#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3a8t s LYS 29 N 0.00 3.15 0.38 -0.14 2.20 -1.26 -5.05 119.74 119.02 3a8t s LYS 29 Ca 0.00 -0.72 -0.28 0.00 -0.36 0.00 0.00 55.97 54.61 3a8t s LYS 29 Cb 0.00 -4.01 -0.11 0.00 -1.51 0.00 0.00 37.83 32.20 3a8t s LYS 29 CO 0.00 -1.03 1.47 -1.21 -0.36 0.00 0.00 175.35 174.22 3a8t s GLU 30 N 2.47 4.08 0.05 4.03 2.02 -1.26 -4.38 118.70 125.71 3a8t s GLU 30 Ca 0.16 2.53 -0.30 0.00 0.02 0.00 0.00 54.97 57.38 3a8t s GLU 30 Cb -0.17 -2.94 -0.04 0.00 0.10 0.00 0.00 34.13 31.07 3a8t s GLU 30 CO 0.14 -0.54 0.95 0.15 0.02 0.00 0.00 175.26 175.99 3a8t s LYS 31 N -2.11 4.61 -0.04 1.61 1.02 -1.26 -0.75 119.74 122.82 3a8t s LYS 31 Ca 0.53 1.40 -0.01 0.00 0.02 0.00 0.00 55.97 57.92 3a8t s LYS 31 Cb -0.46 -3.42 0.03 0.00 -0.52 0.00 0.00 37.83 33.46 3a8t s LYS 31 CO 0.62 0.08 0.02 -1.17 -0.92 0.00 0.00 175.35 173.98 3a8t s LEU 32 N 0.52 0.67 -0.02 3.17 2.96 -0.49 -4.45 118.68 121.03 3a8t s LEU 32 Ca 0.49 0.01 -0.21 0.00 -0.22 0.00 0.00 54.13 54.20 3a8t s LEU 32 Cb -0.22 -0.22 -0.05 0.00 0.50 0.00 0.00 46.19 46.20 3a8t s LEU 32 CO 0.28 -0.18 0.60 -0.22 -1.32 0.00 0.00 176.35 175.52 3a8t s LEU 33 N 1.64 4.39 -0.19 -0.68 2.96 -0.64 -2.09 118.68 124.08 3a8t s LEU 33 Ca -0.01 1.14 0.01 0.00 -0.22 0.00 0.00 54.13 55.05 3a8t s LEU 33 Cb -0.13 -2.93 0.03 0.00 0.50 0.00 0.00 46.19 43.66 3a8t s LEU 33 CO -0.03 0.06 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.19 3a8t s VAL 34 N 0.01 2.01 -0.34 1.68 1.01 0.13 0.11 120.40 125.01 3a8t s VAL 34 Ca 0.32 -1.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.19 3a8t s VAL 34 Cb -0.18 -1.87 0.00 0.00 0.00 0.00 0.00 36.38 34.33 3a8t s VAL 34 CO 0.17 0.45 0.19 -0.76 0.00 0.00 0.00 175.10 175.15 3a8t s LEU 35 N 1.29 4.42 0.26 3.92 1.43 0.56 -0.34 118.68 130.23 3a8t s LEU 35 Ca 0.03 -0.66 0.10 0.00 -1.03 0.00 0.00 54.13 52.58 3a8t s LEU 35 Cb -0.14 -2.05 -0.05 0.00 0.03 0.00 0.00 46.19 43.99 3a8t s LEU 35 CO -0.12 -0.27 -0.08 -0.04 0.23 0.00 0.00 176.35 176.07 3a8t s MET 36 N 1.62 2.05 0.00 1.70 -1.94 0.14 -3.03 119.30 119.84 3a8t s MET 36 Ca 0.04 -1.53 0.00 0.00 -1.71 0.00 0.00 55.69 52.49 3a8t s MET 36 Cb -0.18 -2.02 0.00 0.00 2.01 0.00 0.00 34.83 34.64 3a8t s MET 36 CO 0.07 0.36 0.00 0.41 -0.01 0.00 0.00 175.02 175.85 3a8t n GLY 37 N -0.71 3.59 3.57 -0.03 0.00 -1.26 -0.56 105.19 109.78 3a8t n GLY 37 Ca -0.06 -1.29 -0.29 0.00 0.00 0.00 0.00 46.02 44.38 3a8t