#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1a8y s LEU 4 N 0.00 4.43 0.59 0.99 0.20 -1.26 -5.07 118.68 118.57 1a8y s LEU 4 Ca 0.00 2.05 0.09 0.00 0.69 0.00 0.00 54.13 56.96 1a8y s LEU 4 Cb 0.00 -3.59 0.09 0.00 -0.43 0.00 0.00 46.19 42.25 1a8y s LEU 4 CO 0.00 -0.33 0.73 -0.62 -0.29 0.00 0.00 176.35 175.84 1a8y s ASP 5 N 0.40 4.93 1.02 3.68 2.15 -1.26 -5.10 116.67 122.49 1a8y s ASP 5 Ca 0.53 -0.99 -0.11 0.00 0.43 0.00 0.00 52.55 52.40 1a8y s ASP 5 Cb -0.29 0.45 0.19 0.00 -0.30 0.00 0.00 42.92 42.97 1a8y s ASP 5 CO 0.33 -1.36 1.01 0.49 -0.17 0.00 0.00 175.17 175.47 1a8y n PHE 6 N -2.18 -0.09 -3.00 -5.34 3.72 -1.26 -4.99 117.46 104.32 1a8y n PHE 6 Ca 0.12 0.19 -0.40 0.00 -0.05 0.00 0.00 57.45 57.31 1a8y n PHE 6 Cb 0.62 -1.87 -0.05 0.00 -0.94 0.00 0.00 39.48 37.25 1a8y n PHE 6 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 1a8y s PRO 7 N -4.44 4.35 0.38 -1.08 0.02 -1.26 -5.08 135.00 127.88 1a8y s PRO 7 Ca 0.66 0.89 0.08 0.00 0.02 0.00 0.00 61.00 62.65 1a8y s PRO 7 Cb -0.23 -3.52 -0.03 0.00 0.02 0.00 0.00 34.50 30.74 1a8y s PRO 7 CO 0.61 -0.13 0.33 -1.83 -0.33 0.00 0.00 177.00 175.65 1a8y s GLU 8 N 1.49 2.57 -0.03 5.54 -1.05 -1.26 -5.06 118.70 120.91 1a8y s GLU 8 Ca 0.36 -1.47 -0.33 0.00 -0.15 0.00 0.00 54.97 53.39 1a8y s GLU 8 Cb -0.17 -2.38 -0.11 0.00 -0.44 0.00 0.00 34.13 31.03 1a8y s GLU 8 CO 0.15 -0.07 1.89 0.98 0.95 0.00 0.00 175.26 179.16 1a8y n TYR 9 N -1.45 2.40 0.59 4.83 9.36 -1.26 -4.90 117.16 126.73 1a8y n TYR 9 Ca 0.01 -0.11 0.13 0.00 3.32 0.00 0.00 57.90 61.25 1a8y n TYR 9 Cb 0.61 -2.70 0.41 0.00 -0.63 0.00 0.00 39.34 37.03 1a8y n TYR 9 CO 0.00 0.00 0.00 -0.40 0.22 0.00 0.00 176.86 176.68 1a8y n ASP 10 N 6.65 0.81 0.00 2.98 5.68 -1.26 -4.95 116.55 126.47 1a8y n ASP 10 Ca 0.21 0.59 0.00 0.00 -0.50 0.00 0.00 54.79 55.09 1a8y n ASP 10 Cb 0.33 -0.80 0.00 0.00 -1.14 0.00 0.00 41.12 39.51 1a8y n ASP 10 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1a8y n GLY 11 N 1.14 0.74 3.78 6.12 0.00 -1.26 -5.05 105.19 110.66 1a8y n GLY 11 Ca 0.05 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.68 1a8y n GLY 11 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a8y s VAL 12 N -2.46 4.87 -0.13 1.61 1.01 -1.26 -5.04 120.40 119.00 1a8y s VAL 12 Ca 0.00 1.20 -0.16 0.00 0.00 0.00 0.00 61.98 63.02 1a8y s VAL 12 Cb 0.00 -3.90 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 1a8y s VAL 12 CO 0.00 0.47 0.40 -1.81 0.00 0.00 0.00 175.10 174.16 1a8y s ASP 13 N -0.52 6.59 0.00 3.32 1.01 -1.26 -4.88 116.67 120.93 1a8y s ASP 13 Ca 0.30 0.70 0.00 0.00 0.71 0.00 0.00 52.55 54.26 1a8y s ASP 13 Cb -0.18 -2.24 0.00 0.00 1.01 0.00 0.00 42.92 41.50 1a8y s ASP 13 CO 0.17 0.06 0.00 0.54 0.21 0.00 0.00 175.17 176.15 1a8y n ARG 14 N 3.54 2.16 -2.40 8.23 1.74 -1.26 -5.05 116.66 123.63 1a8y n ARG 14 Ca -0.09 0.00 -0.42 0.00 -0.77 0.00 0.00 57.85 56.56 1a8y n ARG 14 Cb 0.52 -0.82 -0.03 0.00 -1.02 0.00 0.00 32.46 31.11 1a8y n ARG 14 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 1a8y s VAL 15 N -1.32 4.07 0.12 1.55 1.01 -1.26 -4.72 120.40 119.86 1a8y s VAL 15 Ca 0.00 1.44 -0.08 0.00 0.00 0.00 0.00 61.98 63.34 1a8y s VAL 15 Cb 0.00 -3.93 -0.06 0.00 0.00 0.00 0.00 36.38 32.40 1a8y s VAL 15 CO 0.00 0.03 0.41 -0.63 0.00 0.00 0.00 175.10 174.91 1a8y s ILE 16 N 1.89 5.10 -0.98 2.22 1.01 -0.74 -4.96 121.20 124.74 1a8y s ILE 16 Ca 0.58 0.30 -0.17 0.00 0.00 0.00 0.00 60.65 61.36 1a8y s ILE 16 Cb -0.28 -3.63 0.16 0.00 0.01 0.00 0.00 42.46 38.72 1a8y s ILE 16 CO 0.25 0.14 1.13 0.21 0.00 0.00 0.00 174.94 176.68 1a8y s ASN 17 N -2.10 6.76 -0.26 3.58 2.47 -1.26 -1.13 114.94 123.00 1a8y s ASN 17 Ca 0.38 -2.39 -0.29 0.00 0.42 0.00 0.00 52.86 50.98 1a8y s ASN 17 Cb -0.13 -2.36 0.01 0.00 -1.45 0.00 0.00 41.25 37.32 1a8y s ASN 17 CO 0.21 -0.90 1.04 -0.69 -3.72 0.00 0.00 177.10 173.04 1a8y s VAL 18 N 1.92 4.64 0.26 -5.21 1.01 -0.99 -4.87 120.40 117.16 1a8y s VAL 18 Ca 0.32 1.91 0.02 0.00 0.00 0.00 0.00 61.98 64.23 1a8y s VAL 18 Cb -0.05 -4.33 -0.00 0.00 0.00 0.00 0.00 36.38 31.99 1a8y s VAL 18 CO -0.08 -0.26 0.30 -0.46 0.00 0.00 0.00 175.10 174.61 1a8y n ASN 19 N 6.46 -0.82 -0.32 3.32 0.23 -1.26 -4.49 115.26 118.38 1a8y n ASN 19 Ca 0.12 -2.50 0.06 0.00 -0.53 0.00 0.00 54.58 51.73 1a8y n ASN 19 Cb 0.46 1.63 0.21 0.00 -2.08 0.00 0.00 39.78 40.01 1a8y n ASN 19 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1a8y h ALA 20 N 1.84 1.34 0.59 -2.53 0.00 -1.93 0.31 119.26 118.88 1a8y h ALA 20 Ca -0.19 0.04 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1a8y h ALA 20 Cb 0.89 -0.12 0.01 0.00 0.00 0.00 0.00 17.79 18.56 1a8y h ALA 20 CO 0.27 0.08 -0.28 -0.22 0.00 0.00 0.00 179.25 179.10 1a8y h LYS 21 N 0.81 -0.76 -0.05 0.00 3.11 -1.97 -3.39 116.57 114.33 1a8y h LYS 21 Ca 0.46 0.05 0.02 0.00 -2.81 0.00 0.00 60.65 58.37 1a8y h LYS 21 Cb 0.51 0.17 -0.04 0.00 -1.00 0.00 0.00 32.23 31.87 1a8y h LYS 21 CO -0.29 -0.45 -0.40 -0.91 -2.81 0.00 0.00 179.45 174.59 1a8y h ASN 22 N -1.08 -1.26 -1.07 4.20 4.21 -1.76 -3.41 115.58 115.40 1a8y h ASN 22 Ca -0.08 0.15 0.30 0.00 1.21 0.00 0.00 56.30 57.88 1a8y h ASN 22 Cb 0.66 0.49 -0.12 0.00 -1.12 0.00 0.00 38.32 38.23 1a8y h ASN 22 CO 0.13 -0.38 0.66 0.10 -1.29 0.00 0.00 177.43 176.66 1a8y h TYR 23 N -0.47 0.77 -0.73 1.19 -0.00 -0.59 -1.42 116.97 115.71 1a8y h TYR 23 Ca 0.02 0.03 -0.01 0.00 -0.00 0.00 0.00 58.73 58.76 1a8y h TYR 23 Cb 0.52 -0.21 -0.03 0.00 -0.00 0.00 0.00 36.73 37.01 1a8y h TYR 23 CO -0.51 -0.03 0.40 0.87 -0.00 0.00 0.00 178.16 178.89 1a8y h LYS 24 N 0.37 1.02 0.00 0.10 1.57 -1.84 -2.35 116.57 115.43 1a8y h LYS 24 Ca 0.67 -0.12 -0.06 0.00 -1.87 0.00 0.00 60.65 59.27 1a8y h LYS 24 Cb 1.66 -0.20 -0.01 0.00 0.08 0.00 0.00 32.23 33.76 1a8y h LYS 24 CO -0.42 0.75 -0.30 -0.91 -0.57 0.00 0.00 179.45 178.01 1a8y h ASN 25 N 1.01 0.00 0.24 0.86 4.21 -1.56 -3.00 115.58 117.33 1a8y h ASN 25 Ca 0.26 0.00 -0.21 0.00 1.21 0.00 0.00 56.30 57.56 1a8y h ASN 25 Cb 0.03 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.23 1a8y h ASN 25 CO -0.04 0.30 -0.82 0.58 -1.29 0.00 0.00 177.43 176.15 1a8y h VAL 26 N 0.00 1.38 -0.20 2.81 2.07 -1.33 -2.72 116.25 118.26 1a8y h VAL 26 Ca -0.00 -2.25 -0.08 0.00 0.82 0.00 0.00 66.70 65.19 1a8y h VAL 26 Cb 1.11 2.22 -0.01 0.00 -1.52 0.00 0.00 31.29 33.09 1a8y h VAL 26 CO 0.04 0.68 -0.22 -0.26 0.02 0.00 0.00 177.57 177.83 1a8y h PHE 27 N 0.29 0.38 0.00 1.57 0.04 -1.38 -2.87 116.94 114.97 1a8y h PHE 27 Ca -0.05 -0.07 0.00 0.00 2.80 0.00 0.00 57.97 60.65 1a8y h PHE 27 Cb 1.43 -0.10 0.00 0.00 2.20 0.00 0.00 35.95 39.48 1a8y h PHE 27 CO 0.06 0.55 -0.63 1.57 -0.60 0.00 0.00 178.31 179.26 1a8y h LYS 28 N 0.32 0.00 0.00 1.51 2.10 -1.58 -3.34 116.57 115.58 1a8y h LYS 28 Ca 0.05 0.00 -0.08 0.00 -2.00 0.00 0.00 60.65 58.62 1a8y h LYS 28 Cb 0.57 0.00 -0.01 0.00 -0.90 0.00 0.00 32.23 31.89 1a8y h LYS 28 CO 0.04 0.00 -0.37 -0.22 -2.00 0.00 0.00 179.45 176.90 1a8y h LYS 29 N 0.00 0.00 -6.29 0.07 3.64 -1.33 -3.46 116.57 109.20 1a8y h LYS 29 Ca 0.00 0.00 -0.59 0.00 -1.27 0.00 0.00 60.65 58.79 1a8y h LYS 29 Cb 0.97 0.00 -0.23 0.00 -0.41 0.00 0.00 32.23 32.56 1a8y h LYS 29 CO 0.00 0.37 -0.84 0.71 -2.27 0.00 0.00 179.45 177.42 1a8y s TYR 30 N -3.35 1.90 0.00 1.91 2.02 -1.10 -5.06 117.35 113.68 1a8y s TYR 30 Ca 0.02 -0.40 0.00 0.00 -0.37 0.00 0.00 57.07 56.32 1a8y s TYR 30 Cb 0.09 -1.06 0.00 0.00 -0.40 0.00 0.00 41.96 40.59 1a8y s TYR 30 CO 0.69 0.20 0.64 0.39 -1.57 0.00 0.00 175.55 175.91 1a8y n GLU 31 N 1.24 0.00 -5.04 -0.62 1.02 -1.21 -4.80 120.64 111.24 1a8y n GLU 31 Ca -0.19 0.46 -0.32 0.00 -0.02 0.00 0.00 57.16 57.09 1a8y n GLU 31 Cb 0.53 -1.30 -0.15 0.00 -0.02 0.00 0.00 31.44 30.51 1a8y n GLU 31 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1a8y s VAL 32 N -2.21 2.64 -0.02 2.62 0.11 -1.24 -3.50 120.40 118.80 1a8y s VAL 32 Ca 0.00 -0.87 0.03 0.00 -2.93 0.00 0.00 61.98 58.21 1a8y s VAL 32 Cb 0.00 -2.01 -0.00 0.00 -1.53 0.00 0.00 36.38 32.84 1a8y s VAL 32 CO 0.00 0.58 -0.11 -0.22 -3.33 0.00 0.00 175.10 172.02 1a8y s LEU 33 N -0.47 1.93 -0.10 2.54 2.96 -1.19 -2.01 118.68 122.35 1a8y s LEU 33 Ca 0.06 -0.20 0.03 0.00 -0.22 0.00 0.00 54.13 53.80 1a8y s LEU 33 Cb -0.12 -0.58 -0.01 0.00 0.50 0.00 0.00 46.19 45.98 1a8y s LEU 33 CO 0.01 0.11 -0.20 0.00 -1.32 0.00 0.00 176.35 174.95 1a8y s ALA 34 N -0.09 2.34 -0.08 5.97 0.00 0.23 -0.57 121.76 129.56 1a8y s ALA 34 Ca 0.01 -0.96 0.02 0.00 0.00 0.00 0.00 51.96 51.02 1a8y s ALA 34 Cb -0.06 -0.91 0.02 0.00 0.00 0.00 0.00 23.12 22.17 1a8y s ALA 34 CO 0.00 0.33 -0.12 -0.51 0.00 0.00 0.00 175.76 175.46 1a8y s LEU 35 N 0.15 1.55 -0.40 0.00 1.43 0.20 0.31 118.68 121.91 1a8y s LEU 35 Ca -0.11 -0.32 -0.17 0.00 -1.03 0.00 0.00 54.13 52.50 1a8y s LEU 35 Cb -0.16 -0.87 0.01 0.00 0.03 0.00 0.00 46.19 45.20 1a8y s LEU 35 CO 0.06 -0.01 0.43 -0.22 0.23 0.00 0.00 176.35 176.84 1a8y s LEU 36 N 0.96 4.74 -0.13 1.79 0.20 0.39 -1.41 118.68 125.22 1a8y s LEU 36 Ca -0.09 -0.54 -0.23 0.00 0.69 0.00 0.00 54.13 53.97 1a8y s LEU 36 Cb -0.15 -2.39 -0.03 0.00 -0.43 0.00 0.00 46.19 43.19 1a8y s LEU 36 CO -0.00 -0.52 0.69 -0.47 -0.29 0.00 0.00 176.35 175.75 1a8y s TYR 37 N 2.13 3.48 -0.02 5.38 5.04 -0.30 -1.08 117.35 131.97 1a8y s TYR 37 Ca 0.12 1.12 -0.16 0.00 -2.44 0.00 0.00 57.07 55.72 1a8y s TYR 37 Cb -0.17 -2.82 0.03 0.00 0.35 0.00 0.00 41.96 39.34 1a8y s TYR 37 CO 0.13 -0.05 0.33 -3.38 -1.34 0.00 0.00 175.55 171.25 1a8y s HIS 38 N 1.38 -0.22 0.37 4.97 -3.43 -0.27 -2.60 115.29 115.49 1a8y s HIS 38 Ca 0.34 0.35 -0.28 0.00 -0.80 0.00 0.00 55.06 54.67 1a8y s HIS 38 Cb -0.17 0.11 -0.11 0.00 -1.43 0.00 0.00 32.58 30.99 1a8y s HIS 38 CO 0.14 -0.39 1.50 -1.21 -2.00 0.00 0.00 174.74 172.78 1a8y s GLU 39 N -1.24 4.11 0.97 -0.38 0.41 -1.26 -0.94 118.70 120.37 1a8y s GLU 39 Ca -0.13 2.57 -0.11 0.00 -0.41 0.00 0.00 54.97 56.89 1a8y s GLU 39 Cb -0.05 -2.98 0.17 0.00 -1.78 0.00 0.00 34.13 29.49 1a8y s GLU 39 CO 0.04 -0.54 1.07 -0.35 -0.49 0.00 0.00 175.26 174.99 1a8y n PRO 40 N 0.67 -0.83 -2.32 0.39 -0.04 -1.26 -4.91 135.00 126.70 1a8y n PRO 40 Ca 0.02 -0.18 -0.42 0.00 -0.04 0.00 0.00 63.50 62.87 1a8y n PRO 40 Cb 0.39 -2.30 -0.03 0.00 -0.04 0.00 0.00 33.50 31.52 1a8y n PRO 40 CO 0.00 0.00 0.00 -1.25 -0.04 0.00 0.00 175.50 174.21 1a8y s PRO 41 N -4.52 4.28 0.34 0.54 0.04 -1.26 -4.98 135.00 129.44 1a8y s PRO 41 Ca 0.67 1.82 -0.28 0.00 0.04 0.00 0.00 61.00 63.25 1a8y s PRO 41 Cb -0.23 -3.67 -0.10 0.00 0.04 0.00 0.00 34.50 30.54 1a8y s PRO 41 CO 0.60 -0.61 1.29 -1.21 0.04 0.00 0.00 177.00 177.11 1a8y s GLU 42 N 2.84 4.31 0.49 4.56 8.01 -1.26 -4.90 118.70 132.75 1a8y s GLU 42 Ca 0.60 2.18 0.43 0.00 0.01 0.00 0.00 54.97 58.19 1a8y s GLU 42 Cb -0.27 -3.02 1.57 0.00 -4.31 0.00 0.00 34.13 28.10 1a8y s GLU 42 CO 0.22 -0.21 1.47 -0.25 0.01 0.00 0.00 175.26 176.49 1a8y n ASP 43 N 0.70 0.06 -4.80 -0.19 8.00 -1.26 -4.09 116.55 114.97 1a8y n ASP 43 Ca 0.01 1.04 -0.30 0.00 0.71 0.00 0.00 54.79 56.24 1a8y n ASP 43 Cb 0.42 -0.52 0.09 0.00 -0.02 0.00 0.00 41.12 41.10 1a8y n ASP 43 CO 0.00 0.00 0.00 1.51 -0.39 0.00 0.00 177.20 178.32 1a8y s ASP 44 N -3.99 4.41 0.03 -2.24 -4.77 -1.26 -4.93 116.67 103.91 1a8y s ASP 44 Ca -0.05 1.30 -0.25 0.00 -3.30 0.00 0.00 52.55 50.25 1a8y s ASP 44 Cb 0.26 -2.02 -0.18 0.00 -1.09 0.00 0.00 42.92 39.89 1a8y s ASP 44 CO 0.82 -2.02 1.46 0.50 0.70 0.00 0.00 175.17 176.63 1a8y h LYS 45 N -1.13 -0.02 -0.96 2.11 1.63 -2.00 -2.79 116.57 113.41 1a8y h LYS 45 Ca -0.47 0.00 0.23 0.00 -0.85 0.00 0.00 60.65 59.55 1a8y h LYS 45 Cb 1.27 0.00 -0.12 0.00 -0.60 0.00 0.00 32.23 32.79 1a8y h LYS 45 CO 0.59 0.26 0.53 0.00 -3.45 0.00 0.00 179.45 177.38 1a8y h ALA 46 N 0.68 1.64 -0.16 5.00 0.00 -1.94 -0.05 119.26 124.44 1a8y h ALA 46 Ca -0.00 0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 1a8y h ALA 46 Cb 0.29 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1a8y