 193 Ca 0.00 2.66 -0.11 0.00 -0.00 0.00 0.00 52.55 55.10 1diq s ASP 193 Cb 0.00 -2.63 0.02 0.00 -0.00 0.00 0.00 42.92 40.31 1diq s ASP 193 CO 0.00 -1.21 0.21 -0.69 -0.00 0.00 0.00 175.17 173.48 1diq s VAL 194 N -1.33 4.63 -0.12 -1.27 1.01 -1.26 -0.37 120.40 121.68 1diq s VAL 194 Ca 0.65 -0.79 -0.05 0.00 0.00 0.00 0.00 61.98 61.79 1diq s VAL 194 Cb -0.38 -3.56 -0.04 0.00 0.00 0.00 0.00 36.38 32.41 1diq s VAL 194 CO 0.46 -0.20 0.06 -0.47 0.00 0.00 0.00 175.10 174.95 1diq s TYR 195 N 1.57 3.31 -0.15 5.22 5.04 0.40 -4.96 117.35 127.78 1diq s TYR 195 Ca 0.03 0.25 0.01 0.00 -2.44 0.00 0.00 57.07 54.92 1diq s TYR 195 Cb -0.19 -1.91 0.02 0.00 0.35 0.00 0.00 41.96 40.23 1diq s TYR 195 CO 0.07 0.46 -0.17 1.03 -1.34 0.00 0.00 175.55 175.60 1diq s ARG 196 N -0.57 2.60 0.92 4.97 0.52 -1.26 -0.14 118.95 125.98 1diq s ARG 196 Ca 0.11 -0.68 -0.12 0.00 -0.52 0.00 0.00 55.73 54.52 1diq s ARG 196 Cb -0.12 -2.27 0.14 0.00 0.52 0.00 0.00 34.95 33.22 1diq s ARG 196 CO 0.02 -0.19 1.10 0.95 0.02 0.00 0.00 175.30 177.21 1diq s THR 197 N 1.30 2.40 0.00 0.02 -4.23 -0.50 -3.80 115.64 110.83 1diq s THR 197 Ca 0.02 0.13 0.00 0.00 -1.18 0.00 0.00 61.69 60.67 1diq s THR 197 Cb -0.13 -2.71 0.00 0.00 1.34 0.00 0.00 72.50 70.99 1diq s THR 197 CO -0.10 -0.17 0.00 0.61 -0.54 0.00 0.00 174.62 174.42 1diq n GLY 198 N -1.49 3.85 0.84 3.99 0.00 -1.26 -1.99 105.19 109.12 1diq n GLY 198 Ca 0.06 0.21 0.11 0.00 0.00 0.00 0.00 46.02 46.40 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 11.90 2.09 0.20 1.61 2.81 -1.26 -4.40 117.12 130.07 1diq n MET 199 Ca 0.00 -1.65 0.04 0.00 -1.81 0.00 0.00 57.70 54.28 1diq n MET 199 Cb 0.00 -1.44 0.40 0.00 -0.71 0.00 0.00 33.22 31.48 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 -1.61 -2.99 103.07 108.34 1diq h GLY 200 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1diq h GLY 200 CO 0.00 0.00 -0.03 -1.33 0.00 0.00 0.00 176.54 175.18 1diq h GLY 201 N 1.18 0.00 -5.07 4.60 0.00 -1.77 -3.43 103.07 98.58 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 0.04 0.00 0.80 0.14 0.00 0.00 0.00 176.54 177.53 1diq s VAL 202 N -3.82 4.61 0.19 4.60 1.01 -1.13 -5.01 120.40 120.86 1diq s VAL 202 Ca -0.01 1.95 -0.31 0.00 0.00 0.00 0.00 61.98 63.61 1diq s VAL 202 Cb 0.10 -4.25 -0.10 0.00 0.00 0.00 0.00 36.38 32.13 1diq s VAL 202 CO 0.53 -0.16 1.50 -2.84 0.00 0.00 0.00 175.10 174.12 1diq s PRO 203 N 3.17 4.25 -0.40 2.72 0.02 -1.26 -2.58 135.00 140.91 1diq s PRO 203 Ca 0.46 2.30 0.00 0.00 0.02 0.00 0.00 61.00 63.78 1diq s PRO 203 Cb -0.16 -3.15 0.00 0.00 0.02 0.00 0.00 34.50 31.20 1diq s PRO 203 CO 0.08 -0.52 0.00 0.41 -0.33 0.00 0.00 177.00 176.65 1diq n GLY 204 N 3.19 0.63 3.76 0.52 0.00 -1.26 -5.01 105.19 107.01 1diq n GLY 204 Ca 0.11 -0.88 -0.40 0.00 0.00 0.00 0.00 46.02 44.86 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 -2.94 7.35 -0.07 1.61 0.15 -1.06 -4.95 113.70 113.78 1diq s SER 205 Ca 0.00 2.11 0.11 0.00 0.70 0.00 0.00 55.95 58.87 1diq s SER 205 Cb 0.00 -2.61 0.17 0.00 -1.71 0.00 0.00 66.02 61.86 1diq s SER 205 CO 0.00 -0.07 1.07 -0.46 1.20 0.00 0.00 173.24 174.98 1diq n ASN 206 N 1.13 2.07 -0.47 5.45 6.94 -1.26 -4.74 115.26 124.38 1diq n ASN 206 Ca -0.01 -2.60 0.06 0.00 -0.02 0.00 0.00 54.58 52.01 1diq n ASN 206 Cb 0.46 -0.25 0.14 0.00 -2.36 0.00 0.00 39.78 37.77 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 -1.01 1.47 -0.36 5.53 -2.24 -1.26 -4.77 114.28 111.65 1diq n THR 207 Ca 0.09 -1.42 -0.01 0.00 -2.27 0.00 0.00 64.05 60.44 1diq n THR 207 Cb 0.50 0.19 0.13 0.00 -2.10 0.00 0.00 70.33 69.05 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 1.20 1.19 -0.60 4.78 7.01 -1.85 -1.80 115.95 125.89 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 0.90 -0.40 0.00 0.00 -2.10 0.00 0.00 29.16 27.57 1diq h TRP 208 CO 0.21 0.70 0.00 1.04 -2.79 0.00 0.00 178.44 177.61 1diq n GLN 209 N -4.45 3.44 -0.10 2.65 3.00 -1.26 -3.70 117.38 116.96 1diq n GLN 209 Ca 0.12 -2.76 -0.19 0.00 -0.01 0.00 0.00 57.00 54.16 1diq n GLN 209 Cb 0.07 -1.77 -0.06 0.00 0.00 0.00 0.00 30.24 28.48 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 1.01 1.28 -4.05 5.09 2.08 -0.71 -4.86 119.36 119.20 1diq n ILE 210 Ca 0.24 -0.16 -0.34 0.00 0.56 0.00 0.00 62.75 63.04 1diq n ILE 210 Cb 0.80 -1.92 -0.15 0.00 -0.75 0.00 0.00 39.64 37.63 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 2.87 0.08 1.39 5.36 -0.98 -5.06 117.98 119.14 1diq s PHE 211 Ca -0.29 -1.24 -0.33 0.00 -0.96 0.00 0.00 56.93 54.11 1diq s PHE 211 Cb 0.09 -2.01 -0.17 0.00 -0.34 0.00 0.00 43.02 40.59 1diq s PHE 211 CO 0.38 -0.65 1.62 0.87 -1.46 0.00 0.00 175.22 175.97 1diq h LYS 212 N 7.96 -0.85 0.17 10.12 1.57 -1.88 -3.40 116.57 130.26 1diq h LYS 212 Ca -0.43 0.06 -0.01 0.00 -1.87 0.00 0.00 60.65 58.40 1diq h LYS 212 Cb 1.15 0.19 0.00 0.00 0.08 0.00 0.00 32.23 33.66 1diq h LYS 212 CO 0.62 -0.57 -0.08 -1.49 -0.57 0.00 0.00 179.45 177.36 1diq h TRP 213 N -0.88 -0.21 0.00 -1.35 -0.00 -1.97 -3.38 115.95 108.16 1diq h TRP 213 Ca -0.07 -0.00 0.00 0.00 -0.00 0.00 0.00 58.89 58.81 1diq h TRP 213 Cb 0.71 0.07 0.00 0.00 -0.00 0.00 0.00 29.16 29.94 1diq h TRP 213 CO -0.08 0.14 0.00 0.41 -0.00 0.00 0.00 178.44 178.91 1diq n GLY 214 N -0.16 0.58 3.06 1.49 0.00 -1.26 -4.22 105.19 104.68 1diq n GLY 214 Ca -0.09 -1.03 -0.11 0.00 0.00 0.00 0.00 46.02 44.80 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 0.09 0.00 1.61 6.14 -1.26 -5.02 117.35 118.91 1diq s TYR 215 Ca 0.00 -0.20 0.00 0.00 0.64 0.00 0.00 57.07 57.51 1diq s TYR 215 Cb 0.00 -0.08 0.00 0.00 0.42 0.00 0.00 41.96 42.30 1diq s TYR 215 CO 0.00 -0.24 0.00 0.41 0.64 0.00 0.00 175.55 176.36 1diq n GLY 216 N 1.64 -1.97 3.77 8.97 0.00 -1.26 -4.83 105.19 111.50 1diq n GLY 216 Ca -0.22 -1.39 -0.40 0.00 0.00 0.00 0.00 46.02 44.00 1diq n GLY 216 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1diq n PRO 217 N -0.11 2.40 -3.52 1.61 -0.04 -1.26 -4.95 135.00 129.13 1diq n PRO 217 Ca 0.00 0.85 -0.42 0.00 -0.04 0.00 0.00 63.50 63.89 1diq n PRO 217 Cb 0.00 -2.65 -0.10 0.00 -0.04 0.00 0.00 33.50 30.71 1diq n PRO 217 CO 0.00 0.00 0.00 -0.08 -0.04 0.00 0.00 175.50 175.38 1diq s THR 218 N -1.17 4.89 -2.36 0.52 -1.32 -1.26 -4.96 115.64 109.97 1diq s THR 218 Ca 0.59 -0.87 0.22 0.00 -1.21 0.00 0.00 61.69 60.41 1diq s THR 218 Cb -0.46 -3.78 0.44 0.00 -1.51 0.00 0.00 72.50 67.19 1diq s THR 218 CO 0.60 -0.34 1.49 0.18 -2.21 0.00 0.00 174.62 174.33 1diq n LEU 219 N 5.08 2.28 -0.22 9.08 7.99 -1.26 -4.56 117.00 135.38 1diq n LEU 219 Ca -0.11 -0.96 0.01 0.00 -0.01 0.00 0.00 56.01 54.94 1diq n LEU 219 Cb 0.46 -0.15 0.13 0.00 -0.11 0.00 0.00 43.42 43.74 1diq n LEU 219 CO 0.40 0.48 1.02 0.44 -1.51 0.00 0.00 177.39 178.22 1diq h ASP 220 N 3.01 0.34 -0.27 -1.43 3.32 -1.96 -1.83 116.42 117.60 1diq h ASP 220 Ca 0.00 0.07 -0.02 0.00 0.02 0.00 0.00 57.03 57.10 1diq h ASP 220 Cb 0.66 0.02 -0.02 0.00 0.22 0.00 0.00 39.33 40.22 1diq h ASP 220 CO 0.00 0.19 0.12 1.23 -1.72 0.00 0.00 179.24 179.06 1diq h GLY 221 N 0.50 0.48 1.62 2.75 0.00 -1.95 -2.65 103.07 103.83 1diq h GLY 221 Ca 0.33 -0.22 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1diq h GLY 221 CO -0.29 0.21 0.18 1.98 0.00 0.00 0.00 176.54 178.62 1diq h MET 222 N 0.45 0.50 0.00 4.80 1.85 -1.64 -2.77 114.93 118.13 1diq h MET 222 Ca 0.11 -0.05 -0.04 0.00 -0.61 0.00 0.00 59.70 59.11 1diq h MET 222 Cb 0.11 -0.10 -0.01 0.00 0.43 0.00 0.00 31.60 32.03 1diq h MET 222 CO -0.01 0.38 -0.49 0.74 -0.40 0.00 0.00 176.91 177.13 1diq h PHE 223 N 0.50 0.00 -3.50 1.39 0.04 -1.47 -3.42 116.94 110.49 1diq h PHE 223 Ca 0.13 0.00 -0.52 0.00 2.80 0.00 0.00 57.97 60.38 1diq h PHE 223 Cb 0.04 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.18 1diq h PHE 223 CO 0.00 0.18 0.39 0.95 -0.60 0.00 0.00 178.31 179.24 1diq s THR 224 N -3.15 4.47 -1.57 -1.55 -4.23 -1.05 -3.11 115.64 105.45 1diq s THR 224 Ca 0.04 1.96 -0.04 0.00 -1.18 0.00 0.00 61.69 62.47 1diq s THR 224 Cb 0.07 -4.25 0.00 0.00 1.34 0.00 0.00 72.50 69.66 1diq s THR 224 CO 0.73 0.26 0.51 0.00 -0.54 0.00 0.00 174.62 175.58 1diq n GLN 225 N 3.10 -4.37 -4.22 3.99 6.02 0.44 -4.98 117.38 117.36 1diq n GLN 225 Ca 0.04 0.92 -0.13 0.00 -0.01 0.00 0.00 57.00 57.81 1diq n GLN 225 Cb 0.49 -5.72 -0.10 0.00 1.02 0.00 0.00 30.24 25.93 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 -3.15 1.29 -0.49 -1.58 0.00 -1.18 -4.64 121.76 112.01 1diq s ALA 226 Ca 0.25 -1.76 0.07 0.00 0.00 0.00 0.00 51.96 50.53 1diq s ALA 226 Cb -0.11 1.39 0.38 0.00 0.00 0.00 0.00 23.12 24.77 1diq s ALA 226 CO 0.31 -0.59 0.98 0.27 0.00 0.00 0.00 175.76 176.73 1diq n ASN 227 N -0.45 3.91 -0.45 0.00 0.23 -1.26 -4.78 115.26 112.46 1diq n ASN 227 Ca 0.03 -3.55 0.05 0.00 -0.53 0.00 0.00 54.58 50.58 1diq n ASN 227 Cb 0.66 -0.53 0.08 0.00 -2.08 0.00 0.00 39.78 37.90 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 -0.25 0.18 0.00 -2.53 4.01 -1.26 -4.75 117.16 112.56 1diq n TYR 228 Ca 0.31 -0.24 0.00 0.00 -0.16 0.00 0.00 57.90 57.81 1diq n TYR 228 Cb 0.54 -0.01 0.00 0.00 -0.31 0.00 0.00 39.34 39.56 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 0.44 1.54 3.37 2.72 0.00 -1.26 -4.65 105.19 107.35 1diq n GLY 229 Ca 0.07 -0.80 -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 4.15 -0.07 -0.61 1.01 -0.63 -4.92 121.20 118.13 1diq s ILE 230 Ca 0.00 -0.64 -0.30 0.00 0.00 0.00 0.00 60.65 59.71 1diq s ILE 230 Cb 0.00 -3.14 -0.04 0.00 0.01 0.00 0.00 42.46 39.29 1diq s ILE 230 CO 0.00 0.06 1.39 0.00 0.00 0.00 0.00 174.94 176.39 1diq n THR 232 N 5.07 0.13 -3.79 0.00 -2.24 -0.51 -4.77 114.28 108.17 1diq n THR 232 Ca 0.14 -0.28 -0.13 0.00 -2.27 0.00 0.00 64.05 61.52 1diq n THR 232 Cb 0.44 0.06 -0.12 0.00 -2.10 0.00 0.00 70.33 68.61 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 -2.64 0.24 -0.05 -0.78 1.02 -1.20 -4.04 119.74 112.30 1diq s LYS 233 Ca -0.04 0.32 -0.03 0.00 0.02 0.00 0.00 55.97 56.24 1diq s LYS 233 Cb 0.06 0.09 0.02 0.00 -0.52 0.00 0.00 37.83 37.49 1diq s LYS 233 CO 0.43 -0.04 0.11 1.41 -0.92 0.00 0.00 175.35 176.34 1diq s MET 234 N 0.24 0.09 0.06 1.68 1.75 -0.48 -0.68 119.30 121.96 1diq s MET 234 Ca -0.01 0.24 0.05 0.00 -1.25 0.00 0.00 55.69 54.72 1diq s MET 234 Cb -0.02 -0.08 -0.04 0.00 2.84 0.00 0.00 34.83 37.53 1diq s MET 234 CO -0.01 -0.10 -0.06 0.20 -0.65 0.00 0.00 175.02 174.40 1diq s GLY 235 N 0.65 1.81 0.15 2.11 0.00 0.16 -1.27 107.32 110.93 1diq s GLY 235 Ca -0.05 -1.13 -0.17 0.00 0.00 0.00 0.00 44.72 43.37 1diq s GLY 235 CO -0.03 -1.07 0.44 -0.11 0.00 0.00 0.00 173.10 172.34 1diq s PHE 236 N -1.16 -0.17 0.09 1.90 -0.71 -0.33 -0.38 117.98 117.22 1diq s PHE 236 Ca 0.21 -0.15 -0.18 0.00 -1.04 0.00 0.00 56.93 55.77 1diq s PHE 236 Cb -0.11 0.30 -0.07 0.00 -1.21 0.00 0.00 43.02 41.93 1diq s PHE 236 CO 0.13 -0.77 0.56 -1.58 -1.34 0.00 0.00 175.22 172.21 1diq s TRP 237 N -3.83 3.74 -0.02 3.49 0.51 -0.27 -0.70 118.94 