n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a8t s ALA 38 N -2.00 0.25 0.18 4.61 0.00 -1.26 -4.48 121.76 119.06 3a8t s ALA 38 Ca 0.00 -0.05 -0.33 0.00 0.00 0.00 0.00 51.96 51.58 3a8t s ALA 38 Cb 0.00 -3.25 -0.14 0.00 0.00 0.00 0.00 23.12 19.73 3a8t s ALA 38 CO 0.00 -3.37 1.49 -2.37 0.00 0.00 0.00 175.76 171.51 3a8t n THR 39 N -4.59 0.34 -1.04 0.00 5.66 -1.26 -2.41 114.28 110.98 3a8t n THR 39 Ca 0.05 -0.09 -0.01 0.00 -3.05 0.00 0.00 64.05 60.95 3a8t n THR 39 Cb 0.54 -1.45 -0.01 0.00 -1.55 0.00 0.00 70.33 67.87 3a8t n THR 39 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 3a8t n GLY 40 N 2.89 0.49 0.36 1.09 0.00 -1.26 -4.92 105.19 103.84 3a8t n GLY 40 Ca 0.15 -0.24 0.02 0.00 0.00 0.00 0.00 46.02 45.94 3a8t n GLY 40 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 3a8t n THR 41 N -2.81 0.24 -1.09 2.61 -2.24 -1.01 -4.87 114.28 105.10 3a8t n THR 41 Ca -0.01 -0.18 0.00 0.00 -2.27 0.00 0.00 64.05 61.59 3a8t n THR 41 Cb 0.12 -0.07 0.00 0.00 -2.10 0.00 0.00 70.33 68.28 3a8t n THR 41 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3a8t n GLY 42 N 0.53 0.56 0.18 3.38 0.00 -1.26 -4.90 105.19 103.67 3a8t n GLY 42 Ca 0.04 -0.84 -0.10 0.00 0.00 0.00 0.00 46.02 45.12 3a8t n GLY 42 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3a8t h LYS 43 N 0.00 0.53 -0.49 1.61 1.57 -1.91 -2.11 116.57 115.76 3a8t h LYS 43 Ca 0.00 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.66 3a8t h LYS 43 Cb 0.28 -0.07 -0.02 0.00 0.08 0.00 0.00 32.23 32.49 3a8t h LYS 43 CO 0.00 0.59 0.33 0.77 -0.57 0.00 0.00 179.45 180.56 3a8t h SER 44 N 0.38 0.56 -0.32 0.86 0.02 -1.95 -1.79 113.55 111.31 3a8t h SER 44 Ca 0.10 -0.01 0.07 0.00 -0.84 0.00 0.00 61.79 61.11 3a8t h SER 44 Cb 0.30 -0.14 -0.08 0.00 0.14 0.00 0.00 62.40 62.61 3a8t h SER 44 CO 0.00 0.41 -0.27 -0.09 -1.14 0.00 0.00 176.83 175.73 3a8t h ARG 45 N 0.67 -0.24 -0.68 3.45 1.12 -1.94 -1.13 114.38 115.63 3a8t h ARG 45 Ca 0.18 0.02 -0.03 0.00 -1.11 0.00 0.00 59.98 59.03 3a8t h ARG 45 Cb -0.07 0.05 -0.03 0.00 -0.01 0.00 0.00 29.97 29.91 3a8t h ARG 45 CO -0.04 -0.16 0.29 1.25 -3.11 0.00 0.00 179.97 178.20 3a8t h LEU 46 N -0.24 0.90 -1.29 3.80 5.85 -1.15 0.42 115.31 123.61 3a8t h LEU 46 Ca 0.16 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.73 3a8t h LEU 46 Cb 0.50 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 3a8t h LEU 46 CO -0.46 0.80 0.15 0.77 -0.34 0.00 0.00 178.44 179.36 