h ALA 46 CO 0.00 -0.25 -0.20 1.03 0.00 0.00 0.00 179.25 179.83 1a8y h SER 47 N 0.55 0.44 0.59 0.00 0.87 -1.80 -2.68 113.55 111.53 1a8y h SER 47 Ca 0.60 -0.51 -0.08 0.00 -1.23 0.00 0.00 61.79 60.57 1a8y h SER 47 Cb 1.11 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 62.93 1a8y h SER 47 CO -0.47 0.86 -0.40 1.56 -0.53 0.00 0.00 176.83 177.84 1a8y h GLN 48 N 0.04 0.00 -0.07 2.24 4.20 -1.15 -2.19 115.11 118.18 1a8y h GLN 48 Ca 0.02 0.00 -0.24 0.00 0.06 0.00 0.00 58.65 58.49 1a8y h GLN 48 Cb 0.75 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.55 1a8y h GLN 48 CO 0.05 0.40 -0.92 0.00 -0.67 0.00 0.00 178.83 177.70 1a8y h ARG 49 N 0.00 0.71 -0.22 1.46 3.08 -1.01 0.38 114.38 118.78 1a8y h ARG 49 Ca -0.00 -0.67 -0.01 0.00 0.07 0.00 0.00 59.98 59.36 1a8y h ARG 49 Cb 0.81 0.17 -0.01 0.00 0.08 0.00 0.00 29.97 31.02 1a8y h ARG 49 CO 0.05 1.27 0.09 1.96 -1.07 0.00 0.00 179.97 182.26 1a8y h GLN 50 N 0.44 0.30 0.08 0.04 4.20 -1.37 -1.90 115.11 116.90 1a8y h GLN 50 Ca -0.09 -0.03 -0.26 0.00 0.06 0.00 0.00 58.65 58.33 1a8y h GLN 50 Cb 1.55 -0.06 -0.01 0.00 0.30 0.00 0.00 27.48 29.26 1a8y h GLN 50 CO 0.18 0.26 -1.28 0.35 -0.67 0.00 0.00 178.83 177.67 1a8y h PHE 51 N 0.30 0.30 -0.70 2.96 3.57 -1.13 -3.11 116.94 119.14 1a8y h PHE 51 Ca 0.08 -0.22 0.09 0.00 3.53 0.00 0.00 57.97 61.44 1a8y h PHE 51 Cb 0.07 -0.01 -0.07 0.00 2.79 0.00 0.00 35.95 38.73 1a8y h PHE 51 CO 0.00 1.20 0.36 1.49 -2.23 0.00 0.00 178.31 179.13 1a8y h GLU 52 N 0.05 0.60 -0.14 1.11 4.81 0.46 -2.56 114.58 118.91 1a8y h GLU 52 Ca -0.13 -0.04 -0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1a8y h GLU 52 Cb 1.93 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 31.17 1a8y h GLU 52 CO 0.16 0.40 0.09 1.98 -0.73 0.00 0.00 179.01 180.90 1a8y h MET 53 N 0.62 0.19 -0.64 1.92 4.05 -1.44 -2.80 114.93 116.82 1a8y h MET 53 Ca 0.34 -0.02 -0.08 0.00 -0.28 0.00 0.00 59.70 59.66 1a8y h MET 53 Cb 0.33 -0.04 -0.02 0.00 -0.80 0.00 0.00 31.60 31.07 1a8y h MET 53 CO -0.25 0.16 0.08 0.93 0.23 0.00 0.00 176.91 178.06 1a8y h GLU 54 N 0.16 1.07 -0.62 0.39 5.08 -1.39 -0.48 114.58 118.78 1a8y h GLU 54 Ca 0.05 -0.30 -0.09 0.00 -1.00 0.00 0.00 59.36 58.02 1a8y h GLU 54 Cb 0.02 -0.12 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1a8y h GLU 54 CO -0.01 1.00 0.04 1.49 -1.00 0.00 0.00 179.01 180.53 1a8y h GLU 55 N 0.98 1.06 0.00 2.33 4.22 -1.52 -1.44 114.58 120.21 1a8y h GLU 55 Ca 0.19 -0.32 -0.11 0.00 0.08 0.00 0.00 59.36 59.20 1a8y h GLU 55 Cb 0.46 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.59 1a8y h GLU 55 CO 0.02 1.02 -0.52 1.25 -2.18 0.00 0.00 179.01 178.60 1a8y h LEU 56 N 0.97 0.00 -0.36 1.64 5.85 -1.24 0.95 115.31 123.12 1a8y h LEU 56 Ca 0.18 0.00 -0.17 0.00 0.84 0.00 0.00 57.88 58.73 1a8y h LEU 56 Cb 0.51 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 41.54 1a8y h LEU 56 CO 0.02 0.52 -0.45 0.40 -0.34 0.00 0.00 178.44 178.59 1a8y h ILE 57 N 0.00 1.27 -0.00 4.05 2.04 -0.75 -2.60 117.51 121.52 1a8y h ILE 57 Ca -0.01 -1.63 -0.10 0.00 1.00 0.00 0.00 64.86 64.12 1a8y h ILE 57 Cb 1.01 1.47 -0.01 0.00 -0.74 0.00 0.00 36.82 38.55 1a8y h ILE 57 CO 0.07 0.54 -0.49 -0.07 0.00 0.00 0.00 178.15 178.19 1a8y h LEU 58 N 0.73 0.00 -1.35 1.44 3.38 -1.06 -2.62 115.31 115.83 1a8y h LEU 58 Ca 0.04 -0.00 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1a8y h LEU 58 Cb 1.05 -0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.78 1a8y h LEU 58 CO 0.11 0.50 0.03 -0.33 0.09 0.00 0.00 178.44 178.84 1a8y h GLU 59 N 0.00 0.47 -0.08 1.13 4.39 -0.69 -1.14 114.58 118.66 1a8y h GLU 59 Ca -0.00 -0.08 -0.08 0.00 0.34 0.00 0.00 59.36 59.53 1a8y h GLU 59 Cb 0.87 -0.08 0.00 0.00 -0.10 0.00 0.00 28.75 29.45 1a8y h GLU 59 CO 0.06 0.47 -0.26 1.25 -1.16 0.00 0.00 179.01 179.37 1a8y h LEU 60 N 0.46 0.37 -1.21 1.33 6.46 -1.16 -2.93 115.31 118.63 1a8y h LEU 60 Ca 0.10 -0.61 0.07 0.00 -0.12 0.00 0.00 57.88 57.32 1a8y h LEU 60 Cb 0.25 -0.11 -0.06 0.00 -0.73 0.00 0.00 40.66 40.01 1a8y h LEU 60 CO 0.00 0.92 0.56 0.00 -0.62 0.00 0.00 178.44 179.30 1a8y h ALA 61 N 0.46 1.57 -0.35 1.25 0.00 -1.40 -2.18 119.26 118.61 1a8y h ALA 61 Ca -0.01 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 54.91 1a8y h ALA 61 Cb 0.89 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 18.41 1a8y h ALA 61 CO 0.06 0.29 0.17 0.00 0.00 0.00 0.00 179.25 179.77 1a8y h ALA 62 N 1.54 0.43 -0.27 0.00 0.00 -1.19 0.24 119.26 120.01 1a8y h ALA 62 Ca 0.37 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.27 1a8y h ALA 62 Cb 0.23 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.97 1a8y h ALA 62 CO -0.14 -0.20 0.07 0.37 0.00 0.00 0.00 179.25 179.35 1a8y h GLN 63 N 0.35 0.43 0.03 0.00 4.15 -1.27 -0.71 115.11 118.09 1a8y h GLN 63 Ca 0.15 -0.10 -0.00 0.00 0.77 0.00 0.00 58.65 59.47 1a8y h GLN 63 Cb 0.07 -0.06 0.00 0.00 0.21 0.00 0.00 27.48 27.70 1a8y h GLN 63 CO -0.11 0.52 -0.01 0.28 -1.93 0.00 0.00 178.83 177.57 1a8y h VAL 64 N 0.27 1.08 -0.47 2.39 2.07 -1.27 -3.10 116.25 117.21 1a8y h VAL 64 Ca 0.09 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.29 1a8y h VAL 64 Cb 0.28 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.34 1a8y h VAL 64 CO 0.00 0.08 0.00 0.18 0.02 0.00 0.00 177.57 177.85 1a8y n LEU 65 N -5.04 3.20 -0.13 2.57 4.77 0.06 -4.43 117.00 118.00 1a8y n LEU 65 Ca -0.08 -1.61 -0.04 0.00 -0.03 0.00 0.00 56.01 54.25 1a8y n LEU 65 Cb 0.10 -0.43 0.02 0.00 -2.33 0.00 0.00 43.42 40.78 1a8y n LEU 65 CO 0.33 0.62 0.79 -0.08 -1.33 0.00 0.00 177.39 177.72 1a8y h GLU 66 N 2.88 0.01 -0.01 3.23 4.81 -1.04 -2.80 114.58 121.66 1a8y h GLU 66 Ca 0.00 -0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1a8y h GLU 66 Cb 0.95 -0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.32 1a8y h GLU 66 CO 0.11 0.01 0.00 -0.25 -0.73 0.00 0.00 179.01 178.15 1a8y n ASP 67 N -5.30 0.08 -0.19 1.04 8.00 -1.26 -3.12 116.55 115.79 1a8y n ASP 67 Ca 0.03 -1.57 0.06 0.00 0.71 0.00 0.00 54.79 54.02 1a8y n ASP 67 Cb 0.23 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.30 1a8y n ASP 67 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1a8y n LYS 68 N -0.67 2.22 -0.50 -1.24 4.76 -1.06 -5.03 118.16 116.65 1a8y n LYS 68 Ca 0.11 -0.46 0.00 0.00 -2.87 0.00 0.00 58.31 55.09 1a8y n LYS 68 Cb 0.06 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.10 1a8y n LYS 68 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1a8y n GLY 69 N 1.12 0.71 3.56 0.72 0.00 -1.18 -4.95 105.19 105.17 1a8y n GLY 69 Ca 0.04 -0.38 -0.41 0.00 0.00 0.00 0.00 46.02 45.27 1a8y n GLY 69 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1a8y s VAL 70 N -2.00 5.12 0.39 1.61 1.01 -1.24 -3.29 120.40 122.01 1a8y s VAL 70 Ca 0.00 0.23 -0.00 0.00 0.00 0.00 0.00 61.98 62.20 1a8y s VAL 70 Cb 0.00 -3.85 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 1a8y s VAL 70 CO 0.00 -0.09 0.61 -0.83 0.00 0.00 0.00 175.10 174.79 1a8y s GLY 71 N 1.72 1.41 0.05 4.51 0.00 -0.85 -4.62 107.32 109.55 1a8y s GLY 71 Ca 0.14 -0.87 0.05 0.00 0.00 0.00 0.00 44.72 44.04 1a8y s GLY 71 CO 0.12 -0.77 -0.14 -1.36 0.00 0.00 0.00 173.10 170.95 1a8y s PHE 72 N -2.44 1.17 0.18 1.90 0.40 -1.26 -0.61 117.98 117.32 1a8y s PHE 72 Ca 0.43 -0.40 -0.15 0.00 -0.60 0.00 0.00 56.93 56.21 1a8y s PHE 72 Cb -0.10 -0.68 0.02 0.00 0.51 0.00 0.00 43.02 42.77 1a8y s PHE 72 CO 0.38 0.04 0.44 0.20 0.70 0.00 0.00 175.22 176.98 1a8y s GLY 73 N -1.38 0.02 -0.12 4.36 0.00 0.15 -1.80 107.32 108.55 1a8y s GLY 73 Ca -0.01 -0.36 0.02 0.00 0.00 0.00 0.00 44.72 44.37 1a8y s GLY 73 CO 0.02 -0.42 -0.17 1.08 0.00 0.00 0.00 173.10 173.61 1a8y s LEU 74 N -2.89 1.83 -0.25 0.66 1.43 -0.29 -0.47 118.68 118.72 1a8y s LEU 74 Ca 0.10 -0.49 0.01 0.00 -1.03 0.00 0.00 54.13 52.72 1a8y s LEU 74 Cb 0.01 -1.21 0.04 0.00 0.03 0.00 0.00 46.19 45.06 1a8y s LEU 74 CO -0.04 0.03 -0.10 -0.69 0.23 0.00 0.00 176.35 175.78 1a8y s VAL 75 N 1.00 2.48 0.11 -1.59 1.01 -0.25 -2.34 120.40 120.83 1a8y s VAL 75 Ca -0.05 -1.28 -0.30 0.00 0.00 0.00 0.00 61.98 60.35 1a8y s VAL 75 Cb -0.15 -2.32 -0.06 0.00 0.00 0.00 0.00 36.38 33.85 1a8y s VAL 75 CO -0.03 0.14 1.11 -0.62 0.00 0.00 0.00 175.10 175.70 1a8y s ASP 76 N 1.23 7.24 0.45 3.32 -1.08 -1.26 -1.12 116.67 125.44 1a8y s ASP 76 Ca -0.03 1.99 0.21 0.00 -0.52 0.00 0.00 52.55 54.19 1a8y s ASP 76 Cb -0.18 -2.59 1.06 0.00 -1.46 0.00 0.00 42.92 39.75 1a8y s ASP 76 CO -0.06 -0.29 1.93 0.77 0.52 0.00 0.00 175.17 178.04 1a8y h SER 77 N 5.91 0.00 0.00 -0.34 4.64 -1.36 0.16 113.55 122.56 1a8y h SER 77 Ca -0.43 0.00 -0.41 0.00 -0.47 0.00 0.00 61.79 60.48 1a8y h SER 77 Cb 1.21 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.24 1a8y h SER 77 CO 0.75 0.24 -2.45 -0.62 -0.87 0.00 0.00 176.83 173.89 1a8y n GLU 78 N -3.80 0.58 0.08 4.77 1.02 -1.26 -3.96 120.64 118.07 1a8y n GLU 78 Ca -0.02 0.20 -0.04 0.00 -0.02 0.00 0.00 57.16 57.29 1a8y n GLU 78 Cb 0.34 -1.46 -0.08 0.00 -0.02 0.00 0.00 31.44 30.22 1a8y n GLU 78 CO 0.00 0.00 0.00 -0.22 1.18 0.00 0.00 177.13 178.09 1a8y h LYS 79 N -0.53 0.00 -0.41 3.49 3.64 -1.96 -3.31 116.57 117.49 1a8y h LYS 79 Ca -0.62 0.00 -0.29 0.00 -1.27 0.00 0.00 60.65 58.47 1a8y h LYS 79 Cb 1.71 0.00 -0.22 0.00 -0.41 0.00 0.00 32.23 33.31 1a8y h LYS 79 CO -0.27 0.77 -0.55 -0.25 -2.27 0.00 0.00 179.45 176.88 1a8y n ASP 80 N -3.26 3.44 -0.29 4.20 8.00 0.04 -4.84 116.55 123.83 1a8y n ASP 80 Ca -0.01 -3.82 0.16 0.00 0.71 0.00 0.00 54.79 51.82 1a8y n ASP 80 Cb 0.88 -0.47 0.42 0.00 -0.02 0.00 0.00 41.12 41.93 1a8y n ASP 80 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1a8y h ALA 81 N 1.57 1.94 -0.09 2.24 0.00 -1.65 -1.49 119.26 121.78 1a8y h ALA 81 Ca 0.21 0.04 -0.20 0.00 0.00 0.00 0.00 54.91 54.96 1a8y h ALA 81 Cb 1.31 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 19.03 1a8y h ALA 81 CO 0.44 -0.26 -0.76 0.00 0.00 0.00 0.00 179.25 178.67 1a8y h ALA 82 N 1.62 0.51 -0.64 0.00 0.00 -1.90 -1.69 119.26 117.16 1a8y h ALA 82 Ca 0.51 -0.62 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 1a8y h ALA 82 Cb 1.00 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1a8y h ALA 82 CO -0.26 0.75 0.05 0.28 0.00 0.00 0.00 179.25 180.07 1a8y h VAL 83 N 0.33 1.27 0.60 0.00 2.07 -1.76 -2.83 116.25 115.93 1a8y h VAL 83 Ca -0.04 -1.10 -0.03 0.00 0.82 0.00 0.00 66.70 66.35 1a8y h VAL 83 Cb 1.35 0.72 0.01 0.00 -1.52 0.00 0.00 31.29 31.85 1a8y h VAL 83 CO 0.14 0.41 -0.29 0.00 0.02 0.00 0.00 177.57 177.84 1a8y h ALA 84 N 1.02 -0.81 -0.68 1.67 0.00 -1.23 -3.04 119.26 116.19 1a8y h ALA 84 Ca 0.19 -0.19 0.14 0.00 0.00 0.00 0.00 54.91 55.05 1a8y h ALA 84 Cb 0.50 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 18.47 1a8y h ALA 84 CO 0.02 -0.92 -0.16 0.87 0.00 0.00 0.00 179.25 179.06 1a8y h LYS 85 N -0.87 0.01 0.00 0.00 1.57 -1.29 -2.21 116.57 113.78 1a8y h LYS 85 Ca -0.08 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.70 1a8y h LYS 85 Cb 0.64 -0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.95 1a8y h LYS 85 CO 0.14 0.00 0.00 1.17 -0.57 0.00 0.00 179.45 180.19 1a8y n LYS 86 N -5.45 0.90 -0.02 3.15 4.81 -1.07 -3.67 118.16 116.81 1a8y n LYS 86 Ca 0.09 0.00 -0.02 0.00 -0.87 0.00 0.00 58.31 57.51 1a8y n LYS 86 Cb 0.36 -1.48 -0.02 0.00 0.02 0.00 0.00 35.03 33.90 1a8y n LYS 86 CO 0.00 0.00 0.00 1.28 1.17 0.00 0.00 177.40 179.85 1a8y n LEU 87 N -0.98 0.63 0.00 3.14 4.32 -0.88 -5.04 117.00 118.18 1a8y n LEU 87 Ca 0.21 -0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.19 1a8y n LEU 87 Cb 0.10 0.03 0.00 0.00 -1.62 0.00 0.00 43.42 41.93 1a8y n LEU 87 CO 0.16 0.18 0.00 0.61 -1.22 0.00 0.00 177.39 177.12 1a8y n GLY 88 N 2.91 1.85 3.40 -0.72 0.00 -0.91 -5.05 105.19 106.67 1a8y n GLY 88 Ca -0.06 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.52 1a8y n GLY 88 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1a8y s LEU 89 N 0.00 5.15 -0.02 