121.87 1diq s TRP 237 Ca 0.05 1.20 0.03 0.00 -2.12 0.00 0.00 56.10 55.27 1diq s TRP 237 Cb 0.01 -2.45 -0.03 0.00 -0.81 0.00 0.00 33.47 30.18 1diq s TRP 237 CO -0.09 0.54 -0.09 -0.51 -0.51 0.00 0.00 176.95 176.29 1diq s LEU 238 N -1.37 3.06 0.12 2.99 1.43 -0.55 -4.91 118.68 119.44 1diq s LEU 238 Ca 0.32 -0.15 -0.30 0.00 -1.03 0.00 0.00 54.13 52.97 1diq s LEU 238 Cb -0.18 -1.72 -0.06 0.00 0.03 0.00 0.00 46.19 44.26 1diq s LEU 238 CO 0.19 0.31 0.95 -0.32 0.23 0.00 0.00 176.35 177.70 1diq s MET 239 N -1.18 4.71 0.33 1.70 -2.45 -1.20 -4.66 119.30 116.53 1diq s MET 239 Ca 0.15 1.44 -0.28 0.00 -1.25 0.00 0.00 55.69 55.75 1diq s MET 239 Cb -0.11 -3.37 -0.09 0.00 1.25 0.00 0.00 34.83 32.51 1diq s MET 239 CO 0.05 0.25 1.12 -1.25 1.05 0.00 0.00 175.02 176.24 1diq s PRO 240 N -0.14 4.43 -0.03 4.11 0.04 -1.26 -0.52 135.00 141.63 1diq s PRO 240 Ca 0.46 1.78 -0.31 0.00 0.04 0.00 0.00 61.00 62.97 1diq s PRO 240 Cb -0.23 -2.96 -0.09 0.00 0.04 0.00 0.00 34.50 31.25 1diq s PRO 240 CO 0.30 0.02 1.99 1.17 0.04 0.00 0.00 177.00 180.52 1diq n LYS 241 N 0.72 2.59 -2.85 4.56 4.81 0.93 -4.75 118.16 124.17 1diq n LYS 241 Ca 0.01 0.93 -0.34 0.00 -0.87 0.00 0.00 58.31 58.04 1diq n LYS 241 Cb 0.46 -2.94 -0.07 0.00 0.02 0.00 0.00 35.03 32.50 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 4.62 4.31 0.32 1.64 0.04 -1.26 -4.98 135.00 139.68 1diq s PRO 242 Ca 0.92 1.13 0.03 0.00 0.04 0.00 0.00 61.00 63.11 1diq s PRO 242 Cb -0.49 -2.40 0.61 0.00 0.04 0.00 0.00 34.50 32.26 1diq s PRO 242 CO 0.44 0.09 1.91 -1.00 0.04 0.00 0.00 177.00 178.47 1diq h PRO 243 N 2.34 0.91 -4.91 0.56 0.13 -1.94 -3.43 132.00 125.66 1diq h PRO 243 Ca -0.48 -0.05 -0.44 0.00 -0.87 0.00 0.00 66.00 64.16 1diq h PRO 243 Cb 1.18 -0.20 -0.29 0.00 0.13 0.00 0.00 31.00 31.81 1diq h PRO 243 CO 0.63 0.60 -0.79 0.54 -0.23 0.00 0.00 178.00 178.74 1diq s VAL 244 N -5.84 0.88 -0.14 1.56 0.11 -0.73 -5.02 120.40 111.23 1diq s VAL 244 Ca -0.11 -0.46 0.01 0.00 -2.93 0.00 0.00 61.98 58.49 1diq s VAL 244 Cb 0.20 -0.75 0.02 0.00 -1.53 0.00 0.00 36.38 34.32 1diq s VAL 244 CO 0.79 0.26 -0.17 0.12 -3.33 0.00 0.00 175.10 172.77 1diq s PHE 245 N -0.16 2.33 -0.39 1.54 2.19 -1.26 -2.80 117.98 119.42 1diq s PHE 245 Ca 0.03 -1.23 0.03 0.00 0.33 0.00 0.00 56.93 56.09 1diq s PHE 245 Cb -0.05 -1.65 0.11 0.00 -1.31 0.00 0.00 43.02 40.12 1diq s PHE 245 CO -0.00 -0.62 0.13 0.21 1.83 0.00 0.00 175.22 176.77 1diq s LYS 246 N 1.13 1.48 0.33 10.12 2.20 -0.09 -5.00 119.74 129.90 1diq s LYS 246 Ca -0.02 -1.97 -0.15 0.00 -0.36 0.00 0.00 55.97 53.47 1diq s LYS 246 Cb -0.14 -2.97 -0.09 0.00 -1.51 0.00 0.00 37.83 33.12 1diq s LYS 246 CO -0.06 -1.01 0.75 -1.25 -0.36 0.00 0.00 175.35 173.42 1diq s PRO 247 N 0.64 4.02 0.19 4.03 0.04 -1.26 -1.45 135.00 141.21 1diq s PRO 247 Ca 0.13 0.70 -0.15 0.00 0.04 0.00 0.00 61.00 61.72 1diq s PRO 247 Cb -0.21 -2.43 0.02 0.00 0.04 0.00 0.00 34.50 31.92 1diq s PRO 247 CO -0.08 0.15 0.46 -0.59 0.04 0.00 0.00 177.00 176.99 1diq s PHE 248 N -1.98 0.01 0.07 0.56 -0.12 -0.89 -4.05 117.98 111.57 1diq s PHE 248 Ca 0.54 -0.36 0.04 0.00 -0.05 0.00 0.00 56.93 57.11 1diq s PHE 248 Cb -0.10 0.28 -0.03 0.00 -0.63 0.00 0.00 43.02 42.54 1diq s PHE 248 CO 0.17 -0.87 -0.12 -2.00 -0.05 0.00 0.00 175.22 172.36 1diq s GLU 249 N -3.90 0.76 -0.20 1.99 2.12 -0.54 -1.62 118.70 117.31 1diq s GLU 249 Ca 0.11 -0.95 -0.03 0.00 0.36 0.00 0.00 54.97 54.47 1diq s GLU 249 Cb 0.00 -0.66 0.06 0.00 0.26 0.00 0.00 34.13 33.80 1diq s GLU 249 CO -0.02 0.14 0.03 0.08 -0.54 0.00 0.00 175.26 174.94 1diq s VAL 250 N -1.50 0.58 -0.17 3.70 1.01 -0.00 -1.48 120.40 122.54 1diq s VAL 250 Ca -0.03 -0.60 -0.19 0.00 0.00 0.00 0.00 61.98 61.17 1diq s VAL 250 Cb -0.09 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.18 1diq s VAL 250 CO 0.02 -0.20 0.52 -0.63 0.00 0.00 0.00 175.10 174.81 1diq s ILE 251 N 1.83 5.12 -0.00 2.22 1.01 0.06 -1.44 121.20 129.99 1diq s ILE 251 Ca -0.01 1.00 0.05 0.00 0.00 0.00 0.00 60.65 61.68 1diq s ILE 251 Cb -0.17 -3.85 -0.03 0.00 0.01 0.00 0.00 42.46 38.42 1diq s ILE 251 CO -0.08 0.22 -0.14 -0.36 0.00 0.00 0.00 174.94 174.58 1diq s PHE 252 N 1.34 2.70 -0.07 3.97 0.08 0.12 -1.24 117.98 124.87 1diq s PHE 252 Ca 0.26 -0.16 -0.19 0.00 0.12 0.00 0.00 56.93 56.95 1diq s PHE 252 Cb -0.15 -1.57 -0.30 0.00 -0.57 0.00 0.00 43.02 40.43 1diq s PHE 252 CO 0.10 0.26 0.74 0.93 -0.10 0.00 0.00 175.22 177.15 1diq h GLU 253 N 4.85 0.28 -6.14 0.44 3.07 -1.94 0.31 114.58 115.45 1diq h GLU 253 Ca -0.47 -0.48 -0.58 0.00 -0.50 0.00 0.00 59.36 57.33 1diq h GLU 253 Cb 1.16 0.18 -0.03 0.00 -0.84 0.00 0.00 28.75 29.21 1diq h GLU 253 CO 0.50 1.23 -0.34 -0.51 -1.40 0.00 0.00 179.01 178.50 1diq s ASP 254 N -7.02 6.46 0.39 1.42 1.01 -1.26 -3.76 116.67 113.91 1diq s ASP 254 Ca -0.16 0.53 0.17 0.00 0.71 0.00 0.00 52.55 53.79 1diq s ASP 254 Cb 0.03 -2.07 0.79 0.00 1.01 0.00 0.00 42.92 42.68 1diq s ASP 254 CO 0.80 0.05 1.82 -0.08 0.21 0.00 0.00 175.17 177.98 1diq h GLU 255 N 2.75 0.00 -0.00 8.23 4.81 -1.92 -2.71 114.58 125.75 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 0.72 0.36 -0.04 0.00 -0.73 0.00 0.00 179.01 179.32 1diq n ALA 256 N -2.38 2.62 0.44 2.92 0.00 -1.26 -3.62 120.51 119.23 1diq n ALA 256 Ca -0.01 -0.20 0.12 0.00 0.00 0.00 0.00 53.44 53.35 1diq n ALA 256 Cb 0.43 -1.43 0.48 0.00 0.00 0.00 0.00 19.45 18.92 1diq n ALA 256 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1diq n ASP 257 N -1.11 0.71 -0.33 0.00 8.00 -1.02 -3.70 116.55 119.11 1diq n ASP 257 Ca 0.16 0.65 0.14 0.00 0.71 0.00 0.00 54.79 56.45 1diq n ASP 257 Cb 0.24 -0.81 0.36 0.00 -0.02 0.00 0.00 41.12 40.89 1diq n ASP 257 CO 0.00 0.00 0.00 -0.29 -0.39 0.00 0.00 177.20 176.52 1diq h ILE 258 N 0.00 0.71 -0.42 0.53 6.09 -1.78 -2.23 117.51 120.41 1diq h ILE 258 Ca 0.00 -0.24 -0.00 0.00 -1.37 0.00 0.00 64.86 63.25 1diq h ILE 258 Cb 0.45 -0.04 -0.02 0.00 0.47 0.00 0.00 36.82 37.68 1diq h ILE 258 CO 0.00 0.13 0.26 0.58 -3.07 0.00 0.00 178.15 176.05 1diq h VAL 259 N 0.69 1.13 0.00 2.19 2.07 -1.71 -2.27 116.25 118.34 1diq h VAL 259 Ca 0.55 -0.28 -0.13 0.00 0.82 0.00 0.00 66.70 67.66 1diq h VAL 259 Cb 0.95 0.56 -0.02 0.00 -1.52 0.00 0.00 31.29 31.26 1diq h VAL 259 CO -0.32 0.13 -0.61 -0.33 0.02 0.00 0.00 177.57 176.46 1diq h GLU 260 N 0.56 0.00 0.07 1.57 5.08 -1.71 -2.90 114.58 117.26 1diq h GLU 260 Ca 0.15 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.51 1diq h GLU 260 Cb -0.02 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.23 1diq h GLU 260 CO -0.03 0.61 -0.03 0.82 -1.00 0.00 0.00 179.01 179.38 1diq h ILE 261 N 0.00 1.18 -0.16 3.13 2.04 -1.25 -2.35 117.51 120.10 1diq h ILE 261 Ca -0.01 -0.92 -0.01 0.00 1.00 0.00 0.00 64.86 64.93 1diq h ILE 261 Cb 1.38 1.77 -0.01 0.00 -0.74 0.00 0.00 36.82 39.22 1diq h ILE 261 CO 0.08 0.23 0.07 0.58 0.00 0.00 0.00 178.15 179.11 1diq h VAL 262 N -0.51 1.14 0.00 1.67 2.07 -1.50 -0.80 116.25 118.31 1diq h VAL 262 Ca -0.01 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 1diq h VAL 262 Cb 0.44 1.11 -0.01 0.00 -1.52 0.00 0.00 31.29 31.32 1diq h VAL 262 CO 0.02 0.13 -0.18 0.44 0.02 0.00 0.00 177.57 178.00 1diq h ASP 263 N 0.12 0.00 0.67 0.57 3.32 -1.59 -1.16 116.42 118.35 1diq h ASP 263 Ca 0.05 0.00 -0.26 0.00 0.02 0.00 0.00 57.03 56.84 1diq h ASP 263 Cb 0.14 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 1diq h ASP 263 CO -0.01 0.18 -1.44 0.00 -1.72 0.00 0.00 179.24 176.25 1diq h ALA 264 N 1.82 0.58 0.02 3.45 0.00 -1.23 -3.36 119.26 120.55 1diq h ALA 264 Ca -0.00 -1.24 -0.21 0.00 0.00 0.00 0.00 54.91 53.46 1diq h ALA 264 Cb 0.42 0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.44 1diq h ALA 264 CO 0.02 1.43 -0.94 1.25 0.00 0.00 0.00 179.25 181.02 1diq h LEU 265 N 0.01 0.26 -0.29 0.00 5.85 -0.72 -3.38 115.31 117.03 1diq h LEU 265 Ca -0.18 -0.22 0.07 0.00 0.84 0.00 0.00 57.88 58.38 1diq h LEU 265 Cb 1.92 -0.08 -0.07 0.00 0.37 0.00 0.00 40.66 42.80 1diq h LEU 265 CO 0.10 1.06 -0.19 -0.09 -0.34 0.00 0.00 178.44 178.98 1diq h ARG 266 N 0.10 -0.15 0.00 1.25 2.43 -1.37 -1.60 114.38 115.04 1diq h ARG 266 Ca -0.05 0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.12 1diq h ARG 266 Cb 1.59 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 31.17 1diq h ARG 266 CO 0.14 -0.10 -0.06 -1.35 -1.51 0.00 0.00 179.97 177.09 1diq h PRO 267 N -0.16 0.00 0.01 0.20 0.11 -1.79 -0.68 132.00 129.69 1diq h PRO 267 Ca 0.16 0.00 -0.20 0.00 0.11 0.00 0.00 66.00 66.06 1diq h PRO 267 Cb 0.39 0.00 -0.02 0.00 0.11 0.00 0.00 31.00 31.48 1diq h PRO 267 CO -0.39 0.06 -0.95 -0.07 -0.21 0.00 0.00 178.00 176.44 1diq h LEU 268 N 0.00 0.07 0.21 2.35 3.38 -1.53 -2.52 115.31 117.26 1diq h LEU 268 Ca -0.00 -0.06 -0.28 0.00 0.09 0.00 0.00 57.88 57.62 1diq h LEU 268 Cb 0.20 -0.02 0.03 0.00 0.09 0.00 0.00 40.66 40.96 1diq h LEU 268 CO 0.01 0.98 -1.23 0.03 0.09 0.00 0.00 178.44 178.31 1diq h ARG 269 N 0.02 0.47 -0.46 1.13 2.47 -0.56 -0.96 114.38 116.49 1diq h ARG 269 Ca -0.02 -0.78 -0.08 0.00 -1.26 0.00 0.00 59.98 57.84 1diq h ARG 269 Cb 1.66 0.29 -0.02 0.00 -1.65 0.00 0.00 29.97 30.25 1diq h ARG 269 CO 0.13 1.37 -0.03 1.98 0.56 0.00 0.00 179.97 183.98 1diq h MET 270 N -0.01 0.77 -0.00 0.04 4.05 -1.22 -2.24 114.93 116.31 1diq h MET 270 Ca -0.21 -0.22 0.00 0.00 -0.28 0.00 0.00 59.70 58.99 1diq h MET 270 Cb 1.97 -0.09 0.00 0.00 -0.80 0.00 0.00 31.60 32.68 1diq h MET 270 CO 0.23 0.80 -0.15 -1.13 0.23 0.00 0.00 176.91 176.89 1diq n SER 271 N -4.21 0.42 -0.86 1.39 3.41 -0.95 -4.94 113.62 107.88 1diq n SER 271 Ca 0.02 -0.37 -0.11 0.00 -0.26 0.00 0.00 58.87 58.15 1diq n SER 271 Cb 0.31 -0.09 -0.04 0.00 -0.26 0.00 0.00 64.21 64.13 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 -1.10 -4.27 -0.00 4.04 5.15 -0.84 -4.92 115.26 113.32 1diq n ASN 272 Ca 0.12 0.25 -0.12 0.00 -0.60 0.00 0.00 54.58 54.23 1diq n ASN 272 Cb 0.30 -2.78 -0.08 0.00 -0.53 0.00 0.00 39.78 36.69 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 1.22 -3.33 -0.44 2.02 -1.46 -3.27 112.91 107.65 1diq h THR 273 Ca -0.23 -0.66 -0.74 0.00 0.77 0.00 0.00 66.41 65.56 1diq h THR 273 Cb 0.74 1.61 -0.23 0.00 -1.74 0.00 0.00 68.15 68.53 1diq h THR 273 CO 0.33 0.18 -0.35 -0.63 0.37 0.00 0.00 175.52 175.41 1diq s ILE 274 N -5.11 5.09 -1.35 3.11 1.01 -0.79 -4.90 121.20 118.26 1diq s ILE 274 Ca -0.15 -1.10 0.27 0.00 0.00 0.00 0.00 60.65 59.68 1diq s ILE 274 Cb 0.04 -4.04 0.25 0.00 0.01 0.00 0.00 42.46 38.72 1diq s ILE 274 CO 0.68 -0.56 1.69 -0.81 0.00 0.00 0.00 174.94 175.94 1diq n PRO 275 N 5.16 0.37 -3.62 2.79 -0.04 -1.24 -4.35 135.00 134.07 1diq n PRO 275 Ca -0.12 -0.16 -0.20 0.00 -0.04 0.00 0.00 63.50 62.98 1diq n PRO 275 Cb 0.44 -1.50 -0.01 0.00 -0.04 0.00 0.00 33.50 32.38 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 -2.74 5.83 -0.36 3.54 4.22 -1.26 -4.30 114.94 119.88 1diq s ASN 276 Ca 0.20 -0.24 -0.28 0.00 -2.14 0.00 