3a8t h SER 47 N 0.98 0.58 0.04 1.25 4.64 -0.36 -0.27 113.55 120.42 3a8t h SER 47 Ca 0.23 -0.07 -0.23 0.00 -0.47 0.00 0.00 61.79 61.25 3a8t h SER 47 Cb 0.16 -0.15 0.02 0.00 -0.31 0.00 0.00 62.40 62.13 3a8t h SER 47 CO -0.02 0.55 -0.93 0.40 -0.87 0.00 0.00 176.83 175.96 3a8t h ILE 48 N 0.63 1.35 -0.98 0.95 1.08 -0.43 -3.09 117.51 117.03 3a8t h ILE 48 Ca 0.15 -2.27 0.02 0.00 -0.39 0.00 0.00 64.86 62.37 3a8t h ILE 48 Cb 0.17 2.61 -0.05 0.00 -3.07 0.00 0.00 36.82 36.48 3a8t h ILE 48 CO -0.01 0.68 0.64 0.44 -0.69 0.00 0.00 178.15 179.21 3a8t h ASP 49 N 0.12 1.11 0.45 1.72 3.32 -0.43 -1.80 116.42 120.91 3a8t h ASP 49 Ca -0.13 -0.02 -0.01 0.00 0.02 0.00 0.00 57.03 56.89 3a8t h ASP 49 Cb 1.62 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 40.90 3a8t h ASP 49 CO 0.18 0.79 -0.05 -0.07 -1.72 0.00 0.00 179.24 178.37 3a8t h LEU 50 N 1.30 0.00 -1.04 1.55 3.38 -1.10 -2.28 115.31 117.13 3a8t h LEU 50 Ca 0.37 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 58.27 3a8t h LEU 50 Cb -0.11 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 3a8t h LEU 50 CO -0.09 0.05 -0.31 0.00 0.09 0.00 0.00 178.44 178.18 3a8t h ALA 51 N 1.95 1.02 0.00 1.53 0.00 -1.23 -0.58 119.26 121.96 3a8t h ALA 51 Ca -0.00 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.63 3a8t h ALA 51 Cb 0.28 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3a8t h ALA 51 CO 0.01 0.38 0.00 0.00 0.00 0.00 0.00 179.25 179.64 3a8t n ALA 52 N -2.27 1.67 -0.03 0.00 0.00 -0.86 -3.46 120.51 115.55 3a8t n ALA 52 Ca -0.00 0.07 -0.02 0.00 0.00 0.00 0.00 53.44 53.49 3a8t n ALA 52 Cb 0.47 -1.37 -0.07 0.00 0.00 0.00 0.00 19.45 18.48 3a8t n ALA 52 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.50 178.22 3a8t n HIS 53 N -2.15 0.00 -3.99 0.00 -0.00 -0.70 -4.99 115.22 103.38 3a8t n HIS 53 Ca 0.02 0.00 -0.20 0.00 -0.00 0.00 0.00 57.72 57.54 3a8t n HIS 53 Cb 0.22 -0.37 -0.17 0.00 -0.00 0.00 0.00 29.99 29.68 3a8t n HIS 53 CO 0.00 0.00 0.00 -0.06 -0.00 0.00 0.00 176.34 176.28 3a8t s PHE 54 N -2.35 0.62 -0.05 4.41 0.08 -0.31 -5.10 117.98 115.29 3a8t s PHE 54 Ca -0.04 -0.15 -0.29 0.00 0.12 0.00 0.00 56.93 56.57 3a8t s PHE 54 Cb 0.04 -0.64 -0.07 0.00 -0.57 0.00 0.00 43.02 41.77 3a8t s PHE 54 CO 0.37 -0.22 2.00 -1.25 -0.10 0.00 0.00 175.22 176.03 3a8t s PRO 55 N 1.24 3.85 0.29 0.24 0.04 -1.26 -4.29 135.00 135.11 3a8t s PRO 55 Ca -0.06 2.39 -0.07 0.00 0.04 0.00 0.00 61.00 63.29 3a8t s PRO 55 