0.99 1.02 -1.07 -4.81 118.68 119.95 1a8y s LEU 89 Ca 0.00 -1.45 0.02 0.00 0.02 0.00 0.00 54.13 52.72 1a8y s LEU 89 Cb 0.00 -2.34 -0.02 0.00 0.02 0.00 0.00 46.19 43.85 1a8y s LEU 89 CO 0.00 -1.17 0.00 0.35 0.02 0.00 0.00 176.35 175.55 1a8y n THR 90 N 5.56 0.14 -2.94 5.49 -2.24 -1.26 -4.53 114.28 114.51 1a8y n THR 90 Ca -0.03 -0.08 -0.41 0.00 -2.27 0.00 0.00 64.05 61.26 1a8y n THR 90 Cb 0.44 -0.89 -0.04 0.00 -2.10 0.00 0.00 70.33 67.74 1a8y n THR 90 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 1a8y s GLU 91 N -2.05 4.41 0.00 -0.78 0.41 -1.26 -5.04 118.70 114.39 1a8y s GLU 91 Ca -0.01 1.01 0.00 0.00 -0.41 0.00 0.00 54.97 55.56 1a8y s GLU 91 Cb 0.01 -3.49 0.00 0.00 -1.78 0.00 0.00 34.13 28.86 1a8y s GLU 91 CO 0.08 -0.09 0.00 -1.91 -0.49 0.00 0.00 175.26 172.85 1a8y n GLU 92 N 4.29 0.00 -1.56 1.61 4.07 -1.26 -3.78 120.64 124.01 1a8y n GLU 92 Ca 0.02 0.00 -0.40 0.00 -0.06 0.00 0.00 57.16 56.72 1a8y n GLU 92 Cb 0.50 -0.41 -0.02 0.00 -0.06 0.00 0.00 31.44 31.45 1a8y n GLU 92 CO 0.00 0.00 0.00 -0.25 -0.06 0.00 0.00 177.13 176.82 1a8y n ASP 93 N 0.00 7.65 -4.33 4.31 8.00 -1.25 -3.89 116.55 127.03 1a8y n ASP 93 Ca 0.00 -2.75 -0.17 0.00 0.71 0.00 0.00 54.79 52.58 1a8y n ASP 93 Cb 0.00 -1.54 -0.10 0.00 -0.02 0.00 0.00 41.12 39.46 1a8y n ASP 93 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1a8y s SER 94 N 1.94 2.17 0.02 -2.24 1.04 -1.07 -4.93 113.70 110.63 1a8y s SER 94 Ca 0.62 -1.12 -0.16 0.00 0.48 0.00 0.00 55.95 55.77 1a8y s SER 94 Cb 0.17 -0.06 -0.06 0.00 0.10 0.00 0.00 66.02 66.17 1a8y s SER 94 CO -0.07 -0.36 0.45 -0.63 0.98 0.00 0.00 173.24 173.61 1a8y s ILE 95 N -3.22 4.96 -0.02 -1.02 -1.09 -1.26 -1.15 121.20 118.41 1a8y s ILE 95 Ca 0.24 0.91 0.03 0.00 -2.23 0.00 0.00 60.65 59.61 1a8y s ILE 95 Cb 0.03 -3.75 -0.00 0.00 -1.58 0.00 0.00 42.46 37.16 1a8y s ILE 95 CO 0.07 0.56 -0.10 -0.31 -1.23 0.00 0.00 174.94 173.93 1a8y s TYR 96 N -1.10 0.95 -0.15 3.97 1.51 -0.50 -2.56 117.35 119.46 1a8y s TYR 96 Ca 0.25 -0.20 0.02 0.00 -1.01 0.00 0.00 57.07 56.13 1a8y s TYR 96 Cb -0.17 -0.64 0.01 0.00 -0.11 0.00 0.00 41.96 41.06 1a8y s TYR 96 CO 0.15 -0.05 -0.21 0.08 -1.11 0.00 0.00 175.55 174.41 1a8y s VAL 97 N -0.08 2.02 -0.86 0.71 1.01 -0.59 -0.63 120.40 121.98 1a8y s VAL 97 Ca 0.01 -0.94 -0.12 0.00 0.00 0.00 0.00 61.98 60.94 1a8y s VAL 97 Cb -0.06 -1.80 0.22 0.00 0.00 0.00 0.00 36.38 34.74 1a8y s VAL 97 CO -0.00 0.54 0.80 -0.36 0.00 0.00 0.00 175.10 176.08 1a8y s PHE 98 N 1.02 3.83 -0.39 5.22 0.40 0.27 -1.29 117.98 127.04 1a8y s PHE 98 Ca -0.02 -2.23 -0.20 0.00 -0.60 0.00 0.00 56.93 53.88 1a8y s PHE 98 Cb -0.14 -3.74 0.01 0.00 0.51 0.00 0.00 43.02 39.65 1a8y s PHE 98 CO -0.06 -0.96 0.59 0.21 0.70 0.00 0.00 175.22 175.70 1a8y s LYS 99 N -0.18 3.48 -0.08 0.44 2.20 -1.13 -3.18 119.74 121.29 1a8y s LYS 99 Ca 0.21 -0.21 -0.07 0.00 -0.36 0.00 0.00 55.97 55.53 1a8y s LYS 99 Cb -0.11 -3.87 0.01 0.00 -1.51 0.00 0.00 37.83 32.35 1a8y s LYS 99 CO -0.08 -0.82 0.12 -0.85 -0.36 0.00 0.00 175.35 173.36 1a8y n GLU 100 N 6.01 -0.43 0.00 4.03 0.28 -1.23 -3.39 120.64 125.91 1a8y n GLU 100 Ca -0.03 0.49 0.00 0.00 -0.16 0.00 0.00 57.16 57.47 1a8y n GLU 100 Cb 0.48 -0.66 0.00 0.00 1.43 0.00 0.00 31.44 32.69 1a8y n GLU 100 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 177.13 176.72 1a8y n ASP 101 N 1.04 0.00 -4.74 -1.84 9.92 -1.26 -4.90 116.55 114.77 1a8y n ASP 101 Ca -0.02 0.00 -0.41 0.00 -0.53 0.00 0.00 54.79 53.83 1a8y n ASP 101 Cb 0.28 0.00 -0.03 0.00 -0.64 0.00 0.00 41.12 40.73 1a8y n ASP 101 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 1a8y s GLU 102 N 0.00 4.40 0.00 -1.24 4.04 -1.22 -4.97 118.70 119.72 1a8y s GLU 102 Ca 0.00 2.03 -0.25 0.00 0.04 0.00 0.00 54.97 56.78 1a8y s GLU 102 Cb 0.00 -3.20 -0.04 0.00 0.02 0.00 0.00 34.13 30.90 1a8y s GLU 102 CO 0.00 -0.24 0.79 0.08 -1.84 0.00 0.00 175.26 174.04 1a8y s VAL 103 N 0.15 4.85 -0.09 1.83 1.01 -1.26 -2.83 120.40 124.07 1a8y s VAL 103 Ca 0.57 1.65 0.01 0.00 0.00 0.00 0.00 61.98 64.20 1a8y s VAL 103 Cb -0.36 -4.13 -0.03 0.00 0.00 0.00 0.00 36.38 31.87 1a8y s VAL 103 CO 0.38 0.29 -0.09 -0.63 0.00 0.00 0.00 175.10 175.05 1a8y s ILE 104 N 0.40 3.47 -0.10 2.22 1.01 -0.41 -4.99 121.20 122.80 1a8y s ILE 104 Ca 0.41 -0.55 -0.04 0.00 0.00 0.00 0.00 60.65 60.46 1a8y s ILE 104 Cb -0.20 -2.43 -0.04 0.00 0.01 0.00 0.00 42.46 39.81 1a8y s ILE 104 CO 0.22 0.57 0.07 -0.70 0.00 0.00 0.00 174.94 175.10 1a8y s GLU 105 N -0.42 3.21 -0.24 2.79 2.12 -1.26 -1.54 118.70 123.36 1a8y s GLU 105 Ca 0.06 -0.27 -0.16 0.00 0.36 0.00 0.00 54.97 54.95 1a8y s GLU 105 Cb -0.12 -2.99 -0.03 0.00 0.26 0.00 0.00 34.13 31.25 1a8y s GLU 105 CO 0.02 0.74 0.43 -0.47 -0.54 0.00 0.00 175.26 175.44 1a8y s TYR 106 N -0.96 3.30 -1.59 5.30 5.04 -1.06 -4.96 117.35 122.43 1a8y s TYR 106 Ca 0.14 0.56 0.17 0.00 -2.44 0.00 0.00 57.07 55.51 1a8y s TYR 106 Cb -0.12 -2.60 0.45 0.00 0.35 0.00 0.00 41.96 40.04 1a8y s TYR 106 CO 0.03 -0.16 1.37 -0.25 -1.34 0.00 0.00 175.55 175.20 1a8y n ASP 107 N 5.06 3.37 0.00 4.32 8.00 -1.26 -4.63 116.55 131.40 1a8y n ASP 107 Ca -0.07 -1.97 0.00 0.00 0.71 0.00 0.00 54.79 53.46 1a8y n ASP 107 Cb 0.51 -0.33 0.00 0.00 -0.02 0.00 0.00 41.12 41.28 1a8y n ASP 107 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a8y n GLY 108 N 1.12 6.35 3.63 0.44 0.00 -1.10 -2.94 105.19 112.69 1a8y n GLY 108 Ca 0.18 -2.00 -0.48 0.00 0.00 0.00 0.00 46.02 43.71 1a8y n GLY 108 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1a8y n GLU 109 N 0.00 1.71 -3.02 1.61 2.13 0.16 -4.92 120.64 118.31 1a8y n GLU 109 Ca 0.00 0.61 -0.44 0.00 0.66 0.00 0.00 57.16 57.99 1a8y n GLU 109 Cb 0.00 -2.30 -0.00 0.00 0.27 0.00 0.00 31.44 29.40 1a8y n GLU 109 CO 0.00 0.00 0.00 0.12 -0.41 0.00 0.00 177.13 176.84 1a8y s PHE 110 N 0.55 3.60 -0.07 4.31 2.19 -1.26 -4.56 117.98 122.73 1a8y s PHE 110 Ca 0.79 -2.15 -0.10 0.00 0.33 0.00 0.00 56.93 55.80 1a8y s PHE 110 Cb -0.79 -4.22 0.02 0.00 -1.31 0.00 0.00 43.02 36.72 1a8y s PHE 110 CO 0.44 -1.32 0.25 -1.54 1.83 0.00 0.00 175.22 174.87 1a8y s SER 111 N 2.65 -0.22 0.44 6.13 1.04 -1.26 -5.04 113.70 117.45 1a8y s SER 111 Ca 0.39 0.36 0.22 0.00 0.48 0.00 0.00 55.95 57.40 1a8y s SER 111 Cb -0.04 0.45 1.21 0.00 0.10 0.00 0.00 66.02 67.74 1a8y s SER 111 CO -0.02 -0.18 1.81 0.00 0.98 0.00 0.00 173.24 175.83 1a8y h ALA 112 N 5.26 2.43 0.70 5.32 0.00 -1.91 -2.42 119.26 128.64 1a8y h ALA 112 Ca -0.27 0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1a8y h ALA 112 Cb 1.19 0.03 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1a8y h ALA 112 CO 0.36 -0.77 -0.38 0.22 0.00 0.00 0.00 179.25 178.68 1a8y h ASP 113 N 0.29 -0.92 0.47 0.00 3.58 -1.96 -2.81 116.42 115.08 1a8y h ASP 113 Ca 0.53 0.04 -0.16 0.00 0.42 0.00 0.00 57.03 57.87 1a8y h ASP 113 Cb 1.55 0.25 -0.01 0.00 1.72 0.00 0.00 39.33 42.83 1a8y h ASP 113 CO -0.19 -0.61 -0.69 0.74 -2.88 0.00 0.00 179.24 175.62 1a8y h THR 114 N -0.99 1.43 -0.33 2.25 2.02 -1.83 -3.20 112.91 112.26 1a8y h THR 114 Ca -0.10 -2.21 0.03 0.00 0.77 0.00 0.00 66.41 64.91 1a8y h THR 114 Cb 0.77 2.17 -0.03 0.00 -1.74 0.00 0.00 68.15 69.32 1a8y h THR 114 CO 0.13 0.65 0.15 -0.07 0.37 0.00 0.00 175.52 176.75 1a8y h LEU 115 N 0.13 0.20 -0.88 2.58 3.38 -1.52 -0.86 115.31 118.35 1a8y h LEU 115 Ca -0.02 0.02 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 1a8y h LEU 115 Cb 1.23 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.94 1a8y h LEU 115 CO 0.10 0.16 0.02 0.58 0.09 0.00 0.00 178.44 179.39 1a8y h VAL 116 N 0.31 1.25 -0.38 1.22 2.07 -1.52 -0.90 116.25 118.30 1a8y h VAL 116 Ca 0.14 -1.01 -0.11 0.00 0.82 0.00 0.00 66.70 66.55 1a8y h VAL 116 Cb 0.07 0.82 -0.01 0.00 -1.52 0.00 0.00 31.29 30.66 1a8y h VAL 116 CO -0.11 0.36 -0.17 -0.33 0.02 0.00 0.00 177.57 177.34 1a8y h GLU 117 N 0.80 0.79 0.18 1.57 5.08 -1.54 -1.83 114.58 119.63 1a8y h GLU 117 Ca 0.16 -0.34 0.01 0.00 -1.00 0.00 0.00 59.36 58.18 1a8y h GLU 117 Cb 0.45 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.65 1a8y h GLU 117 CO 0.02 0.96 -0.21 0.35 -1.00 0.00 0.00 179.01 179.14 1a8y h PHE 118 N 0.59 -0.54 0.00 4.33 3.57 -0.87 -1.03 116.94 122.99 1a8y h PHE 118 Ca 0.09 0.01 -0.06 0.00 3.53 0.00 0.00 57.97 61.53 1a8y h PHE 118 Cb 0.72 0.22 -0.01 0.00 2.79 0.00 0.00 35.95 39.67 1a8y h PHE 118 CO 0.06 -0.31 -0.28 -0.07 -2.23 0.00 0.00 178.31 175.48 1a8y h LEU 119 N -0.43 0.00 -0.49 0.59 3.38 -1.12 0.22 115.31 117.46 1a8y h LEU 119 Ca 0.01 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.82 1a8y h LEU 119 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 1a8y h LEU 119 CO -0.07 0.28 -0.50 -0.07 0.09 0.00 0.00 178.44 178.16 1a8y h LEU 120 N 0.00 0.73 -0.83 1.67 4.07 -1.22 0.26 115.31 119.99 1a8y h LEU 120 Ca -0.00 -0.37 -0.12 0.00 0.08 0.00 0.00 57.88 57.47 1a8y h LEU 120 Cb 0.56 -0.21 -0.01 0.00 1.08 0.00 0.00 40.66 42.08 1a8y h LEU 120 CO 0.04 1.10 -0.38 0.44 -1.08 0.00 0.00 178.44 178.56 1a8y h ASP 121 N 0.52 0.43 -0.55 -0.43 3.32 0.60 -2.68 116.42 117.64 1a8y h ASP 121 Ca 0.02 -0.18 -0.04 0.00 0.02 0.00 0.00 57.03 56.85 1a8y h ASP 121 Cb 1.06 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 40.46 1a8y h ASP 121 CO 0.10 0.78 0.20 0.58 -1.72 0.00 0.00 179.24 179.17 1a8y h VAL 122 N 0.35 1.22 0.00 -1.35 2.07 -0.13 -2.43 116.25 115.98 1a8y h VAL 122 Ca 0.03 -0.75 -0.01 0.00 0.82 0.00 0.00 66.70 66.79 1a8y h VAL 122 Cb 0.83 0.56 -0.00 0.00 -1.52 0.00 0.00 31.29 31.16 1a8y h VAL 122 CO 0.07 0.29 -0.06 -0.07 0.02 0.00 0.00 177.57 177.82 1a8y h LEU 123 N 0.86 0.00-10.37 2.57 3.38 -0.61 -3.44 115.31 107.70 1a8y h LEU 123 Ca 0.20 0.00 -0.51 0.00 0.09 0.00 0.00 57.88 57.66 1a8y h LEU 123 Cb 0.23 0.00 0.08 0.00 0.09 0.00 0.00 40.66 41.06 1a8y h LEU 123 CO -0.01 0.06 0.40 -1.61 0.09 0.00 0.00 178.44 177.37 1a8y s GLU 124 N -4.12 3.16 0.34 1.13 0.41 -0.92 -5.04 118.70 113.67 1a8y s GLU 124 Ca -0.03 0.77 -0.29 0.00 -0.41 0.00 0.00 54.97 55.02 1a8y s GLU 124 Cb 0.12 -2.03 -0.11 0.00 -1.78 0.00 0.00 34.13 30.34 1a8y s GLU 124 CO 0.53 -0.89 1.41 -0.51 -0.49 0.00 0.00 175.26 175.31 1a8y s ASP 125 N -4.06 6.56 0.44 -0.19 1.01 -1.26 -4.98 116.67 114.20 1a8y s ASP 125 Ca 0.57 2.85 0.25 0.00 0.71 0.00 0.00 52.55 56.92 1a8y s ASP 125 Cb -0.12 -2.65 0.86 0.00 1.01 0.00 0.00 42.92 42.01 1a8y s ASP 125 CO 0.54 -0.71 1.80 1.55 0.21 0.00 0.00 175.17 178.56 1a8y h PRO 126 N 3.51 0.00 -5.18 8.23 0.13 -1.93 -3.42 132.00 133.34 1a8y h PRO 126 Ca -0.49 0.00 -0.66 0.00 -0.87 0.00 0.00 66.00 63.97 1a8y h PRO 126 Cb 1.23 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 32.06 1a8y h PRO 126 CO 0.67 0.19 -0.79 0.08 -0.23 0.00 0.00 178.00 177.92 1a8y s VAL 127 N -3.55 2.75 -0.22 1.56 1.01 -1.26 -4.34 120.40 116.36 1a8y s VAL 127 Ca 0.02 -0.74 -0.08 0.00 0.00 0.00 0.00 61.98 61.18 1a8y s VAL 127 Cb 0.09 -2.17 -0.04 0.00 0.00 0.00 0.00 36.38 34.26 1a8y s VAL 127 CO 0.63 0.51 0.08 -0.70 0.00 0.00 0.00 175.10 175.62 1a8y s GLU 128 N 0.87 3.84 0.33 2.72 2.12 -0.94 -4.95 118.70 122.69 1a8y s GLU 128 Ca -0.04 -0.40 -0.15 0.00 0.36 0.00 0.00 54.97 54.74 1a8y s GLU 128 Cb -0.15 -3.30 -0.09 0.00 0.26 0.00 0.00 34.13 30.85 1a8y s GLU 128 CO -0.01 0.05 0.75 -0.51 -0.54 0.00 0.00 175.26 175.00 1a8y s LEU 129 N 1.00 4.05 -0.28 2.70 1.02 -1.26 -2.73 118.68 123.18 1a8y s LEU 129 Ca 0.04 1.31 -0.06 0.00 0.02 0.00 0.00 54.13 55.45 1a8y s LEU 129 Cb -0.14 -4.11 0.01 0.00 0.02 0.00 0.00 46.19 41.97 1a8y s LEU 129 CO 0.03 -0.22 0.05 -0.63 0.02 0.00 0.00 176.35 175.60 1a8y s ILE 130 N -2.00 3.75 -0.22 -0.59 -1.09 0.56 -4.91 121.20 116.71 1a8y s ILE 130 Ca 0.55 -0.70 -0.04 0.00 -2.23 0.00 0.00 60.65 58.23 1a8y s ILE 130 Cb -0.10 -2.90 0.07 0.00 -1.58 0.00 0.00 42.46 37.95 1a8y s ILE 130 CO 0.17 0.15 0.09 -1.83 -1.23 0.00 0.00 174.94 172.28 1a8y s GLU 131 N 1.48 0.30 0.07 2.79 -1.05 -1.26 -4.34 118.70 116.68 1a8y s GLU 131 