0.00 52.86 50.40 1diq s ASN 276 Cb 0.19 -1.24 -0.02 0.00 1.28 0.00 0.00 41.25 41.46 1diq s ASN 276 CO 0.56 -0.36 1.81 -0.44 -2.04 0.00 0.00 177.10 176.63 1diq s SER 277 N -4.10 5.81 0.21 3.54 0.01 -1.20 -4.93 113.70 113.04 1diq s SER 277 Ca 0.43 1.21 -0.30 0.00 1.31 0.00 0.00 55.95 58.60 1diq s SER 277 Cb -0.09 -2.53 -0.08 0.00 0.21 0.00 0.00 66.02 63.54 1diq s SER 277 CO 0.30 -1.79 0.95 -0.69 0.41 0.00 0.00 173.24 172.42 1diq s VAL 278 N 7.17 4.15 -0.15 3.43 1.01 -1.07 -4.78 120.40 130.15 1diq s VAL 278 Ca 0.79 2.07 -0.03 0.00 0.00 0.00 0.00 61.98 64.81 1diq s VAL 278 Cb -0.21 -4.32 -0.02 0.00 0.00 0.00 0.00 36.38 31.82 1diq s VAL 278 CO 0.32 0.46 -0.06 -0.69 0.00 0.00 0.00 175.10 175.13 1diq s VAL 279 N -0.91 3.70 -0.52 2.92 1.01 -1.01 0.54 120.40 126.13 1diq s VAL 279 Ca 0.42 -0.42 0.00 0.00 0.00 0.00 0.00 61.98 61.98 1diq s VAL 279 Cb -0.26 -2.61 0.14 0.00 0.00 0.00 0.00 36.38 33.65 1diq s VAL 279 CO 0.32 0.50 0.30 -0.63 0.00 0.00 0.00 175.10 175.58 1diq s ILE 280 N 0.41 3.09 0.01 2.22 1.01 -0.46 -0.80 121.20 126.69 1diq s ILE 280 Ca -0.05 -2.88 -0.22 0.00 0.00 0.00 0.00 60.65 57.50 1diq s ILE 280 Cb -0.15 -3.09 -0.05 0.00 0.01 0.00 0.00 42.46 39.18 1diq s ILE 280 CO 0.03 -0.79 0.64 0.00 0.00 0.00 0.00 174.94 174.82 1diq s ALA 281 N 0.15 3.46 0.84 9.38 0.00 0.39 -1.80 121.76 134.19 1diq s ALA 281 Ca 0.15 0.09 -0.11 0.00 0.00 0.00 0.00 51.96 52.09 1diq s ALA 281 Cb -0.22 -2.80 0.09 0.00 0.00 0.00 0.00 23.12 20.19 1diq s ALA 281 CO -0.03 0.16 1.09 -1.54 0.00 0.00 0.00 175.76 175.44 1diq s SER 282 N -0.22 3.98 0.25 0.00 1.04 0.10 -0.67 113.70 118.18 1diq s SER 282 Ca 0.33 1.59 -0.03 0.00 0.48 0.00 0.00 55.95 58.31 1diq s SER 282 Cb -0.19 -2.28 0.40 0.00 0.10 0.00 0.00 66.02 64.05 1diq s SER 282 CO 0.19 -2.33 1.84 0.00 0.98 0.00 0.00 173.24 173.91 1diq h THR 283 N -1.34 0.98 -0.06 2.02 1.03 -1.58 -0.28 112.91 113.68 1diq h THR 283 Ca -0.47 -0.32 -0.13 0.00 -0.01 0.00 0.00 66.41 65.48 1diq h THR 283 Cb 1.26 -0.04 -0.01 0.00 -1.07 0.00 0.00 68.15 68.29 1diq h THR 283 CO 0.54 0.17 -0.57 -0.07 -0.01 0.00 0.00 175.52 175.58 1diq h LEU 284 N 0.93 0.20 -0.09 0.00 4.07 -1.90 0.10 115.31 118.62 1diq h LEU 284 Ca 0.41 -0.11 -0.05 0.00 0.08 0.00 0.00 57.88 58.21 1diq h LEU 284 Cb 0.30 -0.06 -0.00 0.00 1.08 0.00 0.00 40.66 41.98 1diq h LEU 284 CO -0.22 0.73 -0.15 -0.25 -1.08 0.00 0.00 178.44 177.47 1diq h TRP 285 N 0.13 0.33 -0.62 1.13 2.91 -1.68 -1.62 115.95 116.54 1diq h TRP 285 Ca -0.00 -0.11 0.05 0.00 1.13 0.00 0.00 58.89 59.96 1diq h TRP 285 Cb 1.05 -0.06 -0.05 0.00 -0.51 0.00 0.00 29.16 29.58 1diq h TRP 285 CO 0.01 0.75 0.34 1.49 -1.03 0.00 0.00 178.44 180.00 1diq h GLU 286 N -0.19 0.62 0.16 2.65 4.57 -0.87 -1.83 114.58 119.69 1diq h GLU 286 Ca 0.01 -0.04 -0.01 0.00 -1.18 0.00 0.00 59.36 58.14 1diq h GLU 286 Cb 0.72 -0.14 0.00 0.00 -0.16 0.00 0.00 28.75 29.17 1diq h GLU 286 CO 0.03 0.41 -0.08 0.00 -1.18 0.00 0.00 179.01 178.20 1diq h ALA 287 N 1.32 -0.21 -0.92 2.92 0.00 -0.74 -2.03 119.26 119.60 1diq h ALA 287 Ca 0.27 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.20 1diq h ALA 287 Cb 0.15 0.08 -0.06 0.00 0.00 0.00 0.00 17.79 17.97 1diq h ALA 287 CO -0.17 -0.62 0.60 0.78 0.00 0.00 0.00 179.25 179.84 1diq h GLY 288 N -0.21 1.35 2.00 0.00 0.00 -1.03 -1.11 103.07 104.06 1diq h GLY 288 Ca -0.02 -0.43 -0.01 0.00 0.00 0.00 0.00 47.33 46.87 1diq h GLY 288 CO 0.03 0.31 -0.04 1.48 0.00 0.00 0.00 176.54 178.33 1diq h SER 289 N 1.06 0.00 -0.12 0.19 4.64 -1.07 -2.53 113.55 115.73 1diq h SER 289 Ca 0.39 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.71 1diq h SER 289 Cb 0.18 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.27 1diq h SER 289 CO -0.15 0.04 0.00 0.00 -0.87 0.00 0.00 176.83 175.85 1diq n ALA 290 N -2.11 2.53 -2.83 5.18 0.00 -0.46 -4.75 120.51 118.07 1diq n ALA 290 Ca 0.02 -0.55 -0.10 0.00 0.00 0.00 0.00 53.44 52.81 1diq n ALA 290 Cb 0.42 -1.08 0.03 0.00 0.00 0.00 0.00 19.45 18.83 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 0.45 -1.10 -3.69 0.00 8.25 -0.95 -4.96 115.22 113.22 1diq n HIS 291 Ca 0.17 0.36 -0.37 0.00 -0.26 0.00 0.00 57.72 57.63 1diq n HIS 291 Cb 0.38 -2.65 -0.07 0.00 1.12 0.00 0.00 29.99 28.78 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 -3.50 4.32 0.28 2.41 1.43 -0.95 -5.03 118.68 117.64 1diq s LEU 292 Ca 0.21 0.51 0.06 0.00 -1.03 0.00 0.00 54.13 53.88 1diq s LEU 292 Cb -0.09 -2.25 -0.02 0.00 0.03 0.00 0.00 46.19 43.86 1diq s LEU 292 CO 0.26 0.26 0.38 0.42 0.23 0.00 0.00 176.35 177.90 1diq s THR 293 N -0.31 4.65 0.16 5.49 -4.23 -1.26 -4.28 115.64 115.86 1diq s THR 293 Ca 0.15 -1.05 -0.07 0.00 -1.18 0.00 0.00 61.69 59.54 1diq s THR 293 Cb -0.13 -3.62 -0.06 0.00 1.34 0.00 0.00 72.50 70.04 1diq s THR 293 CO 0.04 -0.26 1.47 -0.09 -0.54 0.00 0.00 174.62 175.25 1diq h ARG 294 N 1.10 0.73 -0.04 3.99 2.43 -1.64 -3.25 114.38 117.71 1diq h ARG 294 Ca -0.49 -0.44 0.01 0.00 -0.81 0.00 0.00 59.98 58.25 1diq h ARG 294 Cb 1.24 0.04 -0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1diq h ARG 294 CO 0.58 1.07 0.09 0.00 -1.51 0.00 0.00 179.97 180.20 1diq h ALA 295 N 0.85 1.34 -0.37 2.80 0.00 -1.81 -0.42 119.26 121.65 1diq h ALA 295 Ca 0.02 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1diq h ALA 295 Cb 1.08 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.87 1diq h ALA 295 CO 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 179.25 179.24 1diq n GLN 296 N -3.37 2.01 0.00 0.00 10.64 -1.23 -4.14 117.38 121.29 1diq n GLN 296 Ca -0.02 -1.39 0.00 0.00 -1.83 0.00 0.00 57.00 53.76 1diq n GLN 296 Cb 0.17 -1.37 0.00 0.00 -0.86 0.00 0.00 30.24 28.19 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 0.57 0.00 -3.61 2.61 4.02 -0.28 -5.06 117.16 115.42 1diq n TYR 297 Ca 0.13 0.00 -0.11 0.00 -0.01 0.00 0.00 57.90 57.91 1diq n TYR 297 Cb 0.37 0.00 -0.06 0.00 -0.02 0.00 0.00 39.34 39.63 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 -1.25 0.00 -0.30 -0.72 -1.32 -0.53 -5.04 115.64 106.47 1diq s THR 298 Ca 0.00 0.00 0.03 0.00 -1.21 0.00 0.00 61.69 60.51 1diq s THR 298 Cb 0.00 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.03 1diq s THR 298 CO 0.00 0.00 0.74 0.35 -2.21 0.00 0.00 174.62 173.50 1diq n THR 299 N 1.61 0.32 -2.04 5.08 -2.24 -1.26 -3.91 114.28 111.85 1diq n THR 299 Ca -0.12 -0.66 -0.41 0.00 -2.27 0.00 0.00 64.05 60.59 1diq n THR 299 Cb 0.57 0.88 -0.02 0.00 -2.10 0.00 0.00 70.33 69.65 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 -0.48 4.30 0.89 -0.78 2.56 -1.26 -5.01 118.70 118.92 1diq s GLU 300 Ca 0.04 2.29 -0.11 0.00 0.00 0.00 0.00 54.97 57.19 1diq s GLU 300 Cb 0.02 -3.06 0.13 0.00 2.00 0.00 0.00 34.13 33.22 1diq s GLU 300 CO 0.04 -0.28 1.09 -1.25 -0.56 0.00 0.00 175.26 174.30 1diq s PRO 301 N -1.66 1.29 1.08 4.30 0.04 -1.26 -4.87 135.00 133.93 1diq s PRO 301 Ca 0.51 0.98 0.00 0.00 0.04 0.00 0.00 61.00 62.53 1diq s PRO 301 Cb -0.41 -1.80 0.00 0.00 0.04 0.00 0.00 34.50 32.33 1diq s PRO 301 CO 0.54 -2.26 0.00 0.41 0.04 0.00 0.00 177.00 175.72 1diq n GLY 302 N -0.86 -1.81 3.66 0.56 0.00 -1.26 -4.95 105.19 100.53 1diq n GLY 302 Ca 0.08 -1.55 -0.29 0.00 0.00 0.00 0.00 46.02 44.26 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 2.05 -0.41 1.61 -3.43 -1.18 -4.77 115.29 109.16 1diq s HIS 303 Ca 0.00 1.08 -0.26 0.00 -0.80 0.00 0.00 55.06 55.08 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 -2.90 0.94 0.99 -2.00 0.00 0.00 174.74 171.77 1diq s THR 304 N -2.90 4.51 0.72 -5.38 2.01 -1.26 -5.02 115.64 108.32 1diq s THR 304 Ca 0.65 1.03 -0.16 0.00 0.31 0.00 0.00 61.69 63.52 1diq s THR 304 Cb -0.19 -4.40 0.02 0.00 0.01 0.00 0.00 72.50 67.94 1diq s THR 304 CO 0.58 -0.69 1.12 -2.65 -0.69 0.00 0.00 174.62 172.30 1diq n PRO 305 N 7.01 0.63 0.12 4.92 -0.02 -1.26 -4.85 135.00 141.56 1diq n PRO 305 Ca 0.07 0.28 0.17 0.00 -2.02 0.00 0.00 63.50 61.99 1diq n PRO 305 Cb 0.48 -2.37 0.72 0.00 -0.02 0.00 0.00 33.50 32.32 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 -0.14 0.00 -0.45 2.55 5.19 -1.99 -2.01 116.42 119.57 1diq h ASP 306 Ca -0.48 0.00 -0.12 0.00 -0.62 0.00 0.00 57.03 55.80 1diq h ASP 306 Cb 1.33 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 -0.20 0.77 -3.12 0.00 0.00 179.24 177.18 1diq h SER 307 N 0.00 0.95 1.83 6.45 4.64 -1.99 -1.36 113.55 124.08 1diq h SER 307 Ca 0.14 -0.40 0.00 0.00 -0.47 0.00 0.00 61.79 61.07 1diq h SER 307 Cb 0.63 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 62.45 1diq h SER 307 CO -0.00 1.14 -0.00 1.62 -0.87 0.00 0.00 176.83 178.71 1diq h VAL 308 N 0.77 0.00 0.21 0.95 3.04 -1.74 -2.15 116.25 117.32 1diq h VAL 308 Ca 0.10 -0.83 -0.32 0.00 -1.01 0.00 0.00 66.70 64.65 1diq h VAL 308 Cb 0.77 1.83 0.03 0.00 -2.01 0.00 0.00 31.29 31.91 1diq h VAL 308 CO 0.06 0.00 -1.39 0.40 -1.01 0.00 0.00 177.57 175.63 1diq h ILE 309 N 0.00 1.33 -0.12 3.17 2.04 -1.30 -1.26 117.51 121.38 1diq h ILE 309 Ca 0.00 -2.74 -0.09 0.00 1.00 0.00 0.00 64.86 63.03 1diq h ILE 309 Cb 0.91 2.96 -0.01 0.00 -0.74 0.00 0.00 36.82 39.94 1diq h ILE 309 CO 0.00 0.82 -0.34 0.11 0.00 0.00 0.00 178.15 178.74 1diq h LYS 310 N 0.15 0.23 -0.22 2.37 1.79 -1.20 -1.77 116.57 117.91 1diq h LYS 310 Ca -0.22 -0.09 -0.20 0.00 -2.18 0.00 0.00 60.65 57.96 1diq h LYS 310 Cb 2.08 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 32.73 1diq h LYS 310 CO 0.25 0.55 -0.64 0.37 -1.08 0.00 0.00 179.45 178.91 1diq h GLN 311 N 0.20 0.81 -0.52 3.15 5.75 -1.36 -3.02 115.11 120.11 1diq h GLN 311 Ca 0.02 -0.57 -0.01 0.00 -0.15 0.00 0.00 58.65 57.94 1diq h GLN 311 Cb 0.71 0.09 -0.03 0.00 1.07 0.00 0.00 27.48 29.32 1diq h GLN 311 CO 0.05 1.19 0.28 0.52 -2.65 0.00 0.00 178.83 178.22 1diq h MET 312 N 0.59 0.71 -0.33 1.69 2.86 -0.72 -2.44 114.93 117.28 1diq h MET 312 Ca -0.01 -0.07 -0.14 0.00 -2.06 0.00 0.00 59.70 57.41 1diq h MET 312 Cb 1.25 -0.15 -0.01 0.00 0.06 0.00 0.00 31.60 32.76 1diq h MET 312 CO 0.14 0.53 -0.36 1.96 1.06 0.00 0.00 176.91 180.23 1diq h GLN 313 N 0.72 0.77 -0.11 1.72 4.20 -1.24 -3.04 115.11 118.13 1diq h GLN 313 Ca 0.18 -0.38 -0.05 0.00 0.06 0.00 0.00 58.65 58.46 1diq h GLN 313 Cb 0.03 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.81 1diq h GLN 313 CO -0.03 1.01 -0.13 0.87 -0.67 0.00 0.00 178.83 179.88 1diq h LYS 314 N 0.64 0.28 0.00 1.46 1.57 -1.35 -0.48 116.57 118.69 1diq h LYS 314 Ca 0.06 -0.16 -0.05 0.00 -1.87 0.00 0.00 60.65 58.63 1diq h LYS 314 Cb 0.91 0.01 -0.01 0.00 0.08 0.00 0.00 32.23 33.22 1diq h LYS 314 CO 0.08 0.71 -0.25 -0.44 -0.57 0.00 0.00 179.45 178.98 1diq h ASP 315 N -0.14 0.00 0.00 0.86 3.32 -1.51 -3.33 116.42 115.62 1diq h ASP 315 Ca 0.01 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.01 1diq h ASP 315 Cb 0.67 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.21 1diq h ASP 315 CO 0.03 0.25 -1.33 1.07 -1.72 0.00 0.00 179.24 177.54 1diq n THR 316 N -4.23 0.20 -0.26 0.35 5.66 -1.15 -5.04 114.28 109.81 1diq n THR 316 Ca -0.02 -0.19 0.00 0.00 -3.05 0.00 0.00 64.05 60.79 1diq n THR 316 Cb 0.30 -0.27 0.00 0.00 -1.55 0.00 0.00 70.33 68.81 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 0.81 3.84 1.09 0.00 -0.19 -5.08 105.19 108.08 1diq n GLY 317 Ca -0.05 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.66 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 -0.74 3.30 0.27 1.61 -1.94 -1.21 -5.04 119.30 115.55 1diq s MET 318 Ca 0.00 0.88 0.02 0.00 -1.71 0.00 0.00 55.69 54.88 1diq s MET 318 Cb 0.00 -2.04 0.02 0.00 2.01 0.00 0.00 34.83 34.82 1diq s MET 318 CO 0.00 -0.81 0.18 0.41 -0.01 0.00 0.00 175.02 174.79 1diq n GLY 319 N -2.24 3.03 0.18 -0.03 0.00 -1.26 -4.64 105.19 100.24 1diq n GLY 319 Ca 0.07 -2.24 -0.08 0.00 0.00 0.00 0.00 46.02 43.77 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 0.77 0.74 -3.42 4.61 0.00 -0.47 -3.34 119.26 118.15 1diq h ALA 320 Ca -0.18 -0.55 -0.41 0.00 0.00 0.00 0.00 54.91 53.77 1diq h ALA 320 Cb 0.63 -0.08 -0.35 0.00 0.00 0.00 0.00 17.79 18.00 1diq h ALA 320 CO 0.28 0.73 -0.77 -1.58 0.00 0.00 0.00 179.25 177.91 1diq s TRP 321 N -3.79 0.72 -0.25 0.00 0.52 -1.12 -2.31 118.94 112.72 1diq s TRP 321 Ca -0.05 -0.20 0.02 0.00 0.02 0.00 0.00 56.10 55.89 1diq s TRP 321 Cb 0.11 -0.69 0.06 0.00 -1.15 0.00 0.00 33.47 31.80 1diq s TRP 321 CO 0.82 -0.22 -0.10 -0.80 0.02 0.00 0.00 176.95 176.67 1diq s ASN 322 N 1.14 4.21 -0.16 2.95 0.01 0.15 -0.71 114.94 122.54 1diq s ASN 322 Ca -0.08 -1.30 -0.12 0.00 -0.71 0.00 0.00 52.86 50.65 1diq s ASN 322 Cb -0.14 -1.44 -0.05 0.00 0.41 0.00 0.00 41.25 40.04 1diq s ASN 322 CO -0.01 -0.19 0.24 -0.22 -1.51 0.00 0.00 177.10 175.41 1diq s LEU 323 N 1.20 4.26 -0.15 0.60 2.96 -0.52 -0.46 118.68 126.56 1diq s LEU 323 Ca -0.07 0.45 0.02 0.00 -0.22 0.00 0.00 54.13 54.31 1diq s LEU 323 Cb -0.19 -2.28 0.01 0.00 0.50 0.00 0.00 46.19 44.22 1diq s LEU 323 CO -0.06 0.15 -0.21 -0.31 -1.32 0.00 0.00 176.35 174.61 1diq s TYR 324 N 0.25 2.70 0.37 5.38 2.02 0.02 -0.82 117.35 127.27 1diq s TYR 324 Ca 0.14 -1.38 0.05 0.00 -0.37 0.00 0.00 57.07 55.52 1diq s TYR 324 Cb -0.13 -1.84 -0.02 0.00 -0.40 0.00 0.00 41.96 39.58 1diq s TYR 324 CO 0.03 -0.64 0.20 0.00 -1.57 0.00 0.00 175.55 173.56 1diq n ALA 325 N 4.17 0.62 -3.61 3.71 0.00 -0.64 -2.40 120.51 122.36 1diq n ALA 325 Ca -0.20 -2.00 -0.14 0.00 0.00 0.00 0.00 53.44 51.10 1diq n ALA 325 Cb 0.51 1.45 -0.07 0.00 0.00 0.00 0.00 19.45 21.34 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 -3.19 -1.75 -0.10 0.00 0.00 -1.26 -2.10 121.76 113.35 1diq s ALA 326 Ca 0.28 1.92 -0.03 0.00 0.00 0.00 0.00 51.96 54.13 1diq s ALA 326 Cb 0.01 -1.03 -0.03 0.00 0.00 0.00 0.00 23.12 22.07 1diq s ALA 326 CO 0.20 -0.34 0.00 -0.51 0.00 0.00 0.00 175.76 175.11 1diq s LEU 327 N 0.20 3.55 0.15 0.00 1.02 -0.53 -4.30 118.68 118.77 1diq s LEU 327 Ca -0.01 0.10 0.06 0.00 0.02 0.00 0.00 54.13 54.29 1diq s LEU 327 Cb -0.04 -1.83 -0.04 0.00 0.02 0.00 0.00 46.19 44.30 1diq s LEU 327 CO 0.02 0.33 -0.12 -0.31 0.02 0.00 0.00 176.35 176.29 1diq s TYR 328 N -0.59 1.39 -2.76 0.29 2.02 -1.26 -0.91 117.35 115.52 1diq s TYR 328 Ca 0.10 -0.64 0.00 0.00 -0.37 0.00 0.00 57.07 56.16 1diq s TYR 328 Cb -0.12 -0.70 0.00 0.00 -0.40 0.00 0.00 41.96 40.74 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 0.09 0.73 3.91 0.71 0.00 -1.12 -4.65 105.19 104.85 1diq n GLY 329 Ca -0.12 -2.00 -0.27 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 -1.78 3.79 0.27 2.61 -4.23 -1.26 -1.76 115.64 113.27 1diq s THR 330 Ca 0.00 0.14 -0.01 0.00 -1.18 0.00 0.00 61.69 60.63 1diq s THR 330 Cb 0.00 -3.51 0.26 0.00 1.34 0.00 0.00 72.50 70.59 1diq s THR 330 CO 0.00 -0.56 1.84 -0.61 -0.54 0.00 0.00 174.62 174.75 1diq h GLN 331 N -0.22 0.94 -0.13 3.99 5.75 -1.95 -0.21 115.11 123.27 1diq h GLN 331 Ca -0.45 -0.06 -0.15 0.00 -0.15 0.00 0.00 58.65 57.84 1diq h GLN 331 Cb 1.25 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 29.58 1diq h GLN 331 CO 0.61 0.62 -0.56 0.93 -2.65 0.00 0.00 178.83 177.79 1diq h GLU 332 N 0.97 0.41 -0.31 1.69 3.07 -1.99 -0.43 114.58 117.99 1diq h GLU 332 Ca 0.45 -0.26 -0.07 0.00 -0.50 0.00 0.00 59.36 58.98 1diq h GLU 332 Cb 0.38 0.03 -0.01 0.00 -0.84 0.00 0.00 28.75 28.31 1diq h GLU 332 CO -0.24 0.85 -0.09 1.96 -1.40 0.00 0.00 179.01 180.10 1diq h GLN 333 N 0.31 0.61 -0.53 2.33 4.20 -1.67 -2.74 115.11 117.62 1diq h GLN 333 Ca 0.00 -0.24 -0.11 0.00 0.06 0.00 0.00 58.65 58.36 1diq h GLN 333 Cb 1.07 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.80 1diq h GLN 333 CO 0.10 0.80 -0.11 0.28 -0.67 0.00 0.00 178.83 179.23 1diq h VAL 334 N 0.38 1.27 -0.61 -0.54 2.07 -0.94 -2.59 116.25 115.29 1diq h VAL 334 Ca 0.08 -1.26 -0.06 0.00 0.82 0.00 0.00 66.70 66.28 1diq h VAL 334 Cb 0.58 0.98 -0.03 0.00 -1.52 0.00 0.00 31.29 31.31 1diq h VAL 334 CO 0.03 0.45 0.15 0.44 0.02 0.00 0.00 177.57 178.66 1diq h ASP 335 N 0.89 0.88 0.72 0.57 3.32 -1.03 0.88 116.42 122.65 1diq h ASP 335 Ca 0.14 -0.17 -0.20 0.00 0.02 0.00 0.00 57.03 56.83 1diq h ASP 335 Cb 0.68 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.98 1diq h ASP 335 CO 0.05 0.85 -0.90 -0.37 -1.72 0.00 0.00 179.24 177.15 1diq h VAL 336 N 0.90 1.55 -0.03 -1.35 -1.51 -1.45 -2.61 116.25 111.76 1diq h VAL 336 Ca 0.20 -2.82 -0.18 0.00 -1.23 0.00 0.00 66.70 62.67 1diq h VAL 336 Cb 0.31 2.57 -0.01 0.00 -2.13 0.00 0.00 31.29 32.03 1diq h VAL 336 CO -0.00 0.81 -0.76 0.78 -1.23 0.00 0.00 177.57 177.17 1diq h ASN 337 N 0.06 0.29 -0.18 4.19 2.35 -1.27 -2.49 115.58 118.52 1diq h ASN 337 Ca -0.04 -0.20 -0.11 0.00 -0.55 0.00 0.00 56.30 55.40 1diq h ASN 337 Cb 1.56 -0.09 -0.01 0.00 0.05 0.00 0.00 38.32 39.83 1diq h ASN 337 CO 0.13 0.94 -0.26 -0.25 -1.65 0.00 0.00 177.43 176.34 1diq h TRP 338 N 0.15 0.74 -0.28 1.19 2.91 -0.78 -0.79 115.95 119.09 1diq h TRP 338 Ca -0.03 -0.17 -0.11 0.00 1.13 0.00 0.00 58.89 59.71 1diq h TRP 338 Cb 1.33 -0.17 -0.01 0.00 -0.51 0.00 0.00 29.16 29.79 1diq h TRP 338 CO 0.03 0.84 -0.27 -0.22 -1.03 0.00 0.00 178.44 177.79 1diq h LYS 339 N 0.56 0.56 -0.15 2.65 3.11 -1.33 -0.91 116.57 121.06 1diq h LYS 339 Ca 0.08 -0.23 -0.11 0.00 -2.81 0.00 0.00 60.65 57.58 1diq h LYS 339 Cb 0.74 -0.03 0.00 0.00 -1.00 0.00 0.00 32.23 31.95 1diq h LYS 339 CO 0.06 0.78 -0.35 0.82 -2.81 0.00 0.00 179.45 177.95 1diq h ILE 340 N 0.49 1.36 -0.29 2.00 2.04 -1.03 -2.59 117.51 119.48 1diq h ILE 340 Ca 0.07 -1.61 -0.04 0.00 1.00 0.00 0.00 64.86 64.28 1diq h ILE 340 Cb 0.72 2.00 -0.01 0.00 -0.74 0.00 0.00 36.82 38.80 1diq h ILE 340 CO 0.06 0.49 0.04 0.58 0.00 0.00 0.00 178.15 179.31 1diq h VAL 341 N 0.12 1.24 -0.66 1.67 2.07 -1.06 -2.80 116.25 116.82 1diq h VAL 341 Ca -0.00 -0.82 0.03 0.00 0.82 0.00 0.00 66.70 66.72 1diq h VAL 341 Cb 0.95 1.22 -0.04 0.00 -1.52 0.00 0.00 31.29 31.90 1diq h VAL 341 CO 0.08 0.27 0.42 0.74 0.02 0.00 0.00 177.57 179.09 1diq h THR 342 N 0.29 1.09 -0.29 2.57 2.02 -1.23 -2.55 112.91 114.81 1diq h THR 342 Ca 0.09 -0.28 -0.09 0.00 0.77 0.00 0.00 66.41 66.89 1diq h THR 342 Cb 0.36 0.20 -0.01 0.00 -1.74 0.00 0.00 68.15 66.96 1diq h THR 342 CO 0.01 0.15 -0.20 0.44 0.37 0.00 0.00 175.52 176.28 1diq h ASP 343 N 0.82 0.54 -0.52 4.18 3.45 -1.44 -1.06 116.42 122.39 1diq h ASP 343 Ca 0.27 -0.17 -0.04 0.00 0.43 0.00 0.00 57.03 57.51 1diq h ASP 343 Cb 0.01 -0.15 -0.02 0.00 -0.56 0.00 0.00 39.33 38.61 1diq h ASP 343 CO -0.10 0.75 0.15 0.58 -1.57 0.00 0.00 179.24 179.04 1diq h VAL 344 N 0.48 1.24 -0.01 -1.35 2.07 -1.19 -0.77 116.25 116.72 1diq h VAL 344 Ca 0.08 -0.81 -0.17 0.00 0.82 0.00 0.00 66.70 66.62 1diq h VAL 344 Cb 0.62 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.16 1diq h VAL 344 CO 0.04 0.30 -0.77 -0.26 0.02 0.00 0.00 177.57 176.90 1diq h PHE 345 N 0.71 0.14 -0.20 1.57 0.04 -1.28 -2.84 116.94 115.08 1diq h PHE 345 Ca 0.16 -0.07 -0.08 0.00 2.80 0.00 0.00 57.97 60.79 1diq h PHE 345 Cb 0.30 -0.02 -0.00 0.00 2.20 0.00 0.00 35.95 38.43 1diq h PHE 345 CO 0.02 0.83 -0.18 -0.22 -0.60 0.00 0.00 178.31 178.15 1diq h LYS 346 N 0.06 0.48 0.00 1.51 3.64 -1.03 -2.93 116.57 118.29 1diq h LYS 346 Ca -0.02 -0.25 -0.01 0.00 -1.27 0.00 0.00 60.65 59.11 1diq h LYS 346 Cb 1.36 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 33.18 1diq h LYS 346 CO 0.11 0.82 -0.03 0.87 -2.27 0.00 0.00 179.45 178.94 1diq h LYS 347 N 0.16 0.00 0.03 1.90 1.57 -1.12 -2.06 116.57 117.04 1diq h LYS 347 Ca 0.03 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.56 1diq h LYS 347 Cb 0.72 0.00 0.01 0.00 0.08 0.00 0.00 32.23 33.04 1diq h LYS 347 CO 0.05 0.03 -1.04 -0.07 -0.57 0.00 0.00 179.45 177.84 1diq h LEU 348 N 0.00 0.72 0.17 2.94 3.38 -1.32 -3.48 115.31 117.71 1diq h LEU 348 Ca -0.00 -0.60 -0.13 0.00 0.09 0.00 0.00 57.88 57.25 1diq h LEU 348 Cb 0.12 -0.22 0.01 0.00 0.09 0.00 0.00 40.66 40.66 1diq h LEU 348 CO 0.00 1.40 -0.18 0.61 0.09 0.00 0.00 178.44 180.36 1diq n GLY 349 N 1.09 0.26 3.20 0.83 0.00 -0.78 -5.04 105.19 104.76 1diq n GLY 349 Ca -0.09 -0.53 -0.13 0.00 0.00 0.00 0.00 46.02 45.27 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 0.09 1.61 1.02 -1.26 -5.13 119.74 111.88 1diq s LYS 350 Ca 0.07 -0.11 0.00 0.00 0.02 0.00 0.00 55.97 55.95 1diq s LYS 350 Cb -0.03 0.25 0.00 0.00 -0.52 0.00 0.00 37.83 37.53 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 1.66 -3.37 3.76 -3.33 0.00 -1.26 -4.86 105.19 97.79 1diq n GLY 351 Ca -0.20 -1.04 -0.38 0.00 0.00 0.00 0.00 46.02 44.41 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 -5.17 4.20 -0.23 1.61 3.52 -0.38 -4.87 118.95 117.63 1diq s ARG 352 Ca 0.00 0.40 -0.14 0.00 -0.13 0.00 0.00 55.73 55.86 1diq s ARG 352 Cb 0.00 -3.36 -0.04 0.00 -1.56 0.00 0.00 34.95 29.99 1diq s ARG 352 CO 0.00 0.35 0.34 0.42 -0.81 0.00 0.00 175.30 175.60 1diq s ILE 353 N 0.01 5.23 -0.11 4.11 1.01 -1.26 -0.76 121.20 129.42 1diq s ILE 353 Ca 0.24 0.55 0.04 0.00 0.00 0.00 0.00 60.65 61.48 1diq s ILE 353 Cb -0.15 -3.67 0.00 0.00 0.01 0.00 0.00 42.46 38.65 1diq s ILE 353 CO 0.11 0.25 -0.23 0.54 0.00 0.00 0.00 174.94 175.61 1diq s VAL 354 N 1.43 2.04 0.55 2.92 0.11 -0.55 -5.02 120.40 121.87 1diq s VAL 354 Ca 0.15 -0.99 0.08 0.00 -2.93 0.00 0.00 61.98 58.29 1diq s VAL 354 Cb -0.15 -1.77 0.06 0.00 -1.53 0.00 0.00 36.38 33.00 1diq s VAL 354 CO 0.08 0.55 0.66 0.42 -3.33 0.00 0.00 175.10 173.48 1diq s THR 355 N 0.49 2.09 0.43 5.04 -4.23 -1.26 -1.46 115.64 116.73 1diq s THR 355 Ca -0.15 -1.14 0.27 0.00 -1.18 0.00 0.00 61.69 59.48 1diq s THR 355 Cb -0.17 -2.23 0.29 0.00 1.34 0.00 0.00 72.50 71.73 1diq s THR 355 CO 0.06 0.00 2.08 -0.61 -0.54 0.00 0.00 174.62 175.61 1diq h GLN 356 N 0.39 0.00 0.01 3.99 4.15 -1.98 -2.57 115.11 119.11 1diq h GLN 356 Ca -0.33 0.00 -0.14 0.00 0.77 0.00 0.00 58.65 58.95 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 0.46 0.11 -0.56 0.93 -1.93 0.00 0.00 178.83 177.84 1diq h GLU 357 N 0.00 0.36 -0.22 1.69 4.39 -1.95 -0.82 114.58 118.02 1diq h GLU 357 Ca -0.00 -0.40 0.00 0.00 0.34 0.00 0.00 59.36 59.30 1diq h GLU 357 Cb 0.31 0.12 0.00 0.00 -0.10 0.00 0.00 28.75 29.08 1diq h GLU 357 CO 0.01 1.09 0.00 -0.85 -1.16 0.00 0.00 179.01 178.10 1diq n GLU 358 N -4.26 1.80 0.01 2.33 0.28 -1.14 -4.37 120.64 115.29 1diq n GLU 358 Ca -0.11 -1.22 0.00 0.00 -0.16 0.00 0.00 57.16 55.68 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 0.45 3.00 0.00 -1.84 0.00 -0.98 -4.92 120.51 116.22 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 0.34 0.22 0.00 0.00 0.00 0.00 0.00 19.45 20.01 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 2.18 0.30 0.32 0.00 0.00 -0.31 -1.31 105.19 106.37 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 1.34 0.00 0.00 0.00 173.32 174.66 1diq n ASP 361 N 0.61 1.08 -4.85 1.61 4.64 -1.26 -4.42 116.55 113.96 1diq n ASP 361 Ca 0.00 -1.16 -0.32 0.00 -1.38 0.00 0.00 54.79 51.93 1diq n ASP 361 Cb 0.00 0.02 -0.06 0.00 -1.04 0.00 0.00 41.12 40.05 1diq n ASP 361 CO 0.00 0.00 0.00 0.28 -0.82 0.00 0.00 177.20 176.66 1diq s THR 362 N -2.20 4.69 0.14 5.18 -1.32 -0.43 -4.89 115.64 116.81 1diq s THR 362 Ca 0.34 0.90 -0.03 0.00 -1.21 0.00 0.00 61.69 61.70 1diq s THR 362 Cb 0.20 -3.63 -0.05 0.00 -1.51 0.00 0.00 72.50 67.51 1diq s THR 362 CO 0.41 -0.26 0.34 -1.10 -2.21 0.00 0.00 174.62 171.79 1diq s GLN 363 N -3.18 3.55 0.00 7.08 -1.52 -1.26 -1.88 119.66 122.46 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 -2.89 1.42 0.00 -0.22 0.00 0.00 33.01 31.21 1diq s GLN 363 CO 0.20 0.49 1.98 -0.35 -0.25 0.00 0.00 175.29 177.35 1diq n PRO 364 N -0.06 0.63 -0.27 2.91 -0.04 -1.26 -4.92 135.00 132.00 1diq n PRO 364 Ca -0.04 -0.13 0.07 0.00 -0.04 0.00 0.00 63.50 63.37 1diq n PRO 364 Cb 0.52 -1.50 0.21 0.00 -0.04 0.00 0.00 33.50 32.69 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 0.31 0.53 -0.33 0.54 3.57 -1.95 -2.50 116.94 117.12 1diq h PHE 365 Ca 0.00 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.57 1diq h PHE 365 Cb 0.29 -0.11 -0.04 0.00 2.79 0.00 0.00 35.95 38.88 1diq h PHE 365 CO 0.00 0.04 0.11 -0.22 -2.23 0.00 0.00 178.31 176.01 1diq h LYS 366 N 0.43 0.25 -0.12 1.11 3.64 -1.58 -1.73 116.57 118.56 1diq h LYS 366 Ca 0.44 -0.01 -0.17 0.00 -1.27 0.00 0.00 60.65 59.64 1diq h LYS 366 Cb 0.72 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1diq h LYS 366 CO -0.44 0.16 -0.63 0.10 -2.27 0.00 0.00 179.45 176.38 1diq h TYR 367 N 0.26 0.58 -0.58 1.91 -0.00 -1.75 -2.20 116.97 115.19 1diq h TYR 367 Ca 0.15 -0.23 -0.10 0.00 0.00 0.00 0.00 58.73 58.55 1diq h TYR 367 Cb 0.12 -0.10 -0.02 0.00 0.00 0.00 0.00 36.73 36.72 1diq h TYR 367 CO -0.14 0.95 -0.04 0.00 -0.00 0.00 0.00 178.16 178.93 1diq h ARG 368 N 0.33 1.05 -0.24 0.10 3.08 -1.42 0.12 114.38 117.39 1diq h ARG 368 Ca -0.01 -0.36 -0.06 0.00 0.07 0.00 0.00 59.98 59.63 1diq h ARG 368 Cb 1.17 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 31.13 1diq h ARG 368 CO 0.11 1.05 -0.10 0.00 -1.07 0.00 0.00 179.97 179.96 1diq h ALA 369 N 0.96 1.38 -0.12 0.04 0.00 -1.21 -0.78 119.26 119.52 1diq h ALA 369 Ca 0.16 -0.23 -0.22 0.00 0.00 0.00 0.00 54.91 54.62 1diq h ALA 369 Cb 0.61 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.29 1diq h ALA 369 CO 0.04 0.43 -0.79 1.96 0.00 0.00 0.00 179.25 180.88 1diq h GLN 370 N 0.37 0.75 -0.17 0.00 4.20 -0.99 -3.04 115.11 116.22 1diq h GLN 370 Ca 0.07 -0.64 -0.08 0.00 0.06 0.00 0.00 58.65 58.06 1diq h GLN 370 Cb 0.41 0.14 -0.01 0.00 0.30 0.00 0.00 27.48 28.32 1diq h GLN 370 CO 0.02 1.25 -0.23 -0.07 -0.67 0.00 0.00 178.83 179.13 1diq h LEU 371 N 0.46 0.30 -0.05 1.46 4.07 -0.16 0.16 115.31 121.55 1diq h LEU 371 Ca -0.06 -0.09 0.00 0.00 0.08 0.00 0.00 57.88 57.81 1diq h LEU 371 Cb 1.43 -0.08 0.00 0.00 1.08 0.00 0.00 40.66 43.09 1diq h LEU 371 CO 0.16 0.55 -0.03 0.23 -1.08 0.00 0.00 178.44 178.27 1diq n MET 372 N -4.17 0.51 -0.10 1.13 2.81 -0.36 -3.32 117.12 113.62 1diq n MET 372 Ca -0.01 -0.05 0.03 0.00 -1.81 0.00 0.00 57.70 55.86 1diq n MET 372 Cb 0.36 -1.50 0.04 0.00 -0.71 0.00 0.00 33.22 31.41 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 -1.20 1.43 -1.44 7.83 3.41 -0.90 -4.56 113.62 118.18 1diq n SER 373 Ca 0.15 -2.17 -0.12 0.00 -0.26 0.00 0.00 58.87 56.48 1diq n SER 373 Cb 0.24 -0.17 0.00 0.00 -0.26 0.00 0.00 64.21 64.03 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 -0.63 -0.05 3.34 5.00 0.00 -0.87 -4.78 105.19 107.21 1diq n GLY 374 Ca 0.05 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.34 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 -2.67 3.74 0.44 1.61 1.01 -0.01 -4.60 120.40 119.93 1diq s VAL 375 Ca 0.06 -0.52 -0.25 0.00 0.00 0.00 0.00 61.98 61.27 1diq s VAL 375 Cb -0.03 -2.80 -0.08 0.00 0.00 0.00 0.00 36.38 33.47 1diq s VAL 375 CO 0.07 0.28 1.31 -2.84 0.00 0.00 0.00 175.10 173.92 1diq s PRO 376 N 1.51 3.75 -0.14 2.72 0.02 -1.26 -4.02 135.00 137.57 1diq s PRO 376 Ca 0.04 2.16 -0.30 0.00 0.02 0.00 0.00 61.00 62.92 1diq s PRO 376 Cb -0.16 -2.60 0.12 0.00 0.02 0.00 0.00 34.50 31.88 1diq s PRO 376 CO 0.00 -0.68 0.94 0.54 -0.33 0.00 0.00 177.00 177.48 1diq s ASN 377 N -0.82 -0.42 -0.26 2.53 2.20 -1.26 -4.97 114.94 111.94 1diq s ASN 377 Ca 0.61 0.45 0.11 0.00 -0.94 0.00 0.00 52.86 53.09 1diq s ASN 377 Cb -0.38 0.34 0.49 0.00 -2.00 0.00 0.00 41.25 39.70 1diq s ASN 377 CO 0.48 -0.39 1.42 0.18 -2.94 0.00 0.00 177.10 175.85 1diq n LEU 378 N 0.74 3.89 -0.29 3.54 4.32 -1.26 -4.57 117.00 123.37 1diq n LEU 378 Ca -0.12 -3.63 0.05 0.00 -0.02 0.00 0.00 56.01 52.29 1diq n LEU 378 Cb 0.58 -0.60 0.26 0.00 -1.62 0.00 0.00 43.42 42.03 1diq n LEU 378 CO 0.17 1.15 1.24 -0.61 -1.22 0.00 0.00 177.39 178.12 1diq h GLN 379 N 1.07 0.95 0.00 3.23 5.75 -1.95 -2.36 115.11 121.80 1diq h GLN 379 Ca 0.16 -0.06 0.00 0.00 -0.15 0.00 0.00 58.65 58.60 1diq h GLN 379 Cb 1.54 -0.21 0.00 0.00 1.07 0.00 0.00 27.48 29.88 1diq h GLN 379 CO 0.31 0.63 0.00 -1.91 -2.65 0.00 0.00 178.83 175.21 1diq n GLU 380 N -4.50 0.06 0.00 1.69 2.13 -1.26 -2.44 120.64 116.32 1diq n GLU 380 Ca 0.14 0.49 0.08 0.00 0.66 0.00 0.00 57.16 58.53 1diq n GLU 380 Cb 0.23 -1.68 0.41 0.00 0.27 0.00 0.00 31.44 30.67 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 -1.81 0.00 0.32 4.31 3.72 -0.89 -2.43 117.46 120.67 1diq n PHE 381 Ca 0.00 0.00 0.15 0.00 -0.05 0.00 0.00 57.45 57.55 1diq n PHE 381 Cb 0.06 -0.16 0.67 0.00 -0.94 0.00 0.00 39.48 39.11 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 2.46 0.00 2.00 1.37 0.00 -1.67 -2.29 103.07 104.93 1diq h GLY 382 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1diq h GLY 382 CO 0.00 0.00 -0.04 1.41 0.00 0.00 0.00 176.54 177.91 1diq h LEU 383 N 0.00 0.00 -0.07 3.11 3.38 -1.53 -0.04 115.31 120.16 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 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 1diq h LEU 383 CO 0.00 0.04 -0.05 -1.22 0.09 0.00 0.00 178.44 177.29 1diq n TYR 384 N -4.20 0.00 1.00 1.13 4.01 -0.86 -2.93 117.16 115.31 1diq n TYR 384 Ca -0.03 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.81 1diq n TYR 384 Cb 0.12 -0.27 -0.08 0.00 -0.31 0.00 0.00 39.34 38.80 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 -1.21 1.08 -0.34 7.72 3.02 -0.04 -2.67 115.26 122.81 1diq n ASN 385 Ca 0.13 -1.01 0.01 0.00 -0.03 0.00 0.00 54.58 53.68 1diq n ASN 385 Cb 0.26 0.90 0.15 0.00 -0.61 0.00 0.00 39.78 40.48 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 0.27 1.12 0.00 3.10 2.91 -1.44 -3.32 115.95 118.59 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 0.53 -0.37 0.00 0.00 -0.51 0.00 0.00 29.16 28.81 1diq h TRP 386 CO 0.00 0.60 -0.57 0.54 -1.03 0.00 0.00 178.44 177.98 1diq n ARG 387 N -4.53 2.57 0.00 2.65 1.74 -1.26 -1.86 116.66 115.96 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 0.15 -0.78 0.00 0.00 -1.02 0.00 0.00 32.46 30.81 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 1.47 -1.02 1.92 -0.13 0.00 -1.09 -4.80 105.19 101.54 1diq n GLY 388 Ca 0.00 -1.16 0.00 0.00 0.00 0.00 0.00 46.02 44.86 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 2.70 2.09 -0.02 0.00 -1.26 -3.98 105.19 104.71 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 0.39 3.31 -0.02 0.00 -1.26 -2.90 105.19 102.70 1diq n GLY 390 Ca 0.00 -0.79 -0.35 0.00 0.00 0.00 0.00 46.02 44.88 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 -2.87 1.60 -0.22 -0.02 0.00 -1.06 -4.45 107.32 100.29 1diq s GLY 391 Ca 0.00 -1.16 -0.15 0.00 0.00 0.00 0.00 44.72 43.41 1diq s GLY 391 CO 0.00 0.41 0.55 -0.45 0.00 0.00 0.00 173.10 173.61 1diq s SER 392 N 1.45 -0.67 0.00 1.64 0.15 -0.80 -1.79 113.70 113.68 1diq s SER 392 Ca 0.05 1.17 0.01 0.00 0.70 0.00 0.00 55.95 57.88 1diq s SER 392 Cb -0.14 1.10 -0.01 0.00 -1.71 0.00 0.00 66.02 65.26 1diq s SER 392 CO -0.03 -0.21 -0.03 -0.04 1.20 0.00 0.00 173.24 174.13 1diq s MET 393 N 1.05 0.26 -0.30 5.44 -1.94 -0.77 -4.25 119.30 118.79 1diq s MET 393 Ca -0.06 -0.22 -0.13 0.00 -1.71 0.00 0.00 55.69 53.57 1diq s MET 393 Cb -0.06 -0.18 -0.04 0.00 2.01 0.00 0.00 34.83 36.56 1diq s MET 393 CO -0.10 0.05 0.27 -1.58 -0.01 0.00 0.00 175.02 173.64 1diq s TRP 394 N -0.34 3.23 -0.36 -0.03 0.52 -1.19 -0.92 118.94 119.84 1diq s TRP 394 Ca -0.02 0.11 -0.12 0.00 0.02 0.00 0.00 56.10 56.09 1diq s TRP 394 Cb -0.03 -2.48 0.01 0.00 -1.15 0.00 0.00 33.47 29.82 1diq s TRP 394 CO -0.00 -0.25 0.22 0.12 0.02 0.00 0.00 176.95 177.06 1diq s PHE 395 N 1.86 3.22 -0.56 -1.98 5.36 -0.07 -4.75 117.98 121.06 1diq s PHE 395 Ca 0.09 -0.62 0.05 0.00 -0.96 0.00 0.00 56.93 55.49 1diq s PHE 395 Cb -0.16 -2.46 0.19 0.00 -0.34 0.00 0.00 43.02 40.24 1diq s PHE 395 CO 0.11 -0.52 0.47 0.00 -1.46 0.00 0.00 175.22 173.81 1diq n ALA 396 N 5.05 3.19 -1.32 11.12 0.00 -1.26 -0.45 120.51 136.83 1diq n ALA 396 Ca -0.12 -3.91 -0.30 0.00 0.00 0.00 0.00 53.44 49.11 1diq n ALA 396 Cb 0.48 -0.89 0.11 0.00 0.00 0.00 0.00 19.45 19.15 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 -0.97 1.83 -0.11 0.00 0.04 -1.12 -2.67 135.00 132.01 1diq s PRO 397 Ca 0.30 0.88 -0.03 0.00 0.04 0.00 0.00 61.00 62.20 1diq s PRO 397 Cb 0.03 -1.87 -0.03 0.00 0.04 0.00 0.00 34.50 32.67 1diq s PRO 397 CO -0.16 -1.86 0.01 0.08 0.04 0.00 0.00 177.00 175.11 1diq s VAL 398 N -2.98 4.33 0.11 -0.36 1.01 -1.04 -1.63 120.40 119.83 1diq s VAL 398 Ca 0.62 -0.23 -0.01 0.00 0.00 0.00 0.00 61.98 62.36 1diq s VAL 398 Cb -0.17 -2.85 -0.04 0.00 0.00 0.00 0.00 36.38 33.32 1diq s VAL 398 CO 0.56 0.57 0.02 -0.94 0.00 0.00 0.00 175.10 175.32 1diq s SER 399 N -0.56 0.43 0.36 3.32 1.04 -1.01 -4.74 113.70 112.53 1diq s SER 399 Ca 0.10 -1.14 -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 66.16 1diq s SER 399 CO 0.02 -0.68 1.18 -0.70 0.98 0.00 0.00 173.24 174.05 1diq s GLU 400 N -4.00 4.23 -1.58 4.02 2.12 -1.26 -0.69 118.70 121.54 1diq s GLU 400 Ca 0.19 1.90 -0.10 0.00 0.36 0.00 0.00 54.97 57.31 1diq