Cb -0.14 -4.21 -0.00 0.00 0.04 0.00 0.00 34.50 30.20 3a8t s PRO 55 CO -0.02 -1.28 0.45 -0.48 0.04 0.00 0.00 177.00 175.72 3a8t s LEU 56 N 5.51 0.68 -0.00 -3.56 0.05 -1.26 -1.67 118.68 118.43 3a8t s LEU 56 Ca 0.90 -1.22 -0.06 0.00 0.05 0.00 0.00 54.13 53.80 3a8t s LEU 56 Cb -0.39 1.54 0.00 0.00 -2.05 0.00 0.00 46.19 45.29 3a8t s LEU 56 CO 0.39 -1.20 0.11 -1.61 -0.55 0.00 0.00 176.35 173.49 3a8t s GLU 57 N -3.56 0.40 -0.10 1.48 2.02 -0.82 -4.51 118.70 113.61 3a8t s GLU 57 Ca 0.27 -0.32 -0.04 0.00 0.02 0.00 0.00 54.97 54.90 3a8t s GLU 57 Cb 0.00 0.17 -0.04 0.00 0.10 0.00 0.00 34.13 34.36 3a8t s GLU 57 CO 0.14 -0.09 0.04 0.08 0.02 0.00 0.00 175.26 175.45 3a8t s VAL 58 N -1.13 4.64 -0.18 2.63 1.01 -0.21 -1.46 120.40 125.69 3a8t s VAL 58 Ca -0.12 -0.12 -0.01 0.00 0.00 0.00 0.00 61.98 61.73 3a8t s VAL 58 Cb -0.07 -2.99 0.00 0.00 0.00 0.00 0.00 36.38 33.33 3a8t s VAL 58 CO 0.01 0.59 -0.13 -0.63 0.00 0.00 0.00 175.10 174.94 3a8t s ILE 59 N -0.77 2.69 0.06 2.22 1.01 -0.25 0.26 121.20 126.43 3a8t s ILE 59 Ca 0.12 -0.74 -0.30 0.00 0.00 0.00 0.00 60.65 59.73 3a8t s ILE 59 Cb -0.12 -2.17 -0.05 0.00 0.01 0.00 0.00 42.46 40.14 3a8t s ILE 59 CO 0.03 0.49 1.05 0.21 0.00 0.00 0.00 174.94 176.72 3a8t s ASN 60 N 1.17 7.30 -0.02 3.58 3.84 -0.13 -0.53 114.94 130.15 3a8t s ASN 60 Ca 0.02 1.84 0.06 0.00 0.21 0.00 0.00 52.86 54.99 3a8t s ASN 60 Cb -0.14 -2.58 0.16 0.00 -0.55 0.00 0.00 41.25 38.14 3a8t s ASN 60 CO -0.05 -0.27 1.13 -1.54 -2.79 0.00 0.00 177.10 173.57 3a8t n SER 61 N 3.47 2.48 -4.64 -4.21 3.41 0.14 -4.80 113.62 109.48 3a8t n SER 61 Ca 0.06 -2.11 -0.41 0.00 -0.26 0.00 0.00 58.87 56.14 3a8t n SER 61 Cb 0.49 -0.14 -0.05 0.00 -0.26 0.00 0.00 64.21 64.24 3a8t n SER 61 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 3a8t s ASP 62 N -1.15 6.76 0.38 4.04 -1.08 -1.26 -2.81 116.67 121.55 3a8t s ASP 62 Ca 0.13 0.94 0.28 0.00 -0.52 0.00 0.00 52.55 53.38 3a8t s ASP 62 Cb 0.08 -2.41 1.22 0.00 -1.46 0.00 0.00 42.92 40.35 3a8t s ASP 62 CO 0.07 -0.47 1.83 0.07 0.52 0.00 0.00 175.17 177.20 3a8t h LYS 63 N 7.73 0.00 0.09 4.34 2.10 -1.93 -2.85 116.57 126.06 3a8t h LYS 63 Ca -0.24 0.00 -0.32 0.00 -2.00 0.00 0.00 60.65 58.09 3a8t h LYS 63 Cb 1.10 0.00 -0.02 0.00 -0.90 0.00 0.00 32.23 32.41 3a8t h LYS 63 CO 0.84 0.00 -1.71 0.52 -2.00 0.00 0.00 179.45 177.10 3a8t h MET 64 N 0.00 0.19 0.00 0.07 2.86 -1.95 -3.35 114.93 112.75 3a8t h MET 64 Ca 0.00 -0.33 0.00 0.00 -2.06 0.00 0.00 59.70 57.31 3a8t h MET 64 Cb 0.34 0.12 0.00 0.00 0.06 0.00 0.00 31.60 32.13 3a8t h MET 64 CO 0.00 1.00 0.00 1.04 1.06 0.00 0.00 176.91 180.01 3a8t n GLN 65 N -3.36 0.22 0.22 1.72 6.02 -1.08 -2.37 117.38 118.73 3a8t n GLN 65 Ca -0.21 0.14 0.12 0.00 -0.01 0.00 0.00 57.00 57.04 3a8t n GLN 65 Cb 1.05 -1.50 0.20 0.00 1.02 0.00 0.00 30.24 31.01 3a8t n GLN 65 CO 0.00 0.00 0.00 -0.39 -1.01 0.00 0.00 177.06 175.66 3a8t h VAL 66 N 0.00 0.08 -3.41 5.09 -1.51 -1.69 0.62 116.25 115.43 3a8t h VAL 66 Ca 0.00 -1.06 -0.54 0.00 -1.23 0.00 0.00 66.70 63.86 3a8t h VAL 66 Cb 0.12 1.99 -0.04 0.00 -2.13 0.00 0.00 31.29 31.24 3a8t h VAL 66 CO 0.00 0.04 -0.02 -0.31 -1.23 0.00 0.00 177.57 176.06 3a8t s TYR 67 N -3.23 3.62 0.23 5.19 2.02 -1.00 -1.28 117.35 122.90 3a8t s TYR 67 Ca 0.06 1.18 -0.30 0.00 -0.37 0.00 0.00 57.07 57.64 3a8t s TYR 67 Cb 0.06 -2.46 -0.09 0.00 -0.40 0.00 0.00 41.96 39.07 3a8t s TYR 67 CO 0.67 0.40 1.15 0.15 -1.57 0.00 0.00 175.55 176.34 3a8t s LYS 68 N -1.96 4.56 0.00 -0.62 1.02 -0.33 -4.10 119.74 118.31 3a8t s LYS 68 Ca 0.39 1.84 0.00 0.00 0.02 0.00 0.00 55.97 58.23 3a8t s LYS 68 Cb -0.16 -3.22 0.00 0.00 -0.52 0.00 0.00 37.83 33.94 3a8t s LYS 68 CO 0.20 0.05 0.00 0.41 -0.92 0.00 0.00 175.35 175.09 3a8t n GLY 69 N 1.70 3.29 4.30 -3.33 0.00 -1.26 -4.59 105.19 105.29 3a8t n GLY 69 Ca 0.02 -1.93 -0.31 0.00 0.00 0.00 0.00 46.02 43.79 3a8t n GLY 69 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 3a8t n LEU 70 N 0.00 -1.01 -0.29 0.99 4.77 -1.26 -4.81 117.00 115.38 3a8t n LEU 70 Ca 0.00 -1.27 0.13 0.00 -0.03 0.00 0.00 56.01 54.84 3a8t n LEU 70 Cb 0.00 -1.62 0.38 0.00 -2.33 0.00 0.00 43.42 39.85 3a8t n LEU 70 CO 0.00 0.47 1.22 0.44 -1.33 0.00 0.00 177.39 178.19 3a8t h ASP 71 N -1.80 0.66 0.25 -1.43 3.32 -1.94 -0.05 116.42 115.43 3a8t h ASP 71 Ca -0.66 0.05 -0.01 0.00 0.02 0.00 0.00 57.03 56.43 3a8t h ASP 71 Cb 1.40 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.88 3a8t h ASP 71 CO 0.70 0.30 -0.12 0.40 -1.72 0.00 0.00 179.24 178.81 3a8t h ILE 72 N 0.68 0.37 -0.94 0.35 2.04 -1.91 -1.73 117.51 116.36 3a8t h ILE 72 Ca 0.48 -0.89 0.19 0.00 1.00 0.00 0.00 64.86 65.64 3a8t h ILE 72 Cb 0.82 0.63 -0.08 0.00 -0.74 0.00 0.00 36.82 37.44 3a8t h ILE 72 CO -0.24 0.10 0.60 0.74 0.00 0.00 0.00 178.15 179.36 3a8t h THR 73 N -1.01 0.72 -0.01 -0.27 2.02 -1.84 -0.78 112.91 111.74 3a8t h THR 73 Ca -0.03 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 