Ca 0.03 -0.37 0.00 0.00 -0.15 0.00 0.00 54.97 54.48 1a8y s GLU 131 Cb -0.17 -1.75 0.00 0.00 -0.44 0.00 0.00 34.13 31.77 1a8y s GLU 131 CO 0.01 -0.78 0.00 0.41 0.95 0.00 0.00 175.26 175.85 1a8y n GLY 132 N 5.18 -3.25 0.00 -3.83 0.00 -1.26 -4.64 105.19 97.39 1a8y n GLY 132 Ca -0.07 -1.08 0.00 0.00 0.00 0.00 0.00 46.02 44.87 1a8y n GLY 132 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1a8y n GLU 133 N -0.92 0.00 0.00 1.61 -0.58 -1.26 -1.68 120.64 117.81 1a8y n GLU 133 Ca 0.00 0.00 0.13 0.00 -0.42 0.00 0.00 57.16 56.87 1a8y n GLU 133 Cb 0.00 -1.90 0.28 0.00 -0.57 0.00 0.00 31.44 29.26 1a8y n GLU 133 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1a8y n ARG 134 N -0.90 1.15 -0.05 3.49 1.74 -1.26 -2.68 116.66 118.15 1a8y n ARG 134 Ca 0.00 -0.79 -0.01 0.00 -0.77 0.00 0.00 57.85 56.28 1a8y n ARG 134 Cb 0.40 -1.48 -0.12 0.00 -1.02 0.00 0.00 32.46 30.24 1a8y n ARG 134 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50 1a8y n GLU 135 N -0.24 1.13 -0.05 5.56 1.02 -0.68 -4.48 120.64 122.90 1a8y n GLU 135 Ca 0.13 -0.06 -0.14 0.00 -0.02 0.00 0.00 57.16 57.07 1a8y n GLU 135 Cb 0.40 -1.39 -0.08 0.00 -0.02 0.00 0.00 31.44 30.35 1a8y n GLU 135 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1a8y h LEU 136 N 0.00 0.41 -6.70 -4.62 6.46 -1.67 -2.85 115.31 106.34 1a8y h LEU 136 Ca -0.25 -0.53 -0.77 0.00 -0.12 0.00 0.00 57.88 56.21 1a8y h LEU 136 Cb 1.47 -0.12 -0.19 0.00 -0.73 0.00 0.00 40.66 41.10 1a8y h LEU 136 CO 0.01 0.86 1.64 0.00 -0.62 0.00 0.00 178.44 180.34 1a8y n GLN 137 N -4.50 3.79 0.00 1.25 3.00 -1.09 -1.35 117.38 118.49 1a8y n GLN 137 Ca -0.07 -3.82 0.00 0.00 -0.01 0.00 0.00 57.00 53.11 1a8y n GLN 137 Cb 0.41 -2.83 0.00 0.00 0.00 0.00 0.00 30.24 27.82 1a8y n GLN 137 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1a8y n ALA 138 N 3.41 0.00 0.19 -1.58 0.00 -1.22 -4.86 120.51 116.45 1a8y n ALA 138 Ca 0.36 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.66 1a8y n ALA 138 Cb 0.36 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.73 1a8y n ALA 138 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 1a8y h PHE 139 N 0.00 -0.45 -0.93 0.00 3.57 -1.25 -3.17 116.94 114.72 1a8y h PHE 139 Ca 0.00 -0.01 0.24 0.00 3.53 0.00 0.00 57.97 61.72 1a8y h PHE 139 Cb 0.00 0.15 -0.06 0.00 2.79 0.00 0.00 35.95 38.83 1a8y h PHE 139 CO 0.00 -0.14 0.63 0.93 -2.23 0.00 0.00 178.31 177.50 1a8y h GLU 140 N -0.75 0.26 0.00 1.11 4.39 -1.51 -1.06 114.58 117.02 1a8y h GLU 140 Ca -0.05 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.64 1a8y h GLU 140 Cb 0.51 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.10 1a8y h GLU 140 CO 0.08 0.17 -0.05 -0.91 -1.16 0.00 0.00 179.01 177.14 1a8y h ASN 141 N 0.27 0.00 -2.93 1.42 2.35 -1.82 -3.46 115.58 111.41 1a8y h ASN 141 Ca 0.48 -0.01 -0.53 0.00 -0.55 0.00 0.00 56.30 55.70 1a8y h ASN 141 Cb 1.42 0.00 0.04 0.00 0.05 0.00 0.00 38.32 39.83 1a8y h ASN 141 CO -0.14 0.00 0.81 -0.63 -1.65 0.00 0.00 177.43 175.82 1a8y s ILE 142 N -3.16 2.92 0.00 2.81 1.01 -0.40 -4.85 121.20 119.53 1a8y s ILE 142 Ca 0.08 0.66 0.00 0.00 0.00 0.00 0.00 60.65 61.40 1a8y s ILE 142 Cb 0.09 -3.43 0.00 0.00 0.01 0.00 0.00 42.46 39.13 1a8y s ILE 142 CO 0.64 0.06 0.00 1.21 0.00 0.00 0.00 174.94 176.85 1a8y n GLU 143 N 3.86 2.82 0.00 2.79 2.13 -1.26 -4.87 120.64 126.11 1a8y n GLU 143 Ca 0.12 0.00 0.14 0.00 0.66 0.00 0.00 57.16 58.09 1a8y n GLU 143 Cb 0.40 -0.52 0.68 0.00 0.27 0.00 0.00 31.44 32.27 1a8y n GLU 143 CO 0.00 0.00 0.00 -0.40 -0.41 0.00 0.00 177.13 176.32 1a8y n ASP 144 N -0.32 0.34 -4.32 4.31 5.68 -1.26 -0.05 116.55 120.92 1a8y n ASP 144 Ca 0.00 -0.54 -0.17 0.00 -0.50 0.00 0.00 54.79 53.58 1a8y n ASP 144 Cb 0.01 -0.11 -0.10 0.00 -1.14 0.00 0.00 41.12 39.78 1a8y n ASP 144 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 1a8y s GLU 145 N -2.43 1.26 0.30 0.11 2.56 -1.26 -4.51 118.70 114.72 1a8y s GLU 145 Ca 0.31 -1.56 -0.29 0.00 0.00 0.00 0.00 54.97 53.43 1a8y s GLU 145 Cb 0.20 -0.95 -0.10 0.00 2.00 0.00 0.00 34.13 35.28 1a8y s GLU 145 CO 0.46 0.13 1.44 0.42 -0.56 0.00 0.00 175.26 177.15 1a8y s ILE 146 N -3.10 2.46 0.01 -3.70 1.01 -1.26 -3.88 121.20 112.73 1a8y s ILE 146 Ca 0.21 0.41 0.00 0.00 0.00 0.00 0.00 60.65 61.28 1a8y s ILE 146 Cb 0.01 -3.26 -0.01 0.00 0.01 0.00 0.00 42.46 39.21 1a8y s ILE 146 CO 0.05 0.08 -0.02 -1.59 0.00 0.00 0.00 174.94 173.46 1a8y s LYS 147 N -1.05 0.15 0.10 2.79 -2.85 -0.74 -4.08 119.74 114.06 1a8y s LYS 147 Ca 0.56 -0.19 0.08 0.00 -1.00 0.00 0.00 55.97 55.43 1a8y s LYS 147 Cb -0.43 -0.05 -0.04 0.00 -2.06 0.00 0.00 37.83 35.25 1a8y s LYS 147 CO 0.50 0.01 -0.17 -0.51 0.10 0.00 0.00 175.35 175.28 1a8y s LEU 148 N -0.39 2.73 -0.00 2.77 1.02 0.59 -1.00 118.68 124.40 1a8y s LEU 148 Ca -0.03 -0.51 0.02 0.00 0.02 0.00 0.00 54.13 53.62 1a8y s LEU 148 Cb -0.03 -1.58 -0.01 0.00 0.02 0.00 0.00 46.19 44.60 1a8y s LEU 148 CO -0.00 0.19 -0.07 -0.51 0.02 0.00 0.00 176.35 175.98 1a8y s ILE 149 N -1.12 0.52 0.10 -0.59 1.10 -0.45 -0.19 121.20 120.57 1a8y s ILE 149 Ca 0.18 -0.33 0.02 0.00 -0.51 0.00 0.00 60.65 60.01 1a8y s ILE 149 Cb -0.11 -0.45 -0.04 0.00 0.15 0.00 0.00 42.46 42.01 1a8y s ILE 149 CO 0.10 0.11 -0.08 -0.83 -2.11 0.00 0.00 174.94 172.14 1a8y s GLY 150 N -0.24 0.81 -0.08 1.50 0.00 0.18 -1.15 107.32 108.33 1a8y s GLY 150 Ca 0.02 -1.32 0.02 0.00 0.00 0.00 0.00 44.72 43.44 1a8y s GLY 150 CO -0.00 -1.41 -0.13 -0.47 0.00 0.00 0.00 173.10 171.09 1a8y s TYR 151 N -3.29 1.56 0.38 1.90 5.04 -1.14 -1.68 117.35 120.12 1a8y s TYR 151 Ca 0.10 -0.62 0.04 0.00 -2.44 0.00 0.00 57.07 54.16 1a8y s TYR 151 Cb 0.03 -1.15 -0.02 0.00 0.35 0.00 0.00 41.96 41.18 1a8y s TYR 151 CO -0.03 -0.33 0.15 1.19 -1.34 0.00 0.00 175.55 175.20 1a8y n PHE 152 N 3.96 0.04 0.06 4.97 3.72 -0.75 0.03 117.46 129.49 1a8y n PHE 152 Ca -0.21 -2.52 -0.11 0.00 -0.05 0.00 0.00 57.45 54.55 1a8y n PHE 152 Cb 0.52 0.02 -0.08 0.00 -0.94 0.00 0.00 39.48 39.00 1a8y n PHE 152 CO 0.00 0.00 0.00 -0.22 -0.05 0.00 0.00 176.76 176.49 1a8y h LYS 153 N 0.00 -0.23 0.00 -1.08 3.64 -1.89 -3.40 116.57 113.61 1a8y h LYS 153 Ca -0.30 0.02 0.09 0.00 -1.27 0.00 0.00 60.65 59.19 1a8y h LYS 153 Cb 1.16 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 33.02 1a8y h LYS 153 CO 0.47 0.19 0.36 0.27 -2.27 0.00 0.00 179.45 178.46 1a8y n ASN 154 N -4.94 -1.14 0.14 4.20 0.23 -1.26 -4.86 115.26 107.63 1a8y n ASN 154 Ca -0.08 -1.62 0.09 0.00 -0.53 0.00 0.00 54.58 52.44 1a8y n ASN 154 Cb 0.26 1.86 0.46 0.00 -2.08 0.00 0.00 39.78 40.27 1a8y n ASN 154 CO 0.00 0.00 0.00 2.29 -0.93 0.00 0.00 177.26 178.62 1a8y n LYS 155 N -0.45 0.11 0.04 -3.83 2.85 -1.26 -2.24 118.16 113.37 1a8y n LYS 155 Ca -0.02 0.60 0.07 0.00 -1.05 0.00 0.00 58.31 57.91 1a8y n LYS 155 Cb 0.37 -1.91 -0.08 0.00 -0.65 0.00 0.00 35.03 32.76 1a8y n LYS 155 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 1a8y n ASP 156 N -2.09 0.57 -4.72 -5.58 8.00 -1.26 -4.72 116.55 106.75 1a8y n ASP 156 Ca -0.01 0.23 -0.60 0.00 0.71 0.00 0.00 54.79 55.12 1a8y n ASP 156 Cb 0.08 0.81 -0.08 0.00 -0.02 0.00 0.00 41.12 41.91 1a8y n ASP 156 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1a8y n SER 157 N -2.63 2.01 -0.19 -2.24 2.88 -0.95 -4.86 113.62 107.64 1a8y n SER 157 Ca -0.06 1.11 0.30 0.00 -1.33 0.00 0.00 58.87 58.89 1a8y n SER 157 Cb 0.68 -1.07 0.69 0.00 -0.75 0.00 0.00 64.21 63.76 1a8y n SER 157 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1a8y h GLU 158 N 6.47 0.00 0.00 -1.46 4.57 -1.92 -0.59 114.58 121.65 1a8y h GLU 158 Ca -0.46 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 57.58 1a8y h GLU 158 Cb 1.33 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.90 1a8y h GLU 158 CO 0.96 0.00 -1.11 0.45 -1.18 0.00 0.00 179.01 178.13 1a8y h HIS 159 N 0.00 0.00 -0.10 0.92 3.86 -1.90 -2.94 115.15 114.99 1a8y h HIS 159 Ca 0.46 0.00 -0.20 0.00 -1.16 0.00 0.00 60.37 59.47 1a8y h HIS 159 Cb 2.12 0.00 0.01 0.00 1.06 0.00 0.00 27.41 30.60 1a8y h HIS 159 CO 0.00 0.51 -0.72 -0.92 0.86 0.00 0.00 177.93 177.67 1a8y h TYR 160 N 0.00 0.91 -0.17 2.45 3.20 -1.45 -1.51 116.97 120.41 1a8y h TYR 160 Ca -0.10 -0.43 -0.02 0.00 3.14 0.00 0.00 58.73 61.32 1a8y h TYR 160 Cb 1.48 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 39.61 1a8y h TYR 160 CO 0.00 1.24 -0.00 0.87 -1.64 0.00 0.00 178.16 178.63 1a8y h LYS 161 N 0.32 0.24 -0.04 1.82 1.57 -1.54 0.12 116.57 119.06 1a8y h LYS 161 Ca -0.06 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.68 1a8y h LYS 161 Cb 1.36 -0.04 -0.00 0.00 0.08 0.00 0.00 32.23 33.63 1a8y h LYS 161 CO 0.15 0.27 0.00 0.00 -0.57 0.00 0.00 179.45 179.30 1a8y h ALA 162 N 1.77 0.05 -0.22 3.86 0.00 -1.39 -2.27 119.26 121.06 1a8y h ALA 162 Ca 0.06 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.84 1a8y h ALA 162 Cb 0.17 -0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 1a8y h ALA 162 CO 0.00 -0.29 0.06 0.35 0.00 0.00 0.00 179.25 179.37 1a8y h PHE 163 N -0.20 0.11 -0.16 0.00 3.57 -0.33 -2.30 116.94 117.62 1a8y h PHE 163 Ca 0.01 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.51 1a8y h PHE 163 Cb 0.30 -0.02 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1a8y h PHE 163 CO 0.02 0.05 0.02 -0.22 -2.23 0.00 0.00 178.31 175.94 1a8y h LYS 164 N 0.16 0.23 0.00 1.11 3.64 -0.83 0.21 116.57 121.08 1a8y h LYS 164 Ca 0.10 -0.03 -0.10 0.00 -1.27 0.00 0.00 60.65 59.35 1a8y h LYS 164 Cb 0.08 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.84 1a8y h LYS 164 CO -0.11 0.24 -0.46 0.93 -2.27 0.00 0.00 179.45 177.77 1a8y h GLU 165 N 0.23 0.00 -0.03 1.90 5.08 -0.91 -2.71 114.58 118.14 1a8y h GLU 165 Ca 0.06 0.00 -0.23 0.00 -1.00 0.00 0.00 59.36 58.18 1a8y h GLU 165 Cb 0.13 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.39 1a8y h GLU 165 CO 0.00 0.46 -0.92 0.00 -1.00 0.00 0.00 179.01 177.55 1a8y h ALA 166 N 1.54 0.31 -0.19 3.43 0.00 -0.81 -3.25 119.26 120.30 1a8y h ALA 166 Ca -0.00 -0.68 -0.04 0.00 0.00 0.00 0.00 54.91 54.19 1a8y h ALA 166 Cb 1.21 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1a8y h ALA 166 CO 0.06 0.75 -0.06 0.00 0.00 0.00 0.00 179.25 180.00 1a8y h ALA 167 N 0.64 1.55 -0.37 0.00 0.00 -0.89 -2.69 119.26 117.50 1a8y h ALA 167 Ca -0.08 -0.17 -0.09 0.00 0.00 0.00 0.00 54.91 54.57 1a8y h ALA 167 Cb 1.56 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 1a8y h ALA 167 CO 0.17 0.32 -0.13 0.93 0.00 0.00 0.00 179.25 180.55 1a8y h GLU 168 N 0.28 0.65 0.00 0.00 5.08 -1.52 0.14 114.58 119.20 1a8y h GLU 168 Ca 0.06 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.15 1a8y h GLU 168 Cb 0.29 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 1a8y h GLU 168 CO 0.01 0.76 -0.29 1.49 -1.00 0.00 0.00 179.01 179.98 1a8y h GLU 169 N 0.59 0.00 -0.02 2.33 4.57 -1.51 -3.11 114.58 117.44 1a8y h GLU 169 Ca 0.10 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1a8y h GLU 169 Cb 0.56 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.15 1a8y h GLU 169 CO 0.04 0.29 -0.24 1.19 -1.18 0.00 0.00 179.01 179.11 1a8y n PHE 170 N -3.69 0.00 -2.29 0.92 3.72 -1.06 -4.99 117.46 110.07 1a8y n PHE 170 Ca -0.01 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.97 1a8y n PHE 170 Cb 0.40 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.91 1a8y n PHE 170 CO 0.00 0.00 0.00 -1.58 -0.05 0.00 0.00 176.76 175.13 1a8y s HIS 171 N -1.83 3.32 -2.66 1.38 2.46 0.01 -0.78 115.29 117.20 1a8y s HIS 171 Ca 0.17 1.11 0.24 0.00 0.47 0.00 0.00 55.06 57.05 1a8y s HIS 171 Cb 0.14 -3.56 0.48 0.00 -0.13 0.00 0.00 32.58 29.52 1a8y s HIS 171 CO 0.36 -1.87 1.43 -0.35 -2.47 0.00 0.00 174.74 171.84 1a8y n PRO 172 N 3.99 2.19 0.05 2.88 -0.04 -1.26 -4.94 135.00 137.87 1a8y n PRO 172 Ca 0.10 -1.76 -0.06 0.00 -0.04 0.00 0.00 63.50 61.75 1a8y n PRO 172 Cb 0.44 -1.47 0.13 0.00 -0.04 0.00 0.00 33.50 32.56 1a8y n PRO 172 CO 0.00 0.00 0.00 1.88 -0.04 0.00 0.00 175.50 