s GLU 400 Cb 0.08 -2.85 -0.08 0.00 0.26 0.00 0.00 34.13 31.53 1diq s GLU 400 CO -0.02 -0.18 2.89 0.00 -0.54 0.00 0.00 175.26 177.41 1diq n ALA 401 N 0.43 7.34 -3.63 6.30 0.00 -0.18 -4.61 120.51 126.16 1diq n ALA 401 Ca 0.02 -3.47 -0.26 0.00 0.00 0.00 0.00 53.44 49.73 1diq n ALA 401 Cb 0.45 -3.37 -0.17 0.00 0.00 0.00 0.00 19.45 16.37 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 2.29 1.80 0.33 0.00 3.52 -1.26 -4.78 118.95 120.85 1diq s ARG 402 Ca 0.67 -0.41 0.11 0.00 -0.13 0.00 0.00 55.73 55.97 1diq s ARG 402 Cb 0.17 -1.59 0.92 0.00 -1.56 0.00 0.00 34.95 32.89 1diq s ARG 402 CO -0.06 -0.08 1.73 0.78 -0.81 0.00 0.00 175.30 176.87 1diq h GLY 403 N 7.41 1.82 1.81 8.12 0.00 -1.86 -2.21 103.07 118.16 1diq h GLY 403 Ca -0.31 -0.30 -0.10 0.00 0.00 0.00 0.00 47.33 46.62 1diq h GLY 403 CO 0.46 -0.23 -0.40 1.48 0.00 0.00 0.00 176.54 177.85 1diq h SER 404 N 0.55 0.22 -0.12 0.19 4.64 -1.93 -2.61 113.55 114.50 1diq h SER 404 Ca 0.64 -0.09 -0.20 0.00 -0.47 0.00 0.00 61.79 61.67 1diq h SER 404 Cb 1.27 -0.06 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1diq h SER 404 CO -0.45 0.60 -0.66 -0.33 -0.87 0.00 0.00 176.83 175.12 1diq h GLU 405 N 0.18 0.74 -0.60 4.77 4.39 -1.74 -1.74 114.58 120.59 1diq h GLU 405 Ca 0.02 -0.54 -0.10 0.00 0.34 0.00 0.00 59.36 59.08 1diq h GLU 405 Cb 0.79 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.51 1diq h GLU 405 CO 0.06 1.16 -0.02 0.00 -1.16 0.00 0.00 179.01 179.05 1diq h LYS 407 N 0.98 0.94 -0.23 0.00 3.64 -1.43 -1.40 116.57 119.07 1diq h LYS 407 Ca 0.17 -0.30 -0.02 0.00 -1.27 0.00 0.00 60.65 59.23 1diq h LYS 407 Cb 0.59 -0.09 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 1diq h LYS 407 CO 0.03 0.96 0.05 -0.22 -2.27 0.00 0.00 179.45 178.00 1diq h LYS 408 N 0.82 0.37 -0.48 1.90 3.64 -1.15 -2.38 116.57 119.29 1diq h LYS 408 Ca 0.15 -0.09 -0.09 0.00 -1.27 0.00 0.00 60.65 59.35 1diq h LYS 408 Cb 0.53 -0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.28 1diq h LYS 408 CO 0.03 0.49 -0.05 1.96 -2.27 0.00 0.00 179.45 179.61 1diq h GLN 409 N 0.19 0.83 -0.23 1.90 4.20 -1.16 -2.11 115.11 118.73 1diq h GLN 409 Ca 0.07 -0.25 -0.01 0.00 0.06 0.00 0.00 58.65 58.52 1diq h GLN 409 Cb 0.29 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 1diq h GLN 409 CO 0.00 0.87 0.09 0.00 -0.67 0.00 0.00 178.83 179.12 1diq h ALA 410 N 1.18 0.31 -0.59 3.87 0.00 -1.20 -1.68 119.26 121.14 1diq h ALA 410 Ca 0.14 -0.11 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 1diq h ALA 410 Cb 0.53 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.20 1diq h ALA 410 CO 0.03 -0.10 0.10 0.00 0.00 0.00 0.00 179.25 179.28 1diq h ALA 411 N 0.94 0.78 -0.45 0.00 0.00 -1.31 -1.09 119.26 118.13 1diq h ALA 411 Ca 0.08 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.72 1diq h ALA 411 Cb 0.18 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1diq h ALA 411 CO -0.01 0.52 0.19 0.52 0.00 0.00 0.00 179.25 180.48 1diq h MET 412 N 0.87 0.66 0.09 0.00 2.07 -1.27 -2.52 114.93 114.83 1diq h MET 412 Ca 0.18 -0.11 -0.00 0.00 -2.07 0.00 0.00 59.70 57.69 1diq h MET 412 Cb 0.41 -0.11 0.00 0.00 -1.87 0.00 0.00 31.60 30.03 1diq h MET 412 CO 0.01 0.59 -0.04 0.00 1.07 0.00 0.00 176.91 178.54 1diq h ALA 413 N 1.04 -0.12 -0.98 6.32 0.00 -1.18 -3.04 119.26 121.31 1diq h ALA 413 Ca 0.15 -0.15 0.16 0.00 0.00 0.00 0.00 54.91 55.07 1diq h ALA 413 Cb 0.17 0.05 -0.10 0.00 0.00 0.00 0.00 17.79 17.90 1diq h ALA 413 CO -0.01 -0.43 0.59 -0.22 0.00 0.00 0.00 179.25 179.18 1diq h LYS 414 N -0.40 0.79 -0.05 0.00 3.64 -1.17 -1.22 116.57 118.17 1diq h LYS 414 Ca -0.01 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.31 1diq h LYS 414 Cb 0.34 -0.18 -0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1diq h LYS 414 CO 0.02 0.52 -0.01 -0.09 -2.27 0.00 0.00 179.45 177.62 1diq h ARG 415 N 0.81 0.09 -0.15 1.90 2.43 -1.46 -1.65 114.38 116.35 1diq h ARG 415 Ca 0.53 -0.03 -0.10 0.00 -0.81 0.00 0.00 59.98 59.57 1diq h ARG 415 Cb 0.73 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.26 1diq h ARG 415 CO -0.34 0.43 -0.35 0.28 -1.51 0.00 0.00 179.97 178.48 1diq h VAL 416 N -0.26 1.29 -0.18 0.20 2.07 -1.33 -2.50 116.25 115.53 1diq h VAL 416 Ca 0.01 -1.39 -0.09 0.00 0.82 0.00 0.00 66.70 66.05 1diq h VAL 416 Cb 0.39 1.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.72 1diq h VAL 416 CO 0.00 0.42 -0.24 -0.07 0.02 0.00 0.00 177.57 177.71 1diq h LEU 417 N 0.26 0.52 -1.39 2.57 3.38 -1.19 -3.16 115.31 116.31 1diq h LEU 417 Ca 0.03 -0.51 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 1diq h LEU 417 Cb 0.74 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.33 1diq h LEU 417 CO 0.06 0.93 0.02 0.45 0.09 0.00 0.00 178.44 179.98 1diq h HIS 418 N 0.13 0.43 -0.33 1.13 3.86 -1.22 -0.46 115.15 118.69 1diq h HIS 418 Ca 0.02 -0.03 0.06 0.00 -1.16 0.00 0.00 60.37 59.26 1diq h HIS 418 Cb 0.80 -0.13 -0.02 0.00 1.06 0.00 0.00 27.41 29.12 1diq h HIS 418 CO 0.09 0.42 0.23 -0.22 0.86 0.00 0.00 177.93 179.30 1diq h LYS 419 N 0.41 0.20 -0.54 2.45 3.64 -1.41 0.54 116.57 121.85 1diq h LYS 419 Ca 0.09 -0.01 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 1diq h LYS 419 Cb 0.25 -0.04 0.00 0.00 -0.41 0.00 0.00 32.23 32.02 1diq h LYS 419 CO 0.00 0.13 0.00 0.66 -2.27 0.00 0.00 179.45 177.97 1diq n TYR 420 N -4.48 1.06 -2.23 1.91 4.01 -0.64 -4.95 117.16 111.83 1diq n TYR 420 Ca 0.04 -0.59 -0.13 0.00 -0.16 0.00 0.00 57.90 57.06 1diq n TYR 420 Cb 0.26 -0.15 -0.01 0.00 -0.31 0.00 0.00 39.34 39.13 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 0.86 -0.14 3.78 2.72 0.00 0.18 -4.90 105.19 107.70 1diq n GLY 421 Ca 0.21 -0.36 -0.23 0.00 0.00 0.00 0.00 46.02 45.65 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 -3.60 3.29 0.26 0.99 2.01 -0.27 -3.13 118.68 118.22 1diq s LEU 422 Ca 0.00 -0.81 0.06 0.00 0.01 0.00 0.00 54.13 53.38 1diq s LEU 422 Cb 0.00 -1.78 -0.03 0.00 0.01 0.00 0.00 46.19 44.39 1diq s LEU 422 CO 0.00 -0.44 0.37 -1.81 1.01 0.00 0.00 176.35 175.48 1diq s ASP 423 N -3.94 6.17 -0.73 2.29 -0.00 -1.26 -3.49 116.67 115.70 1diq s ASP 423 Ca 0.41 -0.02 -0.14 0.00 -0.00 0.00 0.00 52.55 52.80 1diq s ASP 423 Cb -0.01 -1.67 0.19 0.00 -0.00 0.00 0.00 42.92 41.42 1diq s ASP 423 CO 0.24 -0.15 0.67 -0.47 -0.00 0.00 0.00 175.17 175.46 1diq s TYR 424 N -2.04 3.59 -0.38 4.23 6.14 -1.26 -4.80 117.35 122.84 1diq s TYR 424 Ca 0.37 -1.79 -0.00 0.00 0.64 0.00 0.00 57.07 56.28 1diq s TYR 424 Cb -0.09 -3.80 0.10 0.00 0.42 0.00 0.00 41.96 38.60 1diq s TYR 424 CO 0.29 -1.00 0.13 0.54 0.64 0.00 0.00 175.55 176.16 1diq s VAL 425 N 0.62 2.91 0.16 3.14 0.11 -1.26 -4.67 120.40 121.42 1diq s VAL 425 Ca 0.13 -2.10 -0.03 0.00 -2.93 0.00 0.00 61.98 57.05 1diq s VAL 425 Cb -0.17 -3.02 -0.03 0.00 -1.53 0.00 0.00 36.38 31.63 1diq s VAL 425 CO -0.05 -0.61 0.13 0.00 -3.33 0.00 0.00 175.10 171.24 1diq s ALA 426 N 1.07 0.80 -0.02 1.54 0.00 -1.26 -1.12 121.76 122.77 1diq s ALA 426 Ca 0.08 -1.44 -0.19 0.00 0.00 0.00 0.00 51.96 50.41 1diq s ALA 426 Cb -0.21 1.06 0.04 0.00 0.00 0.00 0.00 23.12 24.00 1diq s ALA 426 CO -0.05 -0.56 0.41 -1.83 0.00 0.00 0.00 175.76 173.72 1diq s GLU 427 N -4.07 0.78 -0.20 0.00 -1.05 -0.59 -0.72 118.70 112.84 1diq s GLU 427 Ca 0.28 -0.09 -0.07 0.00 -0.15 0.00 0.00 54.97 54.94 1diq s GLU 427 Cb 0.06 0.35 -0.04 0.00 -0.44 0.00 0.00 34.13 34.07 1diq s GLU 427 CO 0.05 -0.23 0.06 -0.06 0.95 0.00 0.00 175.26 176.04 1diq s PHE 428 N -1.36 3.20 -0.33 4.83 0.08 -0.74 -0.83 117.98 122.82 1diq s PHE 428 Ca -0.12 -0.05 -0.10 0.00 0.12 0.00 0.00 56.93 56.78 1diq s PHE 428 Cb -0.04 -2.11 -0.00 0.00 -0.57 0.00 0.00 43.02 40.30 1diq s PHE 428 CO 0.05 0.03 0.18 0.42 -0.10 0.00 0.00 175.22 175.80 1diq s ILE 429 N 0.67 4.71 -0.19 0.64 1.01 -0.36 -1.36 121.20 126.32 1diq s ILE 429 Ca 0.03 -0.47 -0.12 0.00 0.00 0.00 0.00 60.65 60.09 1diq s ILE 429 Cb -0.13 -3.45 -0.05 0.00 0.01 0.00 0.00 42.46 38.84 1diq s ILE 429 CO 0.02 -0.00 0.22 0.54 0.00 0.00 0.00 174.94 175.72 1diq s VAL 430 N 1.62 5.35 0.48 2.92 0.11 0.19 -1.55 120.40 129.51 1diq s VAL 430 Ca 0.04 0.38 0.06 0.00 -2.93 0.00 0.00 61.98 59.53 1diq s VAL 430 Cb -0.17 -3.56 -0.00 0.00 -1.53 0.00 0.00 36.38 31.11 1diq s VAL 430 CO 0.07 0.39 0.31 0.00 -3.33 0.00 0.00 175.10 172.54 1diq s ALA 431 N 0.55 4.10 0.21 1.54 0.00 -0.42 -2.60 121.76 125.15 1diq s ALA 431 Ca 0.12 -1.55 -0.09 0.00 0.00 0.00 0.00 51.96 50.44 1diq s ALA 431 Cb -0.12 -0.63 0.28 0.00 0.00 0.00 0.00 23.12 22.65 1diq s ALA 431 CO 0.02 -0.30 1.78 -1.35 0.00 0.00 0.00 175.76 175.91 1diq h PRO 432 N 1.04 0.55 0.00 0.00 0.11 -1.93 -3.34 132.00 128.43 1diq h PRO 432 Ca -0.40 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.68 1diq h PRO 432 Cb 1.28 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.27 1diq h PRO 432 CO 0.62 0.37 -1.18 0.54 -0.21 0.00 0.00 178.00 178.14 1diq n ARG 433 N -4.88 0.98 -4.37 1.05 1.74 -1.26 -4.67 116.66 105.26 1diq n ARG 433 Ca 0.09 -0.06 -0.22 0.00 -0.77 0.00 0.00 57.85 56.90 1diq n ARG 433 Cb 0.24 -1.12 -0.11 0.00 -1.02 0.00 0.00 32.46 30.44 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 -2.68 2.88 -0.00 0.55 -4.77 -1.25 -1.01 116.67 110.39 1diq s ASP 434 Ca -0.02 -0.93 0.08 0.00 -3.30 0.00 0.00 52.55 48.38 1diq s ASP 434 Cb 0.05 -0.19 -0.02 0.00 -1.09 0.00 0.00 42.92 41.67 1diq s ASP 434 CO 0.32 -0.04 -0.23 -0.04 0.70 0.00 0.00 175.17 175.87 1diq s MET 435 N -3.10 2.09 -0.56 2.11 -1.94 0.13 -1.30 119.30 116.74 1diq s MET 435 Ca 0.20 -0.94 -0.13 0.00 -1.71 0.00 0.00 55.69 53.11 1diq s MET 435 Cb -0.05 -2.09 0.14 0.00 2.01 0.00 0.00 34.83 34.84 1diq s MET 435 CO 0.08 0.56 0.48 -1.01 -0.01 0.00 0.00 175.02 175.12 1diq s HIS 436 N -0.71 3.39 -0.83 -0.03 3.76 -0.60 -2.41 115.29 117.86 1diq s HIS 436 Ca 0.11 -1.66 -0.25 0.00 -0.15 0.00 0.00 55.06 53.11 1diq s HIS 436 Cb -0.10 -3.67 0.04 0.00 1.11 0.00 0.00 32.58 29.96 1diq s HIS 436 CO 0.01 -1.00 1.30 -1.58 -0.85 0.00 0.00 174.74 172.62 1diq s HIS 437 N 1.24 2.43 -0.39 1.40 2.46 -0.65 -1.23 115.29 120.54 1diq s HIS 437 Ca 0.07 -0.40 -0.19 0.00 0.47 0.00 0.00 55.06 55.01 1diq s HIS 437 Cb -0.25 -4.61 0.01 0.00 -0.13 0.00 0.00 32.58 27.60 1diq s HIS 437 CO -0.00 -1.98 0.53 0.08 -2.47 0.00 0.00 174.74 170.90 1diq s VAL 438 N 5.23 4.98 -0.15 0.89 1.01 -0.01 -2.79 120.40 129.57 1diq s VAL 438 Ca 0.37 0.08 -0.02 0.00 0.00 0.00 0.00 61.98 62.41 1diq s VAL 438 Cb -0.06 -4.05 -0.02 0.00 0.00 0.00 0.00 36.38 32.25 1diq s VAL 438 CO 0.06 -0.38 -0.07 -0.63 0.00 0.00 0.00 175.10 174.07 1diq s ILE 439 N 2.44 3.56 -0.47 2.22 1.01 0.40 -1.55 121.20 128.82 1diq s ILE 439 Ca 0.18 -0.47 -0.15 0.00 0.00 0.00 0.00 60.65 60.20 1diq s ILE 439 Cb -0.15 -2.54 0.07 0.00 0.01 0.00 0.00 42.46 39.84 1diq s ILE 439 CO 0.15 0.50 0.39 -0.62 0.00 0.00 0.00 174.94 175.36 1diq s ASP 440 N 0.39 6.12 -0.72 3.58 3.68 -0.27 -0.89 116.67 128.56 1diq s