177.34 1a8y h TYR 173 N 3.89 0.45 -3.15 0.54 0.05 -1.35 -3.42 116.97 113.97 1a8y h TYR 173 Ca 0.00 -0.15 -0.67 0.00 0.05 0.00 0.00 58.73 57.96 1a8y h TYR 173 Cb 0.84 -0.09 -0.34 0.00 1.01 0.00 0.00 36.73 38.15 1a8y h TYR 173 CO 0.09 0.80 -0.86 0.42 -1.05 0.00 0.00 178.16 177.56 1a8y s ILE 174 N -3.99 2.10 -0.05 -2.88 1.01 -0.68 -4.96 121.20 111.76 1a8y s ILE 174 Ca -0.05 -0.95 -0.30 0.00 0.00 0.00 0.00 60.65 59.35 1a8y s ILE 174 Cb 0.12 -1.86 -0.05 0.00 0.01 0.00 0.00 42.46 40.69 1a8y s ILE 174 CO 0.81 0.54 1.46 -2.16 0.00 0.00 0.00 174.94 175.59 1a8y s PRO 175 N 1.00 4.24 -0.21 2.79 0.04 -1.26 -4.54 135.00 137.06 1a8y s PRO 175 Ca -0.02 1.98 -0.04 0.00 0.04 0.00 0.00 61.00 62.97 1a8y s PRO 175 Cb -0.15 -3.75 -0.01 0.00 0.04 0.00 0.00 34.50 30.64 1a8y s PRO 175 CO -0.06 -0.69 -0.05 -0.06 0.04 0.00 0.00 177.00 176.18 1a8y s PHE 176 N 3.16 2.95 0.14 0.56 0.40 -1.26 -0.30 117.98 123.64 1a8y s PHE 176 Ca 0.65 -0.86 0.11 0.00 -0.60 0.00 0.00 56.93 56.23 1a8y s PHE 176 Cb -0.30 -2.08 -0.04 0.00 0.51 0.00 0.00 43.02 41.11 1a8y s PHE 176 CO 0.25 -0.48 -0.26 -0.06 0.70 0.00 0.00 175.22 175.37 1a8y s PHE 177 N 1.31 2.32 0.04 0.36 0.40 0.73 -2.22 117.98 120.94 1a8y s PHE 177 Ca 0.04 -0.37 0.02 0.00 -0.60 0.00 0.00 56.93 56.02 1a8y s PHE 177 Cb -0.14 -1.23 -0.02 0.00 0.51 0.00 0.00 43.02 42.13 1a8y s PHE 177 CO -0.02 0.38 -0.07 0.00 0.70 0.00 0.00 175.22 176.21 1a8y s ALA 178 N -1.21 0.51 0.02 5.36 0.00 -1.11 0.47 121.76 125.80 1a8y s ALA 178 Ca 0.16 -0.77 0.01 0.00 0.00 0.00 0.00 51.96 51.36 1a8y s ALA 178 Cb -0.10 0.07 -0.01 0.00 0.00 0.00 0.00 23.12 23.08 1a8y s ALA 178 CO 0.07 -0.06 -0.04 -0.08 0.00 0.00 0.00 175.76 175.65 1a8y s THR 179 N -1.53 0.28 -0.48 0.00 -1.32 -0.67 -0.32 115.64 111.60 1a8y s THR 179 Ca -0.10 -0.61 0.04 0.00 -1.21 0.00 0.00 61.69 59.82 1a8y s THR 179 Cb -0.09 -0.32 0.02 0.00 -1.51 0.00 0.00 72.50 70.59 1a8y s THR 179 CO -0.00 -0.22 0.52 0.49 -2.21 0.00 0.00 174.62 173.20 1a8y n PHE 180 N 2.18 0.00 -3.16 9.09 3.72 -1.26 -1.80 117.46 126.23 1a8y n PHE 180 Ca -0.19 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 56.82 1a8y n PHE 180 Cb 0.57 0.00 -0.06 0.00 -0.94 0.00 0.00 39.48 39.05 1a8y n PHE 180 CO 0.00 0.00 0.00 0.34 -0.05 0.00 0.00 176.76 177.05 1a8y s ASP 181 N -0.65 6.74 0.46 4.37 2.15 -1.26 -4.88 116.67 123.59 1a8y s ASP 181 Ca 0.04 0.89 0.29 0.00 0.43 0.00 0.00 52.55 54.20 1a8y s ASP 181 Cb 0.04 -2.34 0.99 0.00 -0.30 0.00 0.00 42.92 41.31 1a8y s ASP 181 CO 0.09 -0.18 1.83 0.77 -0.17 0.00 0.00 175.17 177.51 1a8y h SER 182 N 7.17 0.00 -0.47 -0.34 4.64 -1.94 -2.43 113.55 120.19 1a8y h SER 182 Ca -0.36 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 60.83 1a8y h SER 182 Cb 1.16 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.24 1a8y h SER 182 CO 0.76 0.00 -0.22 0.11 -0.87 0.00 0.00 176.83 176.61 1a8y h LYS 183 N 0.00 0.99 -0.16 4.77 1.57 -1.99 0.29 116.57 122.04 1a8y h LYS 183 Ca 0.00 -0.43 -0.19 0.00 -1.87 0.00 0.00 60.65 58.16 1a8y h LYS 183 Cb 0.65 -0.03 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1a8y h LYS 183 CO 0.00 1.10 -0.68 0.28 -0.57 0.00 0.00 179.45 179.58 1a8y h VAL 184 N 0.85 1.31 -0.47 0.50 2.07 -1.93 -2.48 116.25 116.09 1a8y h VAL 184 Ca 0.11 -1.94 -0.08 0.00 0.82 0.00 0.00 66.70 65.61 1a8y h VAL 184 Cb 0.80 1.92 -0.02 0.00 -1.52 0.00 0.00 31.29 32.47 1a8y h VAL 184 CO 0.07 0.61 -0.02 0.00 0.02 0.00 0.00 177.57 178.25 1a8y h ALA 185 N 0.76 1.08 -0.41 1.67 0.00 -1.32 0.25 119.26 121.29 1a8y h ALA 185 Ca -0.02 -0.27 -0.03 0.00 0.00 0.00 0.00 54.91 54.59 1a8y h ALA 185 Cb 1.28 -0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.86 1a8y h ALA 185 CO 0.13 0.58 0.15 0.87 0.00 0.00 0.00 179.25 180.98 1a8y h LYS 186 N 0.74 0.62 -0.55 0.00 1.79 -0.93 -0.35 116.57 117.89 1a8y h LYS 186 Ca 0.14 -0.12 -0.01 0.00 -2.18 0.00 0.00 60.65 58.48 1a8y h LYS 186 Cb 0.48 -0.10 -0.03 0.00 -1.58 0.00 0.00 32.23 31.00 1a8y h LYS 186 CO 0.02 0.60 0.31 0.87 -1.08 0.00 0.00 179.45 180.17 1a8y h LYS 187 N 0.52 0.75 -0.00 3.15 1.79 -0.95 -3.11 116.57 118.72 1a8y h LYS 187 Ca 0.13 -0.08 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 1a8y h LYS 187 Cb 0.22 -0.15 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1a8y h LYS 187 CO -0.01 0.57 -0.09 1.28 -1.08 0.00 0.00 179.45 180.11 1a8y n LEU 188 N -4.63 0.37 0.00 2.94 4.32 0.83 -4.97 117.00 115.86 1a8y n LEU 188 Ca 0.03 0.07 0.00 0.00 -0.02 0.00 0.00 56.01 56.09 1a8y n LEU 188 Cb 0.07 -0.21 0.00 0.00 -1.62 0.00 0.00 43.42 41.67 1a8y n LEU 188 CO 0.36 0.07 0.00 0.41 -1.22 0.00 0.00 177.39 177.01 1a8y n THR 189 N -1.03 0.00 0.00 -5.08 -1.04 -0.16 -5.03 114.28 101.93 1a8y n THR 189 Ca 0.14 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.15 1a8y n THR 189 Cb 0.27 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.78 1a8y n THR 189 CO 0.00 0.00 0.00 0.18 -0.64 0.00 0.00 175.07 174.61 1a8y n LEU 190 N 0.00 0.00 -5.02 -4.42 4.32 -1.13 -4.65 117.00 106.10 1a8y n LEU 190 Ca 0.00 0.00 -0.19 0.00 -0.02 0.00 0.00 56.01 55.80 1a8y n LEU 190 Cb 0.00 0.00 0.04 0.00 -1.62 0.00 0.00 43.42 41.84 1a8y n LEU 190 CO 0.00 0.00 0.29 -0.54 -1.22 0.00 0.00 177.39 175.92 1a8y s LYS 191 N 0.00 2.47 0.11 3.23 1.02 -1.26 -4.60 119.74 120.70 1a8y s LYS 191 Ca 0.00 -1.43 -0.31 0.00 0.02 0.00 0.00 55.97 54.25 1a8y s LYS 191 Cb 0.00 -2.66 -0.09 0.00 -0.52 0.00 0.00 37.83 34.55 1a8y s LYS 191 CO 0.00 -0.68 1.72 -0.51 -0.92 0.00 0.00 175.35 174.96 1a8y s LEU 192 N -4.58 4.38 -0.95 3.17 1.43 -1.26 -1.89 118.68 118.98 1a8y s LEU 192 Ca 0.59 2.63 -0.01 0.00 -1.03 0.00 0.00 54.13 56.31 1a8y s LEU 192 Cb -0.07 -3.57 0.00 0.00 0.03 0.00 0.00 46.19 42.58 1a8y s LEU 192 CO 0.37 -0.93 0.10 0.59 0.23 0.00 0.00 176.35 176.71 1a8y n ASN 193 N 5.36 -3.81 -4.78 2.29 4.13 0.10 -4.94 115.26 113.62 1a8y n ASN 193 Ca 0.16 -0.05 -0.37 0.00 1.68 0.00 0.00 54.58 56.00 1a8y n ASN 193 Cb 0.39 -2.94 -0.06 0.00 -1.54 0.00 0.00 39.78 35.63 1a8y n ASN 193 CO 0.00 0.00 0.00 -0.70 0.28 0.00 0.00 177.26 176.84 1a8y s GLU 194 N -4.74 4.07 -0.26 3.52 2.12 -0.79 -4.54 118.70 118.09 1a8y s GLU 194 Ca 0.05 0.24 -0.03 0.00 0.36 0.00 0.00 54.97 55.59 1a8y s GLU 194 Cb -0.02 -3.33 0.02 0.00 0.26 0.00 0.00 34.13 31.05 1a8y s GLU 194 CO 0.06 0.43 -0.03 0.42 -0.54 0.00 0.00 175.26 175.60 1a8y s ILE 195 N -0.18 3.14 -0.08 -3.70 1.01 -1.26 -2.88 121.20 117.24 1a8y s ILE 195 Ca 0.20 -0.91 -0.15 0.00 0.00 0.00 0.00 60.65 59.79 1a8y s ILE 195 Cb -0.14 -2.59 -0.05 0.00 0.01 0.00 0.00 42.46 39.69 1a8y s ILE 195 CO 0.08 0.19 0.39 -1.81 0.00 0.00 0.00 174.94 173.80 1a8y s ASP 196 N 1.37 6.66 -0.21 3.58 1.01 -0.30 -0.88 116.67 127.90 1a8y s ASP 196 Ca 0.01 0.78 -0.09 0.00 0.71 0.00 0.00 52.55 53.97 1a8y s ASP 196 Cb -0.17 -2.24 -0.04 0.00 1.01 0.00 0.00 42.92 41.48 1a8y s ASP 196 CO -0.03 0.17 0.10 0.12 0.21 0.00 0.00 175.17 175.74 1a8y s PHE 197 N -0.14 3.26 -0.20 4.23 2.19 0.51 -1.35 117.98 126.49 1a8y s PHE 197 Ca 0.22 0.07 -0.03 0.00 0.33 0.00 0.00 56.93 57.53 1a8y s PHE 197 Cb -0.15 -2.16 -0.01 0.00 -1.31 0.00 0.00 43.02 39.39 1a8y s PHE 197 CO 0.10 0.07 -0.06 0.71 1.83 0.00 0.00 175.22 177.86 1a8y s TYR 198 N 0.75 2.93 0.62 10.12 1.51 -0.17 -0.97 117.35 132.15 1a8y s TYR 198 Ca 0.05 -0.89 -0.16 0.00 -1.01 0.00 0.00 57.07 55.06 1a8y s TYR 198 Cb -0.13 -2.05 -0.02 0.00 -0.11 0.00 0.00 41.96 39.65 1a8y s TYR 198 CO 0.02 -0.48 1.10 -2.00 -1.11 0.00 0.00 175.55 173.07 1a8y s GLU 199 N 1.23 3.03 0.26 -0.62 2.12 -1.26 -1.79 118.70 121.67 1a8y s GLU 199 Ca 0.03 1.36 -0.31 0.00 0.36 0.00 0.00 54.97 56.41 1a8y s GLU 199 Cb -0.14 -1.98 -0.11 0.00 0.26 0.00 0.00 34.13 32.15 1a8y s GLU 199 CO -0.02 -1.06 1.63 0.00 -0.54 0.00 0.00 175.26 175.27 1a8y s ALA 200 N -2.30 3.80 -1.03 6.30 0.00 -1.25 -2.10 121.76 125.19 1a8y s ALA 200 Ca 0.67 1.57 0.00 0.00 0.00 0.00 0.00 51.96 54.20 1a8y s ALA 200 Cb -0.20 -3.66 0.00 0.00 0.00 0.00 0.00 23.12 19.26 1a8y s ALA 200 CO 0.38 -0.96 0.00 1.19 0.00 0.00 0.00 175.76 176.37 1a8y n PHE 201 N 2.77 0.00 -4.14 0.00 3.72 0.92 -4.55 117.46 116.17 1a8y n PHE 201 Ca 0.11 0.00 -0.32 0.00 -0.05 0.00 0.00 57.45 57.19 1a8y n PHE 201 Cb 0.37 -2.62 -0.07 0.00 -0.94 0.00 0.00 39.48 36.22 1a8y n PHE 201 CO 0.00 0.00 0.00 -1.64 -0.05 0.00 0.00 176.76 175.07 1a8y s MET 202 N -2.78 2.89 -0.00 -1.08 -1.94 -0.89 -4.93 119.30 110.57 1a8y s MET 202 Ca 0.00 -0.61 0.16 0.00 -1.71 0.00 0.00 55.69 53.54 1a8y s MET 202 Cb 0.00 -2.74 -0.18 0.00 2.01 0.00 0.00 34.83 33.92 1a8y s MET 202 CO 0.00 0.61 0.67 0.39 -0.01 0.00 0.00 175.02 176.68 1a8y n GLU 203 N 1.01 0.63 -3.39 2.03 1.02 -1.26 -4.61 120.64 116.08 1a8y n GLU 203 Ca -0.12 0.19 -0.38 0.00 -0.02 0.00 0.00 57.16 56.82 1a8y n GLU 203 Cb 0.52 -1.75 -0.08 0.00 -0.02 0.00 0.00 31.44 30.11 1a8y n GLU 203 CO 0.00 0.00 0.00 -2.00 1.18 0.00 0.00 177.13 176.31 1a8y s GLU 204 N -2.83 4.14 0.03 3.49 2.12 -1.26 -5.09 118.70 119.30 1a8y s GLU 204 Ca -0.05 0.16 -0.15 0.00 0.36 0.00 0.00 54.97 55.30 1a8y s GLU 204 Cb 0.08 -3.56 -0.06 0.00 0.26 0.00 0.00 34.13 30.85 1a8y s GLU 204 CO 0.82 -0.09 0.44 -1.25 -0.54 0.00 0.00 175.26 174.64 1a8y s PRO 205 N 1.49 3.94 0.01 4.30 0.04 -1.26 -4.50 135.00 139.01 1a8y s PRO 205 Ca 0.18 0.43 -0.19 0.00 0.04 0.00 0.00 61.00 61.46 1a8y s PRO 205 Cb -0.15 -3.17 -0.06 0.00 0.04 0.00 0.00 34.50 31.16 1a8y s PRO 205 CO 0.08 0.65 0.54 0.08 0.04 0.00 0.00 177.00 178.40 1a8y s VAL 206 N -1.15 4.90 -0.12 -0.36 1.01 -0.14 -4.87 120.40 119.67 1a8y s VAL 206 Ca 0.27 1.13 -0.05 0.00 0.00 0.00 0.00 61.98 63.33 1a8y s VAL 206 Cb -0.17 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.31 1a8y s VAL 206 CO 0.15 0.48 0.08 0.28 0.00 0.00 0.00 175.10 176.09 1a8y s THR 207 N -0.55 5.01 0.00 3.92 -1.32 -1.26 -0.36 115.64 121.08 1a8y s THR 207 Ca 0.28 0.03 -0.30 0.00 -1.21 0.00 0.00 61.69 60.49 1a8y s THR 207 Cb -0.18 -3.18 -0.07 0.00 -1.51 0.00 0.00 72.50 67.57 1a8y s THR 207 CO 0.16 0.59 1.66 -0.63 -2.21 0.00 0.00 174.62 174.19 1a8y s ILE 208 N -0.75 3.35 0.01 5.08 1.01 -0.06 -4.96 121.20 124.88 1a8y s ILE 208 Ca 0.13 0.61 -0.05 0.00 0.00 0.00 0.00 60.65 61.34 1a8y s ILE 208 Cb -0.12 -3.39 -0.02 0.00 0.01 0.00 0.00 42.46 38.94 1a8y s ILE 208 CO 0.03 -0.03 1.07 -0.65 0.00 0.00 0.00 174.94 175.36 1a8y h PRO 209 N 9.02 -0.13 -3.43 2.79 0.11 -1.96 -3.40 132.00 135.00 1a8y h PRO 209 Ca -0.41 0.01 -0.80 0.00 0.11 0.00 0.00 66.00 64.91 1a8y h PRO 209 Cb 1.19 0.03 -0.28 0.00 0.11 0.00 0.00 31.00 32.05 1a8y h PRO 209 CO 0.94 -0.09 0.55 -0.25 -0.21 0.00 0.00 178.00 178.94 1a8y n ASP 210 N -2.64 5.73 -4.66 -2.05 8.00 -1.26 -4.96 116.55 114.71 1a8y n ASP 210 Ca -0.02 -3.12 -0.47 0.00 0.71 0.00 0.00 54.79 51.89 1a8y n ASP 210 Cb 0.06 -1.36 -0.04 0.00 -0.02 0.00 0.00 41.12 39.76 1a8y n ASP 210 CO 0.00 0.00 0.00 1.17 -0.39 0.00 0.00 177.20 177.98 1a8y n LYS 211 N 2.41 2.05 -3.00 -1.24 4.81 -1.26 -3.82 118.16 118.11 1a8y n LYS 211 Ca 0.25 0.74 -0.40 0.00 -0.87 0.00 0.00 58.31 58.03 1a8y n LYS 211 Cb 0.38 -2.51 -0.05 0.00 0.02 0.00 0.00 35.03 32.86 1a8y n LYS 211 CO 0.00 0.00 0.00 -2.14 1.17 0.00 0.00 177.40 176.43 1a8y s PRO 212 N 1.46 4.51 0.12 1.64 0.02 -1.26 -5.13 135.00 136.36 1a8y s PRO 212 Ca 0.82 1.08 -0.30 0.00 0.02 0.00 0.00 61.00 62.62 1a8y s PRO 212 Cb -0.71 -3.32 -0.06 0.00 0.02 0.00 0.00 34.50 30.42 1a8y s PRO 212 CO 0.41 0.41 1.10 -0.80 -0.33 0.00 0.00 177.00 177.79 1a8y s ASN 213 N -0.52 7.26 0.49 2.53 0.01 -1.25 -5.05 114.94 118.41 1a8y s ASN 213 Ca 0.37 2.00 -0.06 0.00 -0.71 0.00 0.00 52.86 54.46 1a8y s ASN 213 Cb -0.21 -2.59 -0.04 0.00 0.41 0.00 0.00 41.25 38.82 1a8y s ASN 213 CO 0.24 -0.27 0.80 -0.94 -1.51 0.00 0.00 177.10 175.42 1a8y s SER 214 N 0.30 6.26 0.19 -1.22 1.04 -1.26 -4.78 113.70 114.23 1a8y s SER 214 Ca 0.52 0.96 -0.17 0.00 0.48 0.00 0.00 55.95 57.74 1a8y s SER 214 Cb -0.28 -2.26 0.17 0.00 0.10 0.00 0.00 66.02 63.75 1a8y s SER 214 CO 0.32 -0.60 1.61 -0.08 0.98 0.00 0.00 173.24 175.48 1a8y h GLU 215 N 0.20 -0.09 -0.65 4.02 4.81 -1.95 -0.34 114.58 120.58 1a8y h GLU 215 Ca -0.47 0.01 0.01 0.00 -0.13 0.00 0.00 59.36 58.78 1a8y h GLU 215 Cb 1.20 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.57 1a8y h GLU 215 CO 0.62 -0.06 0.43 0.93 -0.73 0.00 0.00 179.01 180.19 1a8y h GLU 216 N -0.10 0.83 -0.18 1.92 3.07 -1.95 0.25 114.58 118.42 1a8y h GLU 216 Ca 0.26 -0.05 -0.05 0.00 -0.50 0.00 0.00 59.36 59.01 1a8y h GLU 216 Cb 0.50 -0.19 -0.00 0.00 -0.84 0.00 0.00 28.75 28.22 1a8y h GLU 216 CO -0.63 0.55 -0.09 0.93 -1.40 0.00 0.00 179.01 178.36 1a8y h GLU 217 N 0.85 0.39 -0.54 2.33 5.08 -1.57 0.19 114.58 121.30 1a8y h GLU 217 Ca 0.24 -0.17 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1a8y h GLU 217 Cb -0.06 -0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.15 1a8y h GLU 217 CO -0.06 0.69 0.08 0.82 -1.00 0.00 0.00 179.01 179.54 1a8y h ILE 218 N 0.07 1.26 -0.27 3.13 2.04 -0.11 -2.08 117.51 121.54 1a8y h ILE 218 Ca 0.04 -0.98 -0.14 0.00 1.00 0.00 0.00 64.86 64.78 1a8y h ILE 218 Cb 0.58 0.83 -0.01 0.00 -0.74 0.00 0.00 36.82 37.48 1a8y h ILE 218 CO 0.03 0.35 -0.41 0.58 0.00 0.00 0.00 178.15 178.70 1a8y h VAL 219 N 0.80 1.29 -0.92 1.67 2.07 -0.46 -2.51 116.25 118.18 1a8y h VAL 219 Ca 0.16 -1.59 0.01 0.00 0.82 0.00 0.00 66.70 66.10 1a8y h VAL 219 Cb 0.43 1.53 -0.05 0.00 -1.52 0.00 0.00 31.29 31.68 1a8y h VAL 219 CO 0.01 0.51 0.61 0.78 0.02 0.00 0.00 177.57 179.50 1a8y h ASN 220 N 0.54 1.05 0.19 0.57 -0.26 -0.41 -2.71 115.58 114.55 1a8y h ASN 220 Ca 0.04 -0.03 -0.01 0.00 -0.56 0.00 0.00 56.30 55.75 1a8y h ASN 220 Cb 0.94 -0.26 0.00 0.00 -1.06 0.00 0.00 38.32 37.95 1a8y h ASN 220 CO 0.09 0.76 -0.09 0.15 -1.06 0.00 0.00 177.43 177.27 1a8y h PHE 221 N 1.24 -0.24 -0.56 1.19 3.57 -1.17 -1.75 116.94 119.22 1a8y h PHE 221 Ca 0.34 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.75 1a8y h PHE 221 Cb -0.13 0.08 -0.02 0.00 2.79 0.00 0.00 35.95 38.67 1a8y h PHE 221 CO -0.00 -0.13 0.02 0.28 -2.23 0.00 0.00 178.31 176.25 1a8y h VAL 222 N -0.28 1.26 -0.60 1.41 2.07 -1.35 -0.13 116.25 118.63 1a8y h VAL 222 Ca -0.03 -1.10 -0.08 0.00 0.82 0.00 0.00 66.70 66.32 1a8y h VAL 222 Cb 0.22 0.86 -0.02 0.00 -1.52 0.00 0.00 31.29 30.83 1a8y h VAL 222 CO 0.04 0.39 0.06 -0.33 0.02 0.00 0.00 177.57 177.75 1a8y h GLU 223 N 0.86 1.01 0.00 1.57 4.39 -1.50 -1.50 114.58 119.41 1a8y h GLU 223 Ca 0.16 -0.28 -0.04 0.00 0.34 0.00 0.00 59.36 59.54 1a8y h GLU 223 Cb 0.52 -0.11 -0.01 0.00 -0.10 0.00 0.00 28.75 29.05 1a8y h GLU 223 CO 0.03 0.95 -0.20 1.49 -1.16 0.00 0.00 179.01 180.12 1a8y h GLU 224 N 0.94 0.00 -0.19 2.33 4.81 -1.07 -3.29 114.58 118.11 1a8y h GLU 224 Ca 0.18 0.00 -0.11 0.00 -0.13 0.00 0.00 59.36 59.30 1a8y h GLU 224 Cb 0.46 0.00 -0.07 0.00 0.63 0.00 0.00 28.75 29.77 1a8y h GLU 224 CO 0.02 0.20 -0.38 0.72 -0.73 0.00 0.00 179.01 178.84 1a8y n HIS 225 N -3.85 0.62 -0.10 0.92 8.25 -0.08 -4.82 115.22 116.16 1a8y n HIS 225 Ca -0.02 -1.62 -0.13 0.00 -0.26 0.00 0.00 57.72 55.69 1a8y n HIS 225 Cb 0.30 -0.35 -0.04 0.00 1.12 0.00 0.00 29.99 31.02 1a8y n HIS 225 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1a8y h ARG 226 N 1.11 0.76 -6.43 -0.41 3.08 -1.38 -3.41 114.38 107.70 1a8y h ARG 226 Ca 0.11 -0.41 -0.55 0.00 0.07 0.00 0.00 59.98 59.20 1a8y h ARG 226 Cb 1.26 0.02 -0.06 0.00 0.08 0.00 0.00 29.97 31.26 1a8y h ARG 226 CO 0.21 1.04 1.08 0.50 -1.07 0.00 0.00 179.97 181.72 1a8y s ARG 227 N -4.33 3.32 0.70 0.04 3.52 -1.26 -4.99 118.95 115.94 1a8y s ARG 227 Ca -0.12 0.35 -0.11 0.00 -0.13 0.00 0.00 55.73 55.72 1a8y s ARG 227 Cb 0.09 -4.11 0.01 0.00 -1.56 0.00 0.00 34.95 29.38 1a8y s ARG 227 CO 0.84 -1.92 1.07 -1.12 -0.81 0.00 0.00 175.30 173.36 1a8y s SER 228 N 4.15 5.41 0.05 -2.12 0.01 -1.26 -4.99 113.70 114.94 1a8y s SER 228 Ca 0.49 1.41 -0.19 0.00 1.31 0.00 0.00 55.95 58.97 1a8y s SER 228 Cb -0.10 -2.29 -0.14 0.00 0.21 0.00 0.00 66.02 63.70 1a8y s SER 228 CO 0.24 -1.40 1.32 0.74 0.41 0.00 0.00 173.24 174.55 1a8y h THR 229 N -0.69 1.35 -3.72 1.44 2.02 -1.85 -3.39 112.91 108.07 1a8y h THR 229 Ca -0.45 -1.48 -0.69 0.00 0.77 0.00 0.00 66.41 64.56 1a8y h THR 229 Cb 1.23 1.93 -0.31 0.00 -1.74 0.00 0.00 68.15 69.25 1a8y h THR 229 CO 0.60 0.44 -0.67 -0.22 0.37 0.00 0.00 175.52 176.04 1a8y s LEU 230 N -8.93 3.99 0.34 2.58 0.20 -1.26 -0.55 118.68 115.05 1a8y s LEU 230 Ca -0.14 -1.18 0.08 0.00 0.69 0.00 0.00 54.13 53.58 1a8y s LEU 230 Cb 0.06 -1.77 -0.03 0.00 -0.43 0.00 0.00 46.19 44.02 1a8y s LEU 230 CO 0.78 -0.27 0.27 -0.13 -0.29 0.00 0.00 176.35 176.71 1a8y s ARG 231 N 1.31 2.64 -0.08 1.98 0.52 -0.88 -4.57 118.95 119.87 1a8y s ARG 231 Ca -0.04 -1.36 0.03 0.00 -0.52 0.00 0.00 55.73 53.84 1a8y s ARG 231 Cb -0.19 -2.41 0.01 0.00 0.52 0.00 0.00 34.95 32.88 1a8y s ARG 231 CO 0.00 0.08 -0.18 0.21 0.02 0.00 0.00 175.30 175.43 1a8y s LYS 232 N -3.97 2.39 -0.48 3.54 2.20 -1.26 -1.34 119.74 120.82 1a8y s LYS 232 Ca 0.41 -0.65 -0.28 0.00 -0.36 0.00 0.00 55.97 55.09 1a8y s LYS 232 Cb -0.05 -1.87 -0.01 0.00 -1.51 0.00 0.00 37.83 34.39 1a8y s LYS 232 CO 0.26 0.10 1.70 -1.17 -0.36 0.00 0.00 175.35 175.88 1a8y s LEU 233 N 0.50 3.42 -0.10 5.43 0.20 0.04 -4.91 118.68 123.26 1a8y s LEU 233 Ca -0.17 0.72 -0.04 0.00 0.69 0.00 0.00 54.13 55.33 1a8y s LEU 233 Cb -0.17 -3.09 -0.04 0.00 -0.43 0.00 0.00 46.19 42.46 1a8y s LEU 233 CO 0.06 -1.91 0.07 -0.54 -0.29 0.00 0.00 176.35 173.74 1a8y s LYS 234 N 6.02 3.21 0.45 1.98 1.02 -1.26 -4.73 119.74 126.44 1a8y s LYS 234 Ca 0.68 -0.28 0.12 0.00 0.02 0.00 0.00 55.97 56.51 1a8y s LYS 234 Cb -0.16 -2.99 1.03 0.00 -0.52 0.00 0.00 37.83 35.19 1a8y s LYS 234 CO 0.27 0.73 2.06 -1.35 -0.92 0.00 0.00 175.35 176.15 1a8y h PRO 235 N 5.10 0.21 0.00 -1.68 0.11 -1.93 0.53 132.00 134.34 1a8y h PRO 235 Ca -0.53 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.56 1a8y h PRO 235 Cb 1.21 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 32.28 1a8y h PRO 235 CO 0.56 0.20 0.00 -0.85 -0.21 0.00 0.00 178.00 177.70 1a8y n GLU 236 N -4.45 0.14 0.00 1.05 0.00 -1.26 0.36 120.64 116.48 1a8y n GLU 236 Ca -0.01 0.15 0.00 0.00 0.00 0.00 0.00 57.16 57.30 1a8y n GLU 236 Cb 0.13 -1.67 0.00 0.00 0.00 0.00 0.00 31.44 29.90 1a8y n GLU 236 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.13 177.56 1a8y n SER 237 N -1.91 3.24 -0.46 -1.84 7.64 -0.99 -2.72 113.62 116.58 1a8y n SER 237 Ca 0.06 -0.12 0.35 0.00 1.01 0.00 0.00 58.87 60.17 1a8y n SER 237 Cb 0.36 0.89 0.54 0.00 -1.01 0.00 0.00 64.21 64.99 1a8y n SER 237 CO 0.00 0.00 0.00 1.15 -3.01 0.00 0.00 175.04 173.18 1a8y n MET 238 N -1.21 -0.00 0.05 1.43 0.00 0.18 -0.27 117.12 117.29 1a8y n MET 238 Ca 0.00 0.73 0.01 0.00 0.00 0.00 0.00 57.70 58.44 1a8y n MET 238 Cb 0.00 -1.67 -0.07 0.00 0.00 0.00 0.00 33.22 31.48 1a8y n MET 238 CO 0.00 0.00 0.00 1.88 0.00 0.00 0.00 175.97 177.85 1a8y h TYR 239 N 0.00 0.00 0.21 3.17 0.05 -1.84 -2.77 116.97 115.79 1a8y h TYR 239 Ca 0.63 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 59.40 1a8y h TYR 239 Cb 2.48 0.00 0.00 0.00 1.01 0.00 0.00 36.73 40.22 1a8y h TYR 239 CO -0.00 0.53 -0.10 1.49 -1.05 0.00 0.00 178.16 179.03 1a8y h GLU 240 N 0.00 -0.27 -0.04 4.88 4.81 -0.78 -2.54 114.58 120.63 1a8y h GLU 240 Ca -0.14 0.02 -0.07 0.00 -0.13 0.00 0.00 59.36 59.04 1a8y h GLU 240 Cb 1.52 0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.96 1a8y h GLU 240 CO 0.04 0.12 -0.28 1.15 -0.73 0.00 0.00 179.01 179.32 1a8y h THR 241 N -0.78 1.22 0.00 0.32 2.02 -1.70 -3.07 112.91 110.92 1a8y h THR 241 Ca -0.03 -1.03 -0.15 0.00 0.77 0.00 0.00 66.41 65.97 1a8y h THR 241 Cb 0.51 1.50 -0.02 0.00 -1.74 0.00 0.00 68.15 68.40 1a8y h THR 241 CO 0.05 0.30 -0.70 -0.25 0.37 0.00 0.00 175.52 175.29 1a8y h TRP 242 N 0.07 0.00 -0.05 3.16 2.91 -1.51 -3.17 115.95 117.36 1a8y h TRP 242 Ca 0.01 0.00 0.00 0.00 1.13 0.00 0.00 58.89 60.03 1a8y h TRP 242 Cb 0.53 0.00 0.00 0.00 -0.51 0.00 0.00 29.16 29.18 1a8y h TRP 242 CO 0.00 0.70 0.00 0.39 -1.03 0.00 0.00 178.44 178.50 1a8y n GLU 243 N -3.49 1.60 -2.69 2.65 4.71 -0.96 -4.04 120.64 118.41 1a8y n GLU 243 Ca -0.00 -0.88 -0.41 0.00 -0.01 0.00 0.00 57.16 55.87 1a8y n GLU 243 Cb 0.74 -1.46 0.02 0.00 -1.01 0.00 0.00 31.44 29.73 1a8y n GLU 243 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1a8y n ASP 244 N 0.07 7.16 -4.75 1.62 -0.08 -1.20 -5.01 116.55 114.36 1a8y n ASP 244 Ca 0.19 -3.66 -0.41 0.00 -1.51 0.00 0.00 54.79 49.40 1a8y n ASP 244 Cb 0.32 -1.16 -0.04 0.00 2.34 0.00 0.00 41.12 42.58 1a8y n ASP 244 CO 0.00 0.00 0.00 1.51 0.12 0.00 0.00 177.20 178.83 1a8y s ASP 245 N -1.47 7.15 -1.17 1.67 1.47 -1.26 -4.93 116.67 118.13 1a8y s ASP 245 Ca 0.39 2.29 -0.21 0.00 1.18 0.00 0.00 52.55 56.19 1a8y s ASP 245 Cb 0.18 -2.62 0.04 0.00 -0.34 0.00 0.00 42.92 40.18 1a8y s ASP 245 CO -0.10 -0.27 1.69 0.00 0.68 0.00 0.00 175.17 177.16 1a8y s MET 246 N -0.96 3.59 -0.85 2.11 0.23 -0.55 -4.40 119.30 118.46 1a8y s MET 246 Ca 0.48 -1.50 -0.04 0.00 -1.03 0.00 0.00 55.69 53.60 1a8y s MET 246 Cb -0.33 -5.41 -0.00 0.00 -1.53 0.00 0.00 34.83 27.56 1a8y s MET 246 CO 0.40 -2.53 0.68 -0.25 -2.03 0.00 0.00 175.02 171.30 1a8y n ASP 247 N 9.65 -6.13 0.00 -1.18 8.00 -1.26 -2.84 116.55 122.79 1a8y n ASP 247 Ca 0.43 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 55.31 1a8y n ASP 247 Cb 0.48 -3.47 0.00 0.00 -0.02 0.00 0.00 41.12 38.11 1a8y n ASP 247 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1a8y n GLY 248 N -1.70 2.73 3.47 0.44 0.00 -1.26 -5.01 105.19 103.85 1a8y n GLY 248 Ca -0.15 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.61 1a8y n GLY 248 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1a8y s ILE 249 N -2.04 2.57 -0.00 -0.61 1.10 -1.13 -1.54 121.20 119.55 1a8y s ILE 249 Ca 0.00 -2.08 0.01 0.00 -0.51 0.00 0.00 60.65 58.07 1a8y s ILE 249 Cb 0.00 -2.28 -0.00 0.00 0.15 0.00 0.00 42.46 40.33 1a8y s ILE 249 CO 0.00 -0.21 -0.03 -1.00 -2.11 0.00 0.00 174.94 171.60 1a8y s HIS 250 N -1.94 0.22 -0.26 3.50 3.76 -0.92 -1.49 115.29 118.16 1a8y s HIS 250 Ca 0.24 -0.06 -0.10 0.00 -0.15 0.00 0.00 55.06 54.99 1a8y s HIS 250 Cb -0.07 -0.14 -0.05 0.00 1.11 0.00 0.00 32.58 33.43 1a8y s HIS 250 CO 0.13 -0.01 0.16 0.42 -0.85 0.00 0.00 174.74 174.59 1a8y s ILE 251 N -0.10 5.20 -0.09 0.60 1.01 -1.24 -0.24 121.20 126.33 1a8y s ILE 251 Ca 0.00 0.13 0.03 0.00 0.00 0.00 0.00 60.65 60.82 1a8y s ILE 251 Cb -0.01 -3.45 0.01 0.00 0.01 0.00 0.00 42.46 39.01 1a8y s ILE 251 CO -0.00 0.29 -0.20 -0.69 0.00 0.00 0.00 174.94 174.34 1a8y s VAL 252 N 1.50 1.75 -0.14 2.92 1.01 -0.30 0.09 120.40 127.23 1a8y s VAL 252 Ca 0.07 -0.83 0.01 0.00 0.00 0.00 0.00 61.98 61.23 1a8y s VAL 252 Cb -0.15 -1.54 0.00 0.00 0.00 0.00 0.00 36.38 34.69 1a8y s VAL 252 CO 0.08 0.49 -0.18 0.00 0.00 0.00 0.00 175.10 175.49 1a8y s ALA 253 N 0.52 2.38 -0.10 5.51 0.00 -0.12 -0.61 121.76 129.33 1a8y s ALA 253 Ca -0.16 -1.04 -0.12 0.00 0.00 0.00 0.00 51.96 50.63 1a8y s ALA 253 Cb -0.17 -1.10 -0.05 0.00 0.00 0.00 0.00 23.12 21.80 1a8y s ALA 253 CO 0.06 0.02 0.29 -0.06 0.00 0.00 0.00 175.76 176.07 1a8y s PHE 254 N 0.73 3.57 -0.25 0.00 0.08 -0.36 -0.54 117.98 121.21 1a8y s PHE 254 Ca -0.08 0.69 -0.09 0.00 0.12 0.00 0.00 56.93 57.57 1a8y s PHE 254 Cb -0.16 -2.23 0.10 0.00 -0.57 0.00 0.00 43.02 40.17 1a8y s PHE 254 CO 0.01 0.48 0.55 0.00 -0.10 0.00 0.00 175.22 176.15 1a8y s ALA 255 N -0.34 -1.62 -0.48 5.36 0.00 -0.94 -0.83 121.76 122.92 1a8y s ALA 255 Ca 0.18 1.97 -0.28 0.00 0.00 0.00 0.00 51.96 53.83 1a8y s ALA 255 Cb -0.14 -1.50 0.03 0.00 0.00 0.00 0.00 23.12 21.51 1a8y s ALA 255 CO 0.07 -0.75 1.11 -1.21 0.00 0.00 0.00 175.76 174.97 1a8y s GLU 256 N 2.54 3.68 0.49 0.00 2.02 -1.26 -4.25 118.70 121.92 1a8y s GLU 256 Ca -0.05 0.48 0.25 0.00 0.02 0.00 0.00 54.97 55.67 1a8y s GLU 256 Cb -0.11 -3.92 