ASP 440 Ca -0.06 -1.32 -0.23 0.00 2.13 0.00 0.00 52.55 53.06 1diq s ASP 440 Cb -0.15 -2.17 0.07 0.00 -1.45 0.00 0.00 42.92 39.21 1diq s ASP 440 CO 0.04 -0.64 1.07 0.68 0.13 0.00 0.00 175.17 176.46 1diq s VAL 441 N 1.63 4.21 -0.09 1.11 -7.23 -0.10 -4.44 120.40 115.50 1diq s VAL 441 Ca 0.04 -0.33 -0.13 0.00 -1.81 0.00 0.00 61.98 59.75 1diq s VAL 441 Cb -0.24 -4.76 -0.05 0.00 0.56 0.00 0.00 36.38 31.89 1diq s VAL 441 CO 0.07 -1.58 0.31 -0.76 -0.31 0.00 0.00 175.10 172.83 1diq s LEU 442 N 4.35 4.37 0.27 1.32 1.43 -1.26 -1.84 118.68 127.31 1diq s LEU 442 Ca 0.27 0.69 -0.18 0.00 -1.03 0.00 0.00 54.13 53.88 1diq s LEU 442 Cb -0.13 -2.40 0.01 0.00 0.03 0.00 0.00 46.19 43.70 1diq s LEU 442 CO 0.08 0.26 0.64 -0.72 0.23 0.00 0.00 176.35 176.84 1diq s TYR 443 N -0.49 -0.02 -0.42 0.29 1.13 -0.74 -4.68 117.35 112.43 1diq s TYR 443 Ca 0.19 -0.41 -0.19 0.00 -1.41 0.00 0.00 57.07 55.25 1diq s TYR 443 Cb -0.14 0.53 0.02 0.00 -1.10 0.00 0.00 41.96 41.27 1diq s TYR 443 CO 0.08 -1.15 0.57 0.34 -2.51 0.00 0.00 175.55 172.89 1diq s ASP 444 N -2.95 6.30 0.37 -0.18 -1.08 -1.26 -2.58 116.67 115.30 1diq s ASP 444 Ca 0.14 -0.34 0.27 0.00 -0.52 0.00 0.00 52.55 52.10 1diq s ASP 444 Cb -0.04 -2.29 0.87 0.00 -1.46 0.00 0.00 42.92 40.00 1diq s ASP 444 CO 0.07 -0.68 1.77 -0.09 0.52 0.00 0.00 175.17 176.77 1diq h ARG 445 N 8.75 0.00 0.00 4.34 2.43 -1.76 -3.05 114.38 125.10 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 1.10 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.65 1diq h ARG 445 CO 0.85 0.00 -0.11 0.25 -1.51 0.00 0.00 179.97 179.45 1diq n THR 446 N -2.70 0.29 -3.37 0.20 -2.24 -1.25 -4.56 114.28 100.65 1diq n THR 446 Ca 0.03 -0.15 -0.44 0.00 -2.27 0.00 0.00 64.05 61.22 1diq n THR 446 Cb 0.38 -0.43 -0.08 0.00 -2.10 0.00 0.00 70.33 68.09 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 -3.77 6.15 0.54 3.42 3.84 -1.15 -4.99 114.94 118.98 1diq s ASN 447 Ca 0.12 -1.07 0.22 0.00 0.21 0.00 0.00 52.86 52.33 1diq s ASN 447 Cb 0.15 -2.20 1.46 0.00 -0.55 0.00 0.00 41.25 40.12 1diq s ASN 447 CO 0.59 -0.61 2.17 1.55 -2.79 0.00 0.00 177.10 178.01 1diq h PRO 448 N 8.74 0.00 -0.07 0.43 0.13 -1.85 -2.64 132.00 136.74 1diq h PRO 448 Ca -0.28 0.00 -0.19 0.00 -0.87 0.00 0.00 66.00 64.66 1diq h PRO 448 Cb 1.11 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.25 1diq h PRO 448 CO 0.84 0.03 -0.70 1.49 -0.23 0.00 0.00 178.00 179.42 1diq h GLU 449 N 0.00 0.60 0.00 0.86 4.22 -1.94 -2.95 114.58 115.38 1diq h GLU 449 Ca -0.00 -0.55 -0.07 0.00 0.08 0.00 0.00 59.36 58.82 1diq h GLU 449 Cb 0.06 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 1diq h GLU 449 CO 0.00 1.17 -0.32 1.49 -2.18 0.00 0.00 179.01 179.17 1diq h GLU 450 N 0.23 0.00 -0.02 1.92 4.81 -1.79 -2.31 114.58 117.42 1diq h GLU 450 Ca -0.07 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 58.95 1diq h GLU 450 Cb 1.36 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.74 1diq h GLU 450 CO 0.14 0.32 -0.89 1.79 -0.73 0.00 0.00 179.01 179.64 1diq h THR 451 N 0.00 1.39 -0.30 0.32 1.35 -1.49 -1.64 112.91 112.54 1diq h THR 451 Ca -0.00 -2.37 -0.07 0.00 -0.55 0.00 0.00 66.41 63.42 1diq h THR 451 Cb 0.73 2.34 -0.02 0.00 -1.73 0.00 0.00 68.15 69.47 1diq h THR 451 CO 0.04 0.71 -0.13 0.50 -0.25 0.00 0.00 175.52 176.39 1diq h LYS 452 N 0.25 0.51 -0.21 4.72 1.63 -1.33 -1.47 116.57 120.67 1diq h LYS 452 Ca -0.07 -0.15 -0.18 0.00 -0.85 0.00 0.00 60.65 59.40 1diq h LYS 452 Cb 1.52 -0.05 0.00 0.00 -0.60 0.00 0.00 32.23 33.10 1diq h LYS 452 CO 0.16 0.63 -0.58 0.00 -3.45 0.00 0.00 179.45 176.21 1diq h ARG 453 N 0.47 0.77 -0.60 1.90 3.08 -1.32 -2.85 114.38 115.83 1diq h ARG 453 Ca 0.09 -0.54 -0.04 0.00 0.07 0.00 0.00 59.98 59.55 1diq h ARG 453 Cb 0.50 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.61 1diq h ARG 453 CO 0.03 1.16 0.20 0.00 -1.07 0.00 0.00 179.97 180.29 1diq h ALA 454 N 0.60 1.21 -0.50 0.04 0.00 -0.84 0.14 119.26 119.92 1diq h ALA 454 Ca -0.01 -0.19 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 1diq h ALA 454 Cb 1.20 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.73 1diq h ALA 454 CO 0.13 0.56 -0.18 0.22 0.00 0.00 0.00 179.25 179.97 1diq h ASP 455 N 0.88 1.01 -0.07 0.00 3.58 -1.28 -1.23 116.42 119.31 1diq h ASP 455 Ca 0.20 -0.36 -0.17 0.00 0.42 0.00 0.00 57.03 57.12 1diq h ASP 455 Cb 0.24 -0.28 -0.00 0.00 1.72 0.00 0.00 39.33 41.01 1diq h ASP 455 CO -0.01 1.16 -0.55 0.00 -2.88 0.00 0.00 179.24 176.95 1diq h ALA 456 N 0.92 0.61 -0.59 -0.78 0.00 -1.21 -2.50 119.26 115.71 1diq h ALA 456 Ca 0.12 -0.52 -0.04 0.00 0.00 0.00 0.00 54.91 54.47 1diq h ALA 456 Cb 0.75 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.44 1diq h ALA 456 CO 0.06 0.69 0.21 0.00 0.00 0.00 0.00 179.25 180.21 1diq h PHE 458 N 0.83 1.05 -0.23 0.00 3.57 -1.12 -0.46 116.94 120.58 1diq h PHE 458 Ca 0.19 -0.15 -0.01 0.00 3.53 0.00 0.00 57.97 61.53 1diq h PHE 458 Cb 0.25 -0.28 -0.01 0.00 2.79 0.00 0.00 35.95 38.69 1diq h PHE 458 CO 0.01 0.92 0.09 -0.91 -2.23 0.00 0.00 178.31 176.19 1diq h ASN 459 N 0.91 0.31 0.20 0.41 4.21 -1.14 -2.35 115.58 118.14 1diq h ASN 459 Ca 0.18 -0.17 -0.08 0.00 1.21 0.00 0.00 56.30 57.44 1diq h ASN 459 Cb 0.47 -0.08 -0.01 0.00 -1.12 0.00 0.00 38.32 37.58 1diq h ASN 459 CO 0.02 0.40 -0.29 -0.08 -1.29 0.00 0.00 177.43 176.19 1diq h GLU 460 N 0.21 0.16 -0.47 0.81 4.81 -1.01 -0.45 114.58 118.64 1diq h GLU 460 Ca 0.07 -0.05 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 1diq h GLU 460 Cb 0.18 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1diq h GLU 460 CO -0.01 0.44 0.13 -0.07 -0.73 0.00 0.00 179.01 178.77 1diq h LEU 461 N 0.14 0.70 -0.40 1.64 4.07 -0.92 0.21 115.31 120.75 1diq h LEU 461 Ca 0.02 -0.22 -0.13 0.00 0.08 0.00 0.00 57.88 57.63 1diq h LEU 461 Cb 0.59 -0.18 -0.01 0.00 1.08 0.00 0.00 40.66 42.14 1diq h LEU 461 CO 0.04 0.74 -0.26 -0.07 -1.08 0.00 0.00 178.44 177.81 1diq h LEU 462 N 0.62 0.92 -0.27 1.67 3.38 -0.91 -2.02 115.31 118.71 1diq h LEU 462 Ca 0.15 -0.43 -0.05 0.00 0.09 0.00 0.00 57.88 57.65 1diq h LEU 462 Cb 0.30 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 40.79 1diq h LEU 462 CO -0.00 1.15 -0.01 0.44 0.09 0.00 0.00 178.44 180.11 1diq h ASP 463 N 0.70 0.48 -0.69 -0.43 3.45 -0.87 -1.72 116.42 117.34 1diq h ASP 463 Ca 0.08 -0.31 -0.02 0.00 0.43 0.00 0.00 57.03 57.20 1diq h ASP 463 Cb 0.83 -0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 39.44 1diq h ASP 463 CO 0.07 0.68 0.34 -0.33 -1.57 0.00 0.00 179.24 178.42 1diq h GLU 464 N 0.27 0.99 -0.07 3.56 4.39 -0.57 -2.73 114.58 120.41 1diq h GLU 464 Ca 0.08 -0.14 -0.21 0.00 0.34 0.00 0.00 59.36 59.42 1diq h GLU 464 Cb 0.43 -0.18 0.00 0.00 -0.10 0.00 0.00 28.75 28.91 1diq h GLU 464 CO 0.02 0.78 -0.81 0.74 -1.16 0.00 0.00 179.01 178.58 1diq h PHE 465 N 0.96 0.73 -0.55 4.33 -1.00 -1.34 -3.20 116.94 116.88 1diq h PHE 465 Ca 0.24 -0.34 -0.05 0.00 2.81 0.00 0.00 57.97 60.62 1diq h PHE 465 Cb 0.11 -0.10 -0.02 0.00 3.61 0.00 0.00 35.95 39.54 1diq h PHE 465 CO 0.00 1.14 0.12 1.49 -1.61 0.00 0.00 178.31 179.45 1diq h GLU 466 N 0.34 0.85 -0.57 1.51 4.81 -1.07 0.16 114.58 120.62 1diq h GLU 466 Ca -0.05 -0.18 -0.01 0.00 -0.13 0.00 0.00 59.36 58.99 1diq h GLU 466 Cb 1.42 -0.12 -0.03 0.00 0.63 0.00 0.00 28.75 30.65 1diq h GLU 466 CO 0.15 0.77 0.32 -0.22 -0.73 0.00 0.00 179.01 179.30 1diq h LYS 467 N 0.82 0.78 -0.43 1.92 3.64 -1.50 -0.60 116.57 121.19 1diq h LYS 467 Ca 0.18 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 1diq h LYS 467 Cb 0.32 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 31.98 1diq h LYS 467 CO 0.00 0.57 0.00 0.39 -2.27 0.00 0.00 179.45 178.14 1diq n GLU 468 N -4.40 2.01 -0.83 1.90 -0.58 -0.86 -4.91 120.64 112.97 1diq n GLU 468 Ca 0.05 -1.53 0.00 0.00 -0.42 0.00 0.00 57.16 55.26 1diq n GLU 468 Cb 0.09 -1.35 0.00 0.00 -0.57 0.00 0.00 31.44 29.62 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 1.15 0.53 3.73 0.62 0.00 -0.23 -5.06 105.19 105.93 1diq n GLY 469 Ca 0.14 -0.48 -0.33 0.00 0.00 0.00 0.00 46.02 45.36 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 3.18 0.15 1.61 4.12 0.52 -4.97 117.35 119.97 1diq s TYR 470 Ca 0.00 0.15 0.01 0.00 0.02 0.00 0.00 57.07 57.25 1diq s TYR 470 Cb 0.00 -1.71 -0.04 0.00 -1.52 0.00 0.00 41.96 38.68 1diq s TYR 470 CO 0.00 0.51 0.00 0.00 0.02 0.00 0.00 175.55 176.08 1diq s ALA 471 N -1.11 1.22 0.31 3.71 0.00 -1.26 -2.64 121.76 121.98 1diq s ALA 471 Ca 0.20 -1.54 -0.07 0.00 0.00 0.00 0.00 51.96 50.56 1diq s ALA 471 Cb -0.12 0.54 -0.06 0.00 0.00 0.00 0.00 23.12 23.48 1diq s ALA 471 CO 0.11 -0.33 0.61 0.14 0.00 0.00 0.00 175.76 176.29 1diq s VAL 472 N -3.71 4.96 -0.40 0.00 -7.23 -1.26 -2.51 120.40 110.25 1diq s VAL 472 Ca 0.22 0.22 0.23 0.00 -1.81 0.00 0.00 61.98 60.84 1diq s VAL 472 Cb 0.06 -3.73 0.01 0.00 0.56 0.00 0.00 36.38 33.28 1diq s VAL 472 CO 0.02 -0.36 1.13 0.10 -0.31 0.00 0.00 175.10 175.69 1diq h TYR 473 N 1.62 0.00 -1.84 2.82 -0.00 -1.84 -3.48 116.97 114.26 1diq h TYR 473 Ca -0.47 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 58.25 1diq h TYR 473 Cb 1.19 0.00 -0.22 0.00 0.00 0.00 0.00 36.73 37.70 1diq h TYR 473 CO 0.59 0.00 0.30 0.50 -0.00 0.00 0.00 178.16 179.54 1diq s ARG 474 N -3.29 0.81 0.19 0.10 3.52 -1.26 -5.04 118.95 113.98 1diq s ARG 474 Ca 0.02 0.47 -0.11 0.00 -0.13 0.00 0.00 55.73 55.98 1diq s ARG 474 Cb 0.11 0.39 -0.00 0.00 -1.56 0.00 0.00 34.95 33.89 1diq s ARG 474 CO 0.77 -0.20 0.37 0.54 -0.81 0.00 0.00 175.30 175.97 1diq s VAL 475 N -0.56 0.04 0.81 7.11 0.11 -1.26 -4.59 120.40 122.07 1diq s VAL 475 Ca -0.04 -1.28 -0.11 0.00 -2.93 0.00 0.00 61.98 57.63 1diq s VAL 475 Cb -0.02 -1.87 0.08 0.00 -1.53 0.00 0.00 36.38 33.04 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 -2.96 4.17 0.46 3.54 4.22 -1.26 -4.81 114.94 118.29 1diq s ASN 476 Ca 0.17 1.68 0.16 0.00 -2.14 0.00 0.00 52.86 52.74 1diq s ASN 476 Cb 0.02 -2.38 1.12 0.00 1.28 0.00 0.00 41.25 41.28 1diq s ASN 476 CO 0.01 -2.23 1.99 0.71 -2.04 0.00 0.00 177.10 175.55 1diq h THR 477 N -1.26 0.87 0.00 0.54 1.35 -1.90 -1.12 112.91 111.39 1diq h THR 477 Ca -0.46 -0.10 -0.11 0.00 -0.55 0.00 0.00 66.41 65.19 1diq h THR 477 Cb 1.25 0.54 -0.02 0.00 -1.73 0.00 0.00 68.15 68.19 1diq h THR 477 CO 0.53 0.05 -0.53 -0.09 -0.25 0.00 0.00 175.52 175.23 1diq h ARG 478 N 0.30 0.00 -0.34 4.72 2.43 -1.91 -3.24 114.38 116.34 1diq h ARG 478 Ca 0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.43 1diq h ARG 478 Cb 0.61 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.16 1diq h ARG 478 CO -0.06 0.53 0.00 1.19 -1.51 0.00 0.00 179.97 180.12 1diq n PHE 479 N -3.74 0.62 -0.06 2.20 3.72 -0.50 -4.69 117.46 115.01 1diq n PHE 479 Ca -0.01 -0.59 0.00 0.00 -0.05 0.00 0.00 57.45 56.80 1diq n PHE 479 Cb 0.57 -0.10 0.29 0.00 -0.94 0.00 0.00 39.48 39.30 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 2.08 0.66 -0.01 -1.08 4.20 -1.38 -1.67 115.11 117.91 1diq h GLN 480 Ca 0.00 -0.10 -0.24 0.00 0.06 0.00 0.00 58.65 58.36 1diq h GLN 480 Cb 0.93 -0.12 0.01 0.00 0.30 0.00 0.00 27.48 28.61 1diq h GLN 480 CO 0.06 0.57 -0.98 0.22 -0.67 0.00 0.00 178.83 178.03 1diq h ASP 481 N 0.65 0.74 -0.49 1.46 3.58 -1.84 -2.82 116.42 117.70 1diq h ASP 481 Ca 0.16 -0.58 0.00 0.00 0.42 0.00 0.00 57.03 57.03 1diq h ASP 481 Cb 0.18 -0.23 -0.02 0.00 1.72 0.00 0.00 39.33 40.98 1diq h ASP 481 CO -0.01 1.38 0.32 -0.09 -2.88 0.00 0.00 179.24 177.96 1diq h ARG 482 N 0.33 0.65 0.00 0.28 9.65 -1.79 -2.43 114.38 121.06 1diq h ARG 482 Ca -0.10 -0.04 -0.08 0.00 -1.10 0.00 0.00 59.98 58.66 1diq h ARG 482 Cb 1.62 -0.15 -0.01 0.00 -1.39 0.00 0.00 29.97 30.04 1diq h ARG 482 CO 0.18 0.43 -0.38 0.28 2.80 0.00 0.00 179.97 183.28 1diq h VAL 483 N 0.66 0.97 -0.03 0.20 2.07 -1.36 -2.65 116.25 116.11 1diq h VAL 483 Ca 0.18 -1.49 -0.03 0.00 0.82 0.00 0.00 66.70 66.18 1diq h VAL 483 Cb -0.08 1.88 -0.01 0.00 -1.52 0.00 0.00 31.29 31.57 1diq h VAL 483 CO -0.04 0.38 -0.12 0.00 0.02 0.00 0.00 177.57 177.81 1diq h ALA 484 N 1.62 1.74 0.00 1.67 0.00 -1.17 -1.67 119.26 121.44 1diq h ALA 484 Ca -0.00 -0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.72 1diq h ALA 484 Cb 0.85 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1diq h ALA 484 CO 0.05 0.19 -0.29 1.96 0.00 0.00 0.00 179.25 181.17 1diq h GLN 485 N 0.05 0.00 0.00 0.00 4.20 -1.34 -2.86 115.11 115.15 1diq h GLN 485 Ca 0.01 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.69 1diq h GLN 485 Cb 0.24 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.02 1diq h GLN 485 CO 0.02 0.29 -0.13 0.77 -0.67 0.00 0.00 178.83 179.11 1diq h SER 486 N 0.00 0.00 -0.58 1.46 0.02 -1.39 -3.00 113.55 110.07 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 0.66 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.20 1diq h SER 486 CO 0.04 0.13 0.00 -1.22 -1.14 0.00 0.00 176.83 174.63 1diq n TYR 487 N -3.51 0.94 0.00 3.45 4.01 -1.08 -5.04 117.16 115.94 1diq n TYR 487 Ca -0.01 -0.43 0.00 0.00 -0.16 0.00 0.00 57.90 57.30 1diq n TYR 487 Cb 0.27 -0.07 0.00 0.00 -0.31 0.00 0.00 39.34 39.23 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 1.30 -1.85 0.26 2.72 0.00 -1.14 -4.53 105.19 101.95 1diq n GLY 488 Ca 0.20 -1.52 -0.10 0.00 0.00 0.00 0.00 46.02 44.60 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 0.84 -1.00 1.61 0.13 -1.91 -3.27 132.00 128.39 1diq h PRO 489 Ca 0.00 -0.38 0.05 0.00 -0.87 0.00 0.00 66.00 64.80 1diq h PRO 489 Cb 0.00 -0.02 -0.06 0.00 0.13 0.00 0.00 31.00 31.05 1diq h PRO 489 CO 0.00 1.02 0.65 0.28 -0.23 0.00 0.00 178.00 179.72 1diq h VAL 490 N 0.71 1.14 -0.11 1.56 2.07 -1.99 -0.51 116.25 119.11 1diq h VAL 490 Ca 0.08 -0.42 -0.01 0.00 0.82 0.00 0.00 66.70 67.17 1diq h VAL 490 Cb 0.83 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.40 1diq h VAL 490 CO 0.07 0.22 0.04 0.50 0.02 0.00 0.00 177.57 178.43 1diq h LYS 491 N 1.23 0.17 -0.56 1.57 3.64 -1.79 -1.83 116.57 119.00 1diq h LYS 491 Ca 0.41 -0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.71 1diq h LYS 491 Cb 0.07 -0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 1diq h LYS 491 CO -0.14 0.28 0.15 0.00 -2.27 0.00 0.00 179.45 177.47 1diq h ARG 492 N 0.02 0.86 -0.24 1.90 3.08 -1.53 -0.75 114.38 117.72 1diq h ARG 492 Ca 0.04 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 1diq h ARG 492 Cb 0.18 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 30.09 1diq h ARG 492 CO -0.00 0.76 0.11 -0.22 -1.07 0.00 0.00 179.97 179.55 1diq h LYS 493 N 0.83 0.35 -0.67 0.04 3.64 -0.92 -1.17 116.57 118.67 1diq h LYS 493 Ca 0.18 -0.06 -0.06 0.00 -1.27 0.00 0.00 60.65 59.45 1diq h LYS 493 Cb 0.28 -0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 32.01 1diq h LYS 493 CO -0.00 0.37 0.17 1.25 -2.27 0.00 0.00 179.45 178.96 1diq h LEU 494 N 0.26 0.99 -1.24 5.20 6.46 -0.86 -1.84 115.31 124.28 1diq h LEU 494 Ca 0.08 -0.20 -0.07 0.00 -0.12 0.00 0.00 57.88 57.57 1diq h LEU 494 Cb 0.13 -0.26 -0.01 0.00 -0.73 0.00 0.00 40.66 39.79 1diq h LEU 494 CO -0.01 0.95 -0.34 -0.33 -0.62 0.00 0.00 178.44 178.10 1diq h GLU 495 N 1.00 0.00 0.00 1.25 5.08 -0.75 -2.39 114.58 118.78 1diq h GLU 495 Ca 0.21 0.00 -0.14 0.00 -1.00 0.00 0.00 59.36 58.43 1diq h GLU 495 Cb 0.34 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1diq h GLU 495 CO -0.00 0.34 -0.93 0.45 -1.00 0.00 0.00 179.01 177.87 1diq h HIS 496 N 0.00 0.00 -0.23 4.33 3.86 -0.74 -2.67 115.15 119.70 1diq h HIS 496 Ca -0.00 0.00 -0.08 0.00 -1.16 0.00 0.00 60.37 59.12 1diq h HIS 496 Cb 0.70 0.00 -0.00 0.00 1.06 0.00 0.00 27.41 29.17 1diq h HIS 496 CO 0.00 0.58 -0.18 0.00 0.86 0.00 0.00 177.93 179.19 1diq h ALA 497 N 1.42 0.33 -0.30 2.45 0.00 -1.08 -1.41 119.26 120.67 1diq h ALA 497 Ca -0.07 -0.34 -0.11 0.00 0.00 0.00 0.00 54.91 54.39 1diq h ALA 497 Cb 1.51 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 19.21 1diq h ALA 497 CO 0.06 0.24 -0.26 0.82 0.00 0.00 0.00 179.25 180.11 1diq h ILE 498 N 0.23 1.27 -0.54 0.00 2.04 -1.52 -2.76 117.51 116.24 1diq h ILE 498 Ca 0.04 -1.34 -0.08 0.00 1.00 0.00 0.00 64.86 64.48 1diq h ILE 498 Cb 0.71 1.33 -0.02 0.00 -0.74 0.00 0.00 36.82 38.10 1diq h ILE 498 CO 0.05 0.43 0.01 0.50 0.00 0.00 0.00 178.15 179.14 1diq h LYS 499 N 0.52 0.94 -0.32 2.37 1.63 -1.31 -1.57 116.57 118.83 1diq h LYS 499 Ca 0.07 -0.29 -0.06 0.00 -0.85 0.00 0.00 60.65 59.52 1diq h LYS 499 Cb 0.73 -0.09 -0.02 0.00 -0.60 0.00 0.00 32.23 32.25 1diq h LYS 499 CO 0.06 0.95 -0.06 -0.09 -3.45 0.00 0.00 179.45 176.86 1diq h ARG 500 N 0.81 0.52 -0.04 1.90 2.43 -1.13 0.78 114.38 119.65 1diq h ARG 500 Ca 0.15 -0.13 -0.19 0.00 -0.81 0.00 0.00 59.98 59.01 1diq h ARG 500 Cb 0.52 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1diq h ARG 500 CO 0.03 0.59 -0.78 0.00 -1.51 0.00 0.00 179.97 178.29 1diq h ALA 501 N 1.46 0.59 0.00 2.80 0.00 -1.20 -3.05 119.26 119.85 1diq h ALA 501 Ca 0.10 -0.64 0.00 0.00 0.00 0.00 0.00 54.91 54.36 1diq h ALA 501 Cb 0.40 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1diq h ALA 501 CO 0.02 0.81 -1.32 1.33 0.00 0.00 0.00 179.25 180.09 1diq n VAL 502 N -3.78 0.00 -3.07 0.00 0.24 -0.62 -4.73 118.33 106.37 1diq n VAL 502 Ca -0.04 -0.27 -0.19 0.00 -2.04 0.00 0.00 64.34 61.80 1diq n VAL 502 Cb 0.74 0.47 -0.03 0.00 -1.47 0.00 0.00 33.84 33.55 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 -1.77 -0.50 0.12 -1.34 4.64 0.25 -4.00 116.55 113.96 1diq n ASP 503 Ca -0.01 -2.93 0.08 0.00 -1.38 0.00 0.00 54.79 50.55 1diq n ASP 503 Cb 0.34 0.02 0.55 0.00 -1.04 0.00 0.00 41.12 40.98 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 3.78 0.23 -0.01 -0.67 0.13 -1.66 -2.19 132.00 131.62 1diq h PRO 504 Ca 0.02 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.14 1diq h PRO 504 Cb 0.94 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 32.01 1diq h PRO 504 CO 0.42 0.15 0.00 0.09 -0.23 0.00 0.00 178.00 178.44 1diq n ASN 505 N -4.50 0.51 -3.34 1.44 3.02 -1.26 -4.94 115.26 106.20 1diq n ASN 505 Ca 0.01 -1.22 -0.24 0.00 -0.03 0.00 0.00 54.58 53.10 1diq n ASN 505 Cb 0.13 -0.01 0.04 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 -0.58 -5.72 0.06 6.41 5.15 -0.82 -4.94 115.26 114.82 1diq n ASN 506 Ca 0.21 -0.43 0.01 0.00 -0.60 0.00 0.00 54.58 53.77 1diq n ASN 506 Cb 0.19 -4.59 -0.05 0.00 -0.53 0.00 0.00 39.78 34.79 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 -1.78 0.55 -3.23 -1.44 3.07 -1.85 -3.41 117.51 109.42 1diq h ILE 507 Ca -0.54 -1.98 -0.59 0.00 1.55 0.00 0.00 64.86 63.30 1diq h ILE 507 Cb 1.36 2.09 -0.11 0.00 -0.27 0.00 0.00 36.82 39.89 1diq h ILE 507 CO 0.58 0.31 0.68 -0.76 -1.05 0.00 0.00 178.15 177.91 1diq s LEU 508 N -5.91 3.92 -0.55 0.16 1.43 -1.26 -0.73 118.68 115.74 1diq s LEU 508 Ca -0.01 -0.20 -0.15 0.00 -1.03 0.00 0.00 54.13 52.74 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 0.79 -1.28 0.31 0.00 0.23 0.00 0.00 176.35 176.41 1diq n ALA 509 N 7.70 -1.77 -1.71 4.21 0.00 0.11 -4.82 120.51 124.23 1diq n ALA 509 Ca 0.04 -0.27 -0.43 0.00 0.00 0.00 0.00 53.44 52.78 1diq n ALA 509 Cb 0.48 -1.11 -0.03 0.00 0.00 0.00 0.00 19.45 18.79 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 -2.75 2.68 0.00 0.00 -0.04 -1.26 -1.96 135.00 131.67 1diq n PRO 510 Ca -0.06 0.97 0.00 0.00 -0.04 0.00 0.00 63.50 64.36 1diq n PRO 510 Cb 0.27 -2.80 0.00 0.00 -0.04 0.00 0.00 33.50 30.93 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 2.60 3.68 0.55 0.00 0.62 -4.68 105.19 111.66 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 -0.53 4.15 -1.80 1.61 6.06 -0.83 -1.79 118.95 125.82 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 -3.79 0.00 0.00 0.06 0.00 0.00 34.95 31.22 1diq s ARG 512 CO 0.00 -0.86 0.00 0.43 -2.50 0.00 0.00 175.30 172.37 1diq n SER 513 N 6.33 -4.84 -0.24 -2.12 7.64 -1.26 -1.36 113.62 117.76 1diq n SER 513 Ca 0.18 0.34 -0.03 0.00 1.01 0.00 0.00 58.87 60.37 1diq n SER 513 Cb 0.40 -4.27 -0.01 0.00 -1.01 0.00 0.00 64.21 59.32 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 -0.49 0.62 3.47 0.23 0.00 -0.74 -4.71 105.19 103.57 1diq n GLY 514 Ca -0.19 -0.88 -0.41 0.00 0.00 0.00 0.00 46.02 44.54 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 -2.11 5.08 -0.21 -0.61 1.01 -0.47 -4.90 121.20 119.00 1diq s ILE 515 Ca 0.00 -0.52 -0.13 0.00 0.00 0.00 0.00 60.65 60.00 1diq s ILE 515 Cb 0.00 -3.73 0.06 0.00 0.01 0.00 0.00 42.46 38.80 1diq s ILE 515 CO 0.00 -0.16 0.51 -0.62 0.00 0.00 0.00 174.94 174.67 1diq s ASP 516 N 1.67 -0.65 0.12 3.58 3.68 -1.26 -0.27 116.67 123.53 1diq s ASP 516 Ca 0.05 1.11 0.19 0.00 2.13 0.00 0.00 52.55 56.02 1diq s ASP 516 Cb -0.18 1.00 0.79 0.00 -1.45 0.00 0.00 42.92 43.08 1diq s ASP 516 CO 0.09 -0.21 1.58 0.18 0.13 0.00 0.00 175.17 176.95 1diq n LEU 517 N 4.06 0.32 -0.08 -1.34 4.77 -1.26 -2.21 117.00 121.26 1diq n LEU 517 Ca -0.21 0.58 0.07 0.00 -0.03 0.00 0.00 56.01 56.42 1diq n LEU 517 Cb 0.57 -0.54 0.40 0.00 -2.33 0.00 0.00 43.42 41.52 1diq n LEU 517 CO 0.05 -0.40 0.76 0.59 -1.33 0.00 0.00 177.39 177.06 1diq n ASN 518 N -1.85 0.23 -4.96 -1.43 3.02 -1.26 -4.79 115.26 104.21 1diq n ASN 518 Ca 0.03 -1.60 -0.22 0.00 -0.03 0.00 0.00 54.58 52.76 1diq n ASN 518 Cb 0.20 -0.02 -0.02 0.00 -0.61 0.00 0.00 39.78 39.33 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 -1.43 6.27 -1.15 6.41 0.02 -0.94 -5.04 114.94 119.08 1diq s ASN 519 Ca 0.22 0.18 -0.09 0.00 -1.02 0.00 0.00 52.86 52.15 1diq s ASN 519 Cb 0.10 -1.86 0.25 0.00 0.02 0.00 0.00 41.25 39.77 1diq s ASN 519 CO 0.17 -0.19 1.37 0.47 0.02 0.00 0.00 177.10 178.94 1diq n ASP 520 N -1.57 5.61 0.00 -1.22 8.00 -1.26 -5.05 116.55 121.06 1diq n ASP 520 Ca -0.07 -3.12 0.00 0.00 0.71 0.00 0.00 54.79 52.32 1diq n ASP 520 Cb 0.57 -1.41 0.00 0.00 -0.02 0.00 0.00 41.12 40.26 1diq n ASP 520 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30