1.32 0.00 0.10 0.00 0.00 34.13 31.52 1a8y s GLU 256 CO -0.16 -1.38 1.90 1.49 0.02 0.00 0.00 175.26 177.12 1a8y h GLU 257 N 9.23 0.15 -0.16 1.61 4.81 -1.95 -1.69 114.58 126.58 1a8y h GLU 257 Ca -0.23 -0.01 -0.19 0.00 -0.13 0.00 0.00 59.36 58.80 1a8y h GLU 257 Cb 1.06 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 30.41 1a8y h GLU 257 CO 1.12 0.10 -0.66 0.00 -0.73 0.00 0.00 179.01 178.83 1a8y h ALA 258 N 1.61 0.53 -2.89 2.92 0.00 -1.95 -3.37 119.26 116.09 1a8y h ALA 258 Ca 0.41 -0.56 -0.53 0.00 0.00 0.00 0.00 54.91 54.22 1a8y h ALA 258 Cb 1.38 -0.06 0.10 0.00 0.00 0.00 0.00 17.79 19.21 1a8y h ALA 258 CO -0.07 0.71 0.80 0.34 0.00 0.00 0.00 179.25 181.02 1a8y s ASP 259 N -6.99 6.40 0.18 0.00 2.15 -0.64 -4.89 116.67 112.87 1a8y s ASP 259 Ca -0.08 2.98 -0.14 0.00 0.43 0.00 0.00 52.55 55.74 1a8y s ASP 259 Cb 0.10 -2.66 0.15 0.00 -0.30 0.00 0.00 42.92 40.22 1a8y s ASP 259 CO 0.87 -0.85 1.71 1.55 -0.17 0.00 0.00 175.17 178.28 1a8y h PRO 260 N 3.60 0.19 0.00 4.34 0.13 -1.87 -1.86 132.00 136.53 1a8y h PRO 260 Ca -0.49 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.52 1a8y h PRO 260 Cb 1.23 -0.04 -0.02 0.00 0.13 0.00 0.00 31.00 32.30 1a8y h PRO 260 CO 0.69 0.12 -0.52 -0.44 -0.23 0.00 0.00 178.00 177.62 1a8y h ASP 261 N 0.19 0.00 -0.15 1.44 3.32 -1.92 -2.59 116.42 116.72 1a8y h ASP 261 Ca 0.22 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.21 1a8y h ASP 261 Cb 0.30 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.85 1a8y h ASP 261 CO -0.31 0.52 -0.15 1.23 -1.72 0.00 0.00 179.24 178.80 1a8y h GLY 262 N 1.82 0.40 1.31 2.75 0.00 -1.64 -2.77 103.07 104.94 1a8y h GLY 262 Ca -0.01 -0.41 -0.05 0.00 0.00 0.00 0.00 47.33 46.87 1a8y h GLY 262 CO 0.07 0.37 0.18 -1.82 0.00 0.00 0.00 176.54 175.34 1a8y h TYR 263 N -0.00 0.90 -0.57 5.60 3.20 -1.25 0.02 116.97 124.86 1a8y h TYR 263 Ca 0.02 -0.07 -0.07 0.00 3.14 0.00 0.00 58.73 61.76 1a8y h TYR 263 Cb 0.69 -0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.67 1a8y h TYR 263 CO 0.08 0.73 0.09 0.93 -1.64 0.00 0.00 178.16 178.35 1a8y h GLU 264 N 0.85 0.91 -0.07 1.82 5.08 -1.47 -1.20 114.58 120.50 1a8y h GLU 264 Ca 0.19 -0.22 -0.16 0.00 -1.00 0.00 0.00 59.36 58.17 1a8y h GLU 264 Cb 0.25 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 1a8y h GLU 264 CO -0.01 0.85 -0.66 0.35 -1.00 0.00 0.00 179.01 178.54 1a8y h PHE 265 N 0.86 0.40 -0.91 4.33 3.57 -1.16 -2.72 116.94 121.32 1a8y h PHE 265 Ca 0.18 -0.17 -0.02 0.00 3.53 0.00 0.00 57.97 61.50 1a8y h PHE 265 Cb 0.39 -0.07 -0.04 0.00 2.79 0.00 0.00 35.95 39.02 1a8y h PHE 265 CO 0.02 0.87 0.51 1.25 -2.23 0.00 0.00 178.31 178.73 1a8y h LEU 266 N 0.22 1.13 -1.12 0.59 5.85 -0.50 -1.12 115.31 120.36 1a8y h LEU 266 Ca -0.01 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 1a8y h LEU 266 Cb 1.20 -0.29 -0.04 0.00 0.37 0.00 0.00 40.66 41.90 1a8y h LEU 266 CO 0.11 0.90 0.51 -0.33 -0.34 0.00 0.00 178.44 179.29 1a8y h GLU 267 N 1.27 1.11 -0.15 1.25 4.39 -0.93 0.12 114.58 121.65 1a8y h GLU 267 Ca 0.32 -0.09 -0.06 0.00 0.34 0.00 0.00 59.36 59.87 1a8y h GLU 267 Cb 0.02 -0.24 -0.00 0.00 -0.10 0.00 0.00 28.75 28.42 1a8y h GLU 267 CO -0.05 0.76 -0.16 0.82 -1.16 0.00 0.00 179.01 179.22 1a8y h ILE 268 N 1.13 1.35 -0.46 3.13 2.04 -1.24 -2.61 117.51 120.84 1a8y h ILE 268 Ca 0.30 -1.33 -0.04 0.00 1.00 0.00 0.00 64.86 64.79 1a8y h ILE 268 Cb -0.07 1.88 -0.02 0.00 -0.74 0.00 0.00 36.82 37.86 1a8y h ILE 268 CO -0.06 0.39 0.11 0.25 0.00 0.00 0.00 178.15 178.85 1a8y h LEU 269 N -0.00 0.64 -1.13 1.44 5.85 -1.05 -0.62 115.31 120.43 1a8y h LEU 269 Ca 0.02 -0.10 -0.09 0.00 0.84 0.00 0.00 57.88 58.55 1a8y h LEU 269 Cb 0.69 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.55 1a8y h LEU 269 CO 0.04 0.63 -0.36 0.11 -0.34 0.00 0.00 178.44 178.52 1a8y h LYS 270 N 0.67 0.14 0.00 1.25 1.57 -0.91 -2.55 116.57 116.74 1a8y h LYS 270 Ca 0.15 -0.06 -0.14 0.00 -1.87 0.00 0.00 60.65 58.74 1a8y h LYS 270 Cb 0.25 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 32.53 1a8y h LYS 270 CO -0.00 0.48 -0.66 1.03 -0.57 0.00 0.00 179.45 179.73 1a8y h SER 271 N 0.12 0.00 -0.09 0.86 0.87 -0.90 -2.72 113.55 111.69 1a8y h SER 271 Ca 0.01 0.00 -0.14 0.00 -1.23 0.00 0.00 61.79 60.43 1a8y h SER 271 Cb 0.70 0.00 0.01 0.00 -0.44 0.00 0.00 62.40 62.67 1a8y h SER 271 CO 0.05 0.66 -0.48 0.58 -0.53 0.00 0.00 176.83 177.11 1a8y h VAL 272 N 0.00 1.38 -0.73 2.23 2.07 -0.92 -3.13 116.25 117.15 1a8y h VAL 272 Ca -0.01 -1.83 -0.05 0.00 0.82 0.00 0.00 66.70 65.64 1a8y h VAL 272 Cb 1.43 2.24 -0.03 0.00 -1.52 0.00 0.00 31.29 33.41 1a8y h VAL 272 CO 0.09 0.55 0.27 0.00 0.02 0.00 0.00 177.57 178.49 1a8y h ALA 273 N 0.46 1.10 0.00 1.67 0.00 -1.54 -2.49 119.26 118.45 1a8y h ALA 273 Ca -0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1a8y h ALA 273 Cb 1.13 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 18.64 1a8y h ALA 273 CO 0.10 0.63 -0.05 1.96 0.00 0.00 0.00 179.25 181.90 1a8y h GLN 274 N 1.07 0.00 0.07 0.00 4.20 -1.54 -2.28 115.11 116.63 1a8y h GLN 274 Ca 0.24 0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.60 1a8y h GLN 274 Cb 0.24 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 27.98 1a8y h GLN 274 CO -0.02 0.05 -2.05 -3.47 -0.67 0.00 0.00 178.83 172.67 1a8y n ASP 275 N -3.19 1.72 -1.89 1.46 2.03 -1.14 -4.37 116.55 111.17 1a8y n ASP 275 Ca -0.00 0.18 -0.15 0.00 0.52 0.00 0.00 54.79 55.34 1a8y n ASP 275 Cb 0.29 -0.51 0.21 0.00 -0.72 0.00 0.00 41.12 40.39 1a8y n ASP 275 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1a8y n ASN 276 N -3.31 3.67 0.13 1.67 3.02 -0.95 -4.62 115.26 114.87 1a8y n ASN 276 Ca -0.31 -3.56 0.13 0.00 -0.03 0.00 0.00 54.58 50.81 1a8y n ASN 276 Cb 1.05 -0.77 0.35 0.00 -0.61 0.00 0.00 39.78 39.81 1a8y n ASN 276 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1a8y h THR 277 N 1.35 0.00 0.00 3.41 1.03 -1.61 -1.86 112.91 115.24 1a8y h THR 277 Ca 0.45 -0.59 -0.03 0.00 -0.01 0.00 0.00 66.41 66.23 1a8y h THR 277 Cb 2.44 1.59 -0.00 0.00 -1.07 0.00 0.00 68.15 71.11 1a8y h THR 277 CO 0.84 0.00 -0.14 -2.24 -0.01 0.00 0.00 175.52 173.97 1a8y h ASP 278 N 0.00 0.00 -3.40 0.00 3.04 -1.87 -3.43 116.42 110.76 1a8y h ASP 278 Ca 0.00 0.00 -0.55 0.00 -3.24 0.00 0.00 57.03 53.24 1a8y h ASP 278 Cb 0.79 0.00 -0.03 0.00 -1.04 0.00 0.00 39.33 39.05 1a8y h ASP 278 CO 0.00 0.14 0.26 0.21 -2.04 0.00 0.00 179.24 177.81 1a8y s ASN 279 N -6.04 7.23 -0.04 4.15 3.84 -0.70 -5.01 114.94 118.37 1a8y s ASN 279 Ca -0.01 1.48 0.18 0.00 0.21 0.00 0.00 52.86 54.72 1a8y s ASN 279 Cb 0.11 -2.51 -0.21 0.00 -0.55 0.00 0.00 41.25 38.09 1a8y s ASN 279 CO 0.59 -0.19 0.53 -2.65 -2.79 0.00 0.00 177.10 172.58 1a8y n PRO 280 N 3.80 0.65 -0.01 0.43 -0.02 -1.26 -4.30 135.00 134.29 1a8y n PRO 280 Ca 0.03 0.08 -0.09 0.00 -2.02 0.00 0.00 63.50 61.50 1a8y n PRO 280 Cb 0.51 -1.67 0.06 0.00 -0.02 0.00 0.00 33.50 32.38 1a8y n PRO 280 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 1a8y h ASP 281 N 0.00 0.65 -3.04 2.55 3.32 -1.96 -3.45 116.42 114.49 1a8y h ASP 281 Ca -0.26 -0.33 -0.55 0.00 0.02 0.00 0.00 57.03 55.92 1a8y h ASP 281 Cb 1.71 -0.18 0.08 0.00 0.22 0.00 0.00 39.33 41.16 1a8y h ASP 281 CO 0.04 1.04 0.81 0.18 -1.72 0.00 0.00 179.24 179.58 1a8y n LEU 282 N -3.98 3.94 -3.68 1.55 4.77 -1.26 -4.74 117.00 113.59 1a8y n LEU 282 Ca -0.03 1.14 -0.10 0.00 -0.03 0.00 0.00 56.01 57.00 1a8y n LEU 282 Cb 0.58 -1.54 -0.10 0.00 -2.33 0.00 0.00 43.42 40.03 1a8y n LEU 282 CO 0.47 -0.04 0.05 -0.94 -1.33 0.00 0.00 177.39 175.59 1a8y s SER 283 N 0.49 -0.40 -0.26 -1.43 1.04 -1.26 -4.59 113.70 107.28 1a8y s SER 283 Ca 0.66 0.94 -0.07 0.00 0.48 0.00 0.00 55.95 57.97 1a8y s SER 283 Cb -0.55 1.02 -0.01 0.00 0.10 0.00 0.00 66.02 66.59 1a8y s SER 283 CO 0.48 -0.21 0.06 -0.63 0.98 0.00 0.00 173.24 173.91 1a8y s ILE 284 N 1.93 4.04 -0.23 -1.02 1.01 0.29 -3.72 121.20 123.50 1a8y s ILE 284 Ca -0.06 -0.41 -0.17 0.00 0.00 0.00 0.00 60.65 60.01 1a8y s ILE 284 Cb -0.10 -2.95 -0.03 0.00 0.01 0.00 0.00 42.46 39.39 1a8y s ILE 284 CO -0.13 0.26 0.48 -0.63 0.00 0.00 0.00 174.94 174.93 1a8y s ILE 285 N 1.55 5.11 -0.21 2.92 1.01 0.11 -2.07 121.20 129.63 1a8y s ILE 285 Ca 0.05 0.84 -0.09 0.00 0.00 0.00 0.00 60.65 61.45 1a8y s ILE 285 Cb -0.16 -3.80 -0.04 0.00 0.01 0.00 0.00 42.46 38.47 1a8y s ILE 285 CO 0.02 0.15 0.11 0.86 0.00 0.00 0.00 174.94 176.07 1a8y s TRP 286 N 1.93 3.30 -0.15 3.97 -0.11 -0.45 -0.95 118.94 126.48 1a8y s TRP 286 Ca 0.21 0.14 0.01 0.00 1.22 0.00 0.00 56.10 57.68 1a8y s TRP 286 Cb -0.15 -2.16 -0.00 0.00 -1.50 0.00 0.00 33.47 29.65 1a8y s TRP 286 CO 0.09 0.13 -0.16 0.42 -4.62 0.00 0.00 176.95 172.81 1a8y s ILE 287 N 0.64 2.61 -0.33 5.86 1.01 0.30 -0.78 121.20 130.50 1a8y s ILE 287 Ca 0.06 -0.79 -0.17 0.00 0.00 0.00 0.00 60.65 59.75 1a8y s ILE 287 Cb -0.13 -2.09 -0.01 0.00 0.01 0.00 0.00 42.46 40.24 1a8y s ILE 287 CO 0.01 0.52 0.45 -0.62 0.00 0.00 0.00 174.94 175.30 1a8y s ASP 288 N 0.77 6.27 0.47 3.58 -1.08 -1.26 -2.20 116.67 123.21 1a8y s ASP 288 Ca -0.06 -0.03 0.18 0.00 -0.52 0.00 0.00 52.55 52.12 1a8y s ASP 288 Cb -0.15 -2.24 1.17 0.00 -1.46 0.00 0.00 42.92 40.24 1a8y s ASP 288 CO 0.00 -0.39 1.99 -0.65 0.52 0.00 0.00 175.17 176.65 1a8y h PRO 289 N 8.40 0.24 0.00 4.34 0.11 -1.92 -1.77 132.00 141.40 1a8y h PRO 289 Ca -0.29 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.81 1a8y h PRO 289 Cb 1.14 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 32.19 1a8y h PRO 289 CO 0.73 0.16 0.00 -0.25 -0.21 0.00 0.00 178.00 178.42 1a8y n ASP 290 N -4.45 0.16 -0.28 -2.05 8.00 -1.26 -0.78 116.55 115.89 1a8y n ASP 290 Ca 0.09 0.56 0.11 0.00 0.71 0.00 0.00 54.79 56.26 1a8y n ASP 290 Cb 0.44 -0.59 0.05 0.00 -0.02 0.00 0.00 41.12 41.00 1a8y n ASP 290 CO 0.00 0.00 0.00 0.47 -0.39 0.00 0.00 177.20 177.28 1a8y n ASP 291 N -1.70 1.46 -3.21 -2.24 8.00 -0.66 -4.57 116.55 113.62 1a8y n ASP 291 Ca 0.01 -1.17 -0.24 0.00 0.71 0.00 0.00 54.79 54.10 1a8y n ASP 291 Cb 0.06 0.55 -0.07 0.00 -0.02 0.00 0.00 41.12 41.64 1a8y n ASP 291 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1a8y n PHE 292 N -0.65 -0.24 -0.21 1.24 3.72 0.04 -4.92 117.46 116.44 1a8y n PHE 292 Ca 0.08 -3.57 -0.08 0.00 -0.05 0.00 0.00 57.45 53.83 1a8y n PHE 292 Cb 0.40 -0.32 0.03 0.00 -0.94 0.00 0.00 39.48 38.65 1a8y n PHE 292 CO 0.00 0.00 0.00 -1.35 -0.05 0.00 0.00 176.76 175.36 1a8y h PRO 293 N 4.12 0.95 0.00 -1.08 0.11 -1.81 -2.85 132.00 131.43 1a8y h PRO 293 Ca 0.09 -0.23 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1a8y h PRO 293 Cb 0.87 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 31.86 1a8y h PRO 293 CO 0.47 0.87 0.00 1.28 -0.21 0.00 0.00 178.00 180.41 1a8y n LEU 294 N -4.36 0.70 -0.01 2.35 4.77 -1.26 -3.44 117.00 115.74 1a8y n LEU 294 Ca 0.03 0.68 0.07 0.00 -0.03 0.00 0.00 56.01 56.76 1a8y n LEU 294 Cb 0.24 -0.59 -0.13 0.00 -2.33 0.00 0.00 43.42 40.60 1a8y n LEU 294 CO 0.41 -0.60 -0.73 -0.11 -1.33 0.00 0.00 177.39 175.03 1a8y n LEU 295 N -2.28 0.00 0.22 2.23 7.94 -1.09 -4.59 117.00 119.42 1a8y n LEU 295 Ca 0.02 0.00 0.09 0.00 -1.11 0.00 0.00 56.01 55.01 1a8y n LEU 295 Cb 0.22 0.04 0.46 0.00 0.53 0.00 0.00 43.42 44.67 1a8y n LEU 295 CO 0.20 0.04 0.79 -0.37 -1.11 0.00 0.00 177.39 176.93 1a8y h VAL 296 N 0.00 0.65 -0.18 1.96 -1.51 -1.54 -0.58 116.25 115.05 1a8y h VAL 296 Ca -0.04 -1.15 -0.05 0.00 -1.23 0.00 0.00 66.70 64.22 1a8y h VAL 296 Cb 0.89 1.76 -0.01 0.00 -2.13 0.00 0.00 31.29 31.80 1a8y h VAL 296 CO 0.00 0.25 -0.13 1.55 -1.23 0.00 0.00 177.57 178.01 1a8y h PRO 297 N 0.00 0.29 0.10 5.19 0.13 -1.81 -0.74 132.00 135.16 1a8y h PRO 297 Ca -0.00 -0.07 -0.00 0.00 -0.87 0.00 0.00 66.00 65.05 1a8y h PRO 297 Cb 0.74 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 31.83 1a8y h PRO 297 CO 0.03 0.43 -0.05 -0.92 -0.23 0.00 0.00 178.00 177.26 1a8y h TYR 298 N 0.27 -0.12 -0.30 1.56 3.20 -1.55 -2.54 116.97 117.49 1a8y h TYR 298 Ca 0.05 -0.00 -0.04 0.00 3.14 0.00 0.00 58.73 61.88 1a8y h TYR 298 Cb 0.40 0.04 -0.02 0.00 1.54 0.00 0.00 36.73 38.70 1a8y h TYR 298 CO 0.01 0.17 0.02 -1.49 -1.64 0.00 0.00 178.16 175.23 1a8y h TRP 299 N -0.41 0.46 -0.26 -3.82 6.55 -1.11 -2.41 115.95 114.94 1a8y h TRP 299 Ca -0.01 -0.03 -0.19 0.00 0.95 0.00 0.00 58.89 59.60 1a8y h TRP 299 Cb 0.35 -0.14 0.00 0.00 -0.86 0.00 0.00 29.16 28.51 1a8y h TRP 299 CO 0.02 0.45 -0.58 0.93 -1.05 0.00 0.00 178.44 178.21 1a8y h GLU 300 N 0.44 0.83 0.00 0.49 5.08 -1.05 -2.80 114.58 117.56 1a8y h GLU 300 Ca 0.10 -0.55 -0.09 0.00 -1.00 0.00 0.00 59.36 57.82 1a8y h GLU 300 Cb 0.26 0.07 -0.02 0.00 0.50 0.00 0.00 28.75 29.57 1a8y h GLU 300 CO 0.01 1.17 -1.01 1.57 -1.00 0.00 0.00 179.01 179.75 1a8y h LYS 301 N 0.63 0.00 0.20 2.33 2.10 -1.32 -0.39 116.57 120.12 1a8y h LYS 301 Ca 0.00 0.00 -0.01 0.00 -2.00 0.00 0.00 60.65 58.65 1a8y h LYS 301 Cb 1.18 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.52 1a8y h LYS 301 CO 0.13 0.22 -0.10 1.15 -2.00 0.00 0.00 179.45 178.85 1a8y h THR 302 N 0.00 0.00 0.00 0.07 2.02 -1.55 -3.30 112.91 110.15 1a8y h THR 302 Ca -0.07 -0.19 0.00 0.00 0.77 0.00 0.00 66.41 66.92 1a8y h THR 302 Cb 1.33 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.74 1a8y h THR 302 CO 0.03 0.00 0.00 -0.26 0.37 0.00 0.00 175.52 175.66 1a8y h PHE 303 N -0.46 0.00 -5.82 3.16 0.04 -1.66 -3.47 116.94 108.73 1a8y h PHE 303 Ca -0.03 0.00 -0.37 0.00 2.80 0.00 0.00 57.97 60.37 1a8y h PHE 303 Cb 0.21 0.00 0.13 0.00 2.20 0.00 0.00 35.95 38.48 1a8y h PHE 303 CO 0.07 0.00 -0.77 -3.47 -0.60 0.00 0.00 178.31 173.54 1a8y n ASP 304 N -2.49 -2.56 -4.27 2.17 -0.08 -0.19 -5.00 116.55 104.14 1a8y n ASP 304 Ca 0.02 -0.67 -0.17 0.00 -1.51 0.00 0.00 54.79 52.46 1a8y n ASP 304 Cb 0.27 -4.78 -0.11 0.00 2.34 0.00 0.00 41.12 38.85 1a8y n ASP 304 CO 0.00 0.00 0.00 0.27 0.12 0.00 0.00 177.20 177.59 1a8y s ILE 305 N -3.43 1.38 -0.36 5.18 -4.36 -1.00 -5.04 121.20 113.56 1a8y s ILE 305 Ca 0.12 -1.91 -0.19 0.00 -0.26 0.00 0.00 60.65 58.40 1a8y s ILE 305 Cb -0.05 -1.72 0.00 0.00 1.25 0.00 0.00 42.46 41.94 1a8y s ILE 305 CO 0.76 -0.54 0.59 -0.62 0.24 0.00 0.00 174.94 175.36 1a8y s ASP 306 N -2.82 6.38 0.00 4.36 2.15 -1.26 -4.47 116.67 121.00 1a8y s ASP 306 Ca 0.14 0.05 0.09 0.00 0.43 0.00 0.00 52.55 53.26 1a8y s ASP 306 Cb -0.02 -2.30 0.37 0.00 -0.30 0.00 0.00 42.92 40.67 1a8y s ASP 306 CO 0.03 -0.56 1.27 0.18 -0.17 0.00 0.00 175.17 175.92 1a8y n LEU 307 N 5.93 0.94 0.11 -1.34 4.32 -1.26 -2.92 117.00 122.77 1a8y n LEU 307 Ca -0.03 -0.45 0.00 0.00 -0.02 0.00 0.00 56.01 55.52 1a8y n LEU 307 Cb 0.49 -0.10 -0.02 0.00 -1.62 0.00 0.00 43.42 42.17 1a8y n LEU 307 CO 0.48 0.22 0.29 0.77 -1.22 0.00 0.00 177.39 177.93 1a8y h SER 308 N 1.08 0.00 -3.30 -1.43 4.64 -2.01 -3.46 113.55 109.07 1a8y h SER 308 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 1a8y h SER 308 Cb 0.24 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.33 1a8y h SER 308 CO 0.00 0.60 -0.09 0.00 -0.87 0.00 0.00 176.83 176.47 1a8y s ALA 309 N -2.91 3.57 0.27 5.18 0.00 -1.15 -4.91 121.76 121.80 1a8y s ALA 309 Ca 0.02 -0.49 -0.30 0.00 0.00 0.00 0.00 51.96 51.20 1a8y s ALA 309 Cb 0.08 -2.38 -0.10 0.00 0.00 0.00 0.00 23.12 20.72 1a8y s ALA 309 CO 0.77 0.19 1.39 -1.25 0.00 0.00 0.00 175.76 176.86 1a8y s PRO 310 N -3.62 4.30 0.12 0.00 0.04 -1.26 -4.76 135.00 129.81 1a8y s PRO 310 Ca 0.45 2.26 0.05 0.00 0.04 0.00 0.00 61.00 63.80 1a8y s PRO 310 Cb -0.11 -3.11 -0.04 0.00 0.04 0.00 0.00 34.50 31.29 1a8y s PRO 310 CO 0.30 -0.35 -0.12 -0.65 0.04 0.00 0.00 177.00 176.22 1a8y s GLN 311 N -0.75 0.99 -0.12 4.56 -1.52 -0.01 -4.98 119.66 117.83 1a8y s GLN 311 Ca 0.56 -1.25 -0.05 0.00 -1.95 0.00 0.00 55.36 52.67 1a8y s GLN 311 Cb -0.41 -0.77 0.06 0.00 -0.22 0.00 0.00 33.01 31.67 1a8y s GLN 311 CO 0.46 0.13 0.24 -1.50 -0.25 0.00 0.00 175.29 174.38 1a8y s ILE 312 N -2.41 -0.30 0.34 1.08 1.10 -1.26 -1.23 121.20 118.53 1a8y s ILE 312 Ca 0.09 0.26 0.04 0.00 -0.51 0.00 0.00 60.65 60.53 1a8y s ILE 312 Cb -0.03 -0.41 -0.02 0.00 0.15 0.00 0.00 42.46 42.15 1a8y s ILE 312 CO 0.02 0.11 0.35 -0.83 -2.11 0.00 0.00 174.94 172.48 1a8y s GLY 313 N 2.11 2.05 -0.15 1.50 0.00 0.21 -2.43 107.32 110.61 1a8y s GLY 313 Ca -0.01 -1.88 0.01 0.00 0.00 0.00 0.00 44.72 42.83 1a8y s GLY 313 CO -0.08 -1.30 -0.15 0.14 0.00 0.00 0.00 173.10 171.70 1a8y s VAL 314 N -3.27 1.65 -0.02 1.40 1.01 -1.02 -1.15 120.40 119.01 1a8y s VAL 314 Ca 0.37 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.73 1a8y s VAL 314 Cb 0.01 -1.53 -0.02 0.00 0.00 0.00 0.00 36.38 34.85 1a8y s VAL 314 CO 0.25 0.47 -0.23 0.68 0.00 0.00 0.00 175.10 176.28 1a8y s VAL 315 N 1.37 1.79 -0.25 2.92 -7.23 0.67 -2.63 120.40 117.03 1a8y s VAL 315 Ca 0.03 -0.97 -0.29 0.00 -1.81 0.00 0.00 61.98 58.94 1a8y s VAL 315 Cb -0.13 -1.48 -0.01 0.00 0.56 0.00 0.00 36.38 35.31 1a8y s VAL 315 CO -0.09 0.51 1.46 0.21 -0.31 0.00 0.00 175.10 176.88 1a8y s ASN 316 N -0.53 6.53 0.08 4.85 3.04 0.93 -2.17 114.94 127.67 1a8y s ASN 316 Ca 0.09 1.44 0.07 0.00 0.04 0.00 0.00 52.86 54.49 1a8y s ASN 316 Cb -0.09 -2.54 0.34 0.00 -1.54 0.00 0.00 41.25 37.43 1a8y s ASN 316 CO -0.01 -1.16 1.21 0.52 -3.04 0.00 0.00 177.10 174.62 1a8y n VAL 317 N 6.28 1.67 -0.08 -5.21 0.31 -0.59 -2.29 118.33 118.43 1a8y n VAL 317 Ca 0.17 0.53 -0.17 0.00 -0.01 0.00 0.00 64.34 64.85 1a8y n VAL 317 Cb 0.46 -1.51 -0.06 0.00 -0.91 0.00 0.00 33.84 31.82 1a8y n VAL 317 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1a8y n THR 318 N -1.69 1.00 0.58 2.52 -2.24 -1.26 -4.67 114.28 108.52 1a8y n THR 318 Ca -0.00 -0.20 0.13 0.00 -2.27 0.00 0.00 64.05 61.71 1a8y n THR 318 Cb 0.03 -1.77 0.37 0.00 -2.10 0.00 0.00 70.33 66.86 1a8y n THR 318 CO 0.00 0.00 0.00 -0.78 -0.57 0.00 0.00 175.07 173.72 1a8y h ASP 319 N -0.62 0.00 -0.31 3.42 1.82 -1.97 -3.46 116.42 115.30 1a8y h ASP 319 Ca -0.40 -0.01 -0.13 0.00 -0.39 0.00 0.00 57.03 56.10 1a8y h ASP 319 Cb 1.31 0.00 -0.05 0.00 0.68 0.00 0.00 39.33 41.27 1a8y h ASP 319 CO -0.24 0.01 -0.12 0.00 -1.61 0.00 0.00 179.24 177.27 1a8y n ALA 320 N -1.82 -0.10 -1.76 -0.78 0.00 -0.97 -5.00 120.51 110.08 1a8y n ALA 320 Ca 0.05 0.10 -0.40 0.00 0.00 0.00 0.00 53.44 53.20 1a8y n ALA 320 Cb 0.44 -1.31 -0.03 0.00 0.00 0.00 0.00 19.45 18.55 1a8y n ALA 320 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1a8y s ASP 321 N -2.36 6.98 0.15 0.00 2.15 -1.25 -4.79 116.67 117.55 1a8y s ASP 321 Ca 0.00 2.40 -0.15 0.00 0.43 0.00 0.00 52.55 55.23 1a8y s ASP 321 Cb 0.00 -2.63 0.02 0.00 -0.30 0.00 0.00 42.92 40.01 1a8y s ASP 321 CO 0.00 -0.36 0.39 -0.94 -0.17 0.00 0.00 175.17 174.10 1a8y s SER 322 N -0.83 -0.17 -0.03 -0.34 1.04 -1.26 -0.05 113.70 112.06 1a8y s SER 322 Ca 0.48 -0.47 0.04 0.00 0.48 0.00 0.00 55.95 56.48 1a8y s SER 322 Cb -0.34 0.48 -0.00 0.00 0.10 0.00 0.00 66.02 66.26 1a8y s SER 322 CO 0.44 -0.90 -0.14 -0.69 0.98 0.00 0.00 173.24 172.93 1a8y s VAL 323 N -3.85 1.12 0.09 5.02 1.01 -1.08 -5.03 120.40 117.67 1a8y s VAL 323 Ca 0.07 -0.56 0.09 0.00 0.00 0.00 0.00 61.98 61.58 1a8y s VAL 323 Cb 0.02 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 1a8y s VAL 323 CO -0.08 0.33 -0.25 0.26 0.00 0.00 0.00 175.10 175.36 1a8y s TRP 324 N -0.03 2.16 0.37 5.22 0.51 -1.26 -2.43 118.94 123.47 1a8y s TRP 324 Ca -0.01 -0.40 -0.24 0.00 -2.12 0.00 0.00 56.10 53.34 1a8y s TRP 324 Cb -0.09 -1.23 -0.10 0.00 -0.81 0.00 0.00 33.47 31.25 1a8y s TRP 324 CO 0.01 0.21 0.97 1.41 -0.51 0.00 0.00 176.95 179.04 1a8y s MET 325 N -1.65 4.41 0.00 4.98 -2.45 -1.02 -5.03 119.30 118.54 1a8y s MET 325 Ca 0.11 1.31 0.29 0.00 -1.25 0.00 0.00 55.69 56.15 1a8y s MET 325 Cb -0.10 -2.58 1.27 0.00 1.25 0.00 0.00 34.83 34.67 1a8y s MET 325 CO 0.04 0.11 1.93 0.39 1.05 0.00 0.00 175.02 178.54 1a8y n GLU 326 N 0.12 0.13 0.00 4.11 1.02 -1.26 -4.81 120.64 119.95 1a8y n GLU 326 Ca 0.04 -0.01 0.00 0.00 -0.02 0.00 0.00 57.16 57.17 1a8y n GLU 326 Cb 0.51 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.43 1a8y n GLU 326 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 1a8y n PRO 334 N -1.42 0.00 -2.01 3.49 -0.04 -1.26 -5.19 135.00 128.56 1a8y n PRO 334 Ca 0.09 0.00 -0.28 0.00 -0.04 0.00 0.00 63.50 63.27 1a8y n PRO 334 Cb 0.31 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 33.86 1a8y n PRO 334 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1a8y s SER 335 N 0.00 4.48 0.18 3.54 1.04 -1.26 -4.81 113.70 116.87 1a8y s SER 335 Ca 0.00 0.61 -0.13 0.00 0.48 0.00 0.00 55.95 56.91 1a8y s SER 335 Cb 0.00 -1.11 0.16 0.00 0.10 0.00 0.00 66.02 65.17 1a8y s SER 335 CO 0.00 -1.88 1.75 0.00 0.98 0.00 0.00 173.24 174.09 1a8y h ALA 336 N -0.95 0.60 -0.17 5.32 0.00 -1.98 0.31 119.26 122.38 1a8y h ALA 336 Ca -0.45 0.06 -0.09 0.00 0.00 0.00 0.00 54.91 54.43 1a8y h ALA 336 Cb 1.32 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.12 1a8y h ALA 336 CO 0.61 -0.21 -0.28 0.93 0.00 0.00 0.00 179.25 180.30 1a8y h GLU 337 N 0.36 0.32 -0.28 0.00 3.07 -1.97 0.19 114.58 116.28 1a8y h GLU 337 Ca 0.23 -0.12 -0.18 0.00 -0.50 0.00 0.00 59.36 58.80 1a8y h GLU 337 Cb 0.23 -0.02 -0.00 0.00 -0.84 0.00 0.00 28.75 28.12 1a8y h GLU 337 CO -0.23 0.58 -0.52 0.93 -1.40 0.00 0.00 179.01 178.37 1a8y h GLU 338 N 0.28 0.81 -0.13 2.33 5.08 -1.81 -1.98 114.58 119.16 1a8y h GLU 338 Ca 0.04 -0.50 -0.11 0.00 -1.00 0.00 0.00 59.36 57.80 1a8y h GLU 338 Cb 0.65 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.94 1a8y h GLU 338 CO 0.05 1.13 -0.40 1.25 -1.00 0.00 0.00 179.01 180.04 1a8y h LEU 339 N 0.63 0.29 -0.15 1.33 6.46 0.25 -2.45 115.31 121.67 1a8y h LEU 339 Ca 0.02 -0.12 -0.04 0.00 -0.12 0.00 0.00 57.88 57.63 1a8y h LEU 339 Cb 1.11 -0.08 -0.00 0.00 -0.73 0.00 0.00 40.66 40.95 1a8y h LEU 339 CO 0.11 0.66 -0.05 -0.08 -0.62 0.00 0.00 178.44 178.47 1a8y h GLU 340 N 0.23 0.29 -0.38 1.25 4.81 -0.60 -2.82 114.58 117.36 1a8y h GLU 340 Ca 0.02 -0.12 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1a8y h GLU 340 Cb 0.81 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.16 1a8y h GLU 340 CO 0.06 0.60 0.16 0.22 -0.73 0.00 0.00 179.01 179.32 1a8y h ASP 341 N -0.03 0.52 0.19 1.04 3.58 -1.26 -0.33 116.42 120.13 1a8y h ASP 341 Ca 0.03 -0.15 -0.03 0.00 0.42 0.00 0.00 57.03 57.30 1a8y h ASP 341 Cb 0.50 -0.13 -0.00 0.00 1.72 0.00 0.00 39.33 41.41 1a8y h ASP 341 CO 0.02 0.53 -0.15 -0.25 -2.88 0.00 0.00 179.24 176.51 1a8y h TRP 342 N 0.47 0.00 -0.05 0.28 7.01 -1.50 0.06 115.95 122.23 1a8y h TRP 342 Ca 0.13 0.00 -0.13 0.00 2.11 0.00 0.00 58.89 61.00 1a8y h TRP 342 Cb 0.16 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.21 1a8y h TRP 342 CO -0.01 0.15 -0.56 -0.07 -2.79 0.00 0.00 178.44 175.16 1a8y h LEU 343 N 0.00 0.15 -0.35 0.65 4.07 -0.94 -3.12 115.31 115.77 1a8y h LEU 343 Ca -0.00 -0.08 -0.15 0.00 0.08 0.00 0.00 57.88 57.73 1a8y h LEU 343 Cb 0.28 -0.04 -0.01 0.00 1.08 0.00 0.00 40.66 41.97 1a8y h LEU 343 CO 0.02 0.68 -0.35 -0.33 -1.08 0.00 0.00 178.44 177.38 1a8y h GLU 344 N 0.10 0.86 -0.25 1.13 5.08 0.61 -3.01 114.58 119.10 1a8y h GLU 344 Ca -0.00 -0.45 -0.11 0.00 -1.00 0.00 0.00 59.36 57.79 1a8y h GLU 344 Cb 1.02 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 30.27 1a8y h GLU 344 CO 0.08 1.10 -0.31 -0.44 -1.00 0.00 0.00 179.01 178.44 1a8y h ASP 345 N 0.65 0.53 0.51 1.42 3.32 -1.43 -3.33 116.42 118.09 1a8y h ASP 345 Ca 0.06 -0.20 -0.22 0.00 0.02 0.00 0.00 57.03 56.69 1a8y h ASP 345 Cb 0.94 -0.15 -0.04 0.00 0.22 0.00 0.00 39.33 40.30 1a8y h ASP 345 CO 0.09 0.82 -1.66 1.33 -1.72 0.00 0.00 179.24 178.09 1a8y n VAL 346 N -4.08 1.24 1.75 -1.35 0.24 -1.18 -5.13 118.33 109.82 1a8y n VAL 346 Ca -0.01 -0.73 0.15 0.00 -2.04 0.00 0.00 64.34 61.71 1a8y n VAL 346 Cb 0.45 -0.72 0.74 0.00 -1.47 0.00 0.00 33.84 32.83 1a8y n VAL 346 CO 0.00 0.00 0.00 0.18 -2.14 0.00 0.00 176.83 174.87