66.94 3a8t h THR 73 Cb 0.42 0.08 0.00 0.00 -1.74 0.00 0.00 68.15 66.91 3a8t h THR 73 CO 0.06 0.11 -0.19 0.35 0.37 0.00 0.00 175.52 176.22 3a8t n THR 74 N -4.60 0.00 -3.30 3.16 -2.24 -0.06 -4.86 114.28 102.38 3a8t n THR 74 Ca 0.20 -0.09 -0.17 0.00 -2.27 0.00 0.00 64.05 61.72 3a8t n THR 74 Cb 0.62 0.14 0.07 0.00 -2.10 0.00 0.00 70.33 69.05 3a8t n THR 74 CO 0.00 0.00 0.00 0.59 -0.57 0.00 0.00 175.07 175.09 3a8t n ASN 75 N -0.83 -4.30 -4.74 3.42 4.13 -0.30 -4.79 115.26 107.84 3a8t n ASN 75 Ca 0.13 -0.46 -0.41 0.00 1.68 0.00 0.00 54.58 55.52 3a8t n ASN 75 Cb 0.31 -4.17 -0.03 0.00 -1.54 0.00 0.00 39.78 34.35 3a8t n ASN 75 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3a8t s LYS 76 N -5.72 4.43 0.20 3.52 1.02 -0.66 -4.94 119.74 117.59 3a8t s LYS 76 Ca 0.31 2.00 -0.32 0.00 0.02 0.00 0.00 55.97 57.98 3a8t s LYS 76 Cb -0.14 -3.19 -0.13 0.00 -0.52 0.00 0.00 37.83 33.86 3a8t s LYS 76 CO 0.59 -0.16 1.66 1.51 -0.92 0.00 0.00 175.35 178.02 3a8t n ILE 77 N 2.24 0.14 -1.77 2.17 3.06 -1.26 -4.92 119.36 119.02 3a8t n ILE 77 Ca 0.04 -0.03 -0.37 0.00 -2.50 0.00 0.00 62.75 59.89 3a8t n ILE 77 Cb 0.43 -1.83 0.06 0.00 0.54 0.00 0.00 39.64 38.85 3a8t n ILE 77 CO 0.00 0.00 0.00 -0.94 -2.50 0.00 0.00 176.55 173.11 3a8t s SER 78 N 0.99 4.67 0.16 9.51 1.04 -1.26 -4.89 113.70 123.92 3a8t s SER 78 Ca 0.75 2.61 -0.13 0.00 0.48 0.00 0.00 55.95 59.66 3a8t s SER 78 Cb -0.56 -2.62 0.05 0.00 0.10 0.00 0.00 66.02 62.99 3a8t s SER 78 CO 0.36 -1.96 1.68 0.58 0.98 0.00 0.00 173.24 174.88 3a8t h VAL 79 N 0.60 1.24 -0.83 5.02 2.07 -2.01 -2.11 116.25 120.22 3a8t h VAL 79 Ca -0.51 -0.80 0.13 0.00 0.82 0.00 0.00 66.70 66.34 3a8t h VAL 79 Cb 1.33 0.74 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 3a8t h VAL 79 CO 0.53 0.30 0.54 -0.65 0.02 0.00 0.00 177.57 178.31 3a8t h PRO 80 N 0.75 0.63 0.00 1.57 0.11 -2.03 -0.43 132.00 132.59 3a8t h PRO 80 Ca 0.17 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 66.25 3a8t h PRO 80 Cb 0.28 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.25 3a8t h PRO 80 CO -0.00 0.41 0.00 -0.25 -0.21 0.00 0.00 178.00 177.95 3a8t n ASP 81 N -4.53 0.00 -0.11 -2.05 8.00 -0.81 -3.28 116.55 113.77 3a8t n ASP 81 Ca 0.15 -0.84 0.14 0.00 0.71 0.00 0.00 54.79 54.95 3a8t n ASP 81 Cb 0.43 -0.04 0.60 0.00 -0.02 0.00 0.00 41.12 42.10 3a8t n ASP 81 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 3a8t n ARG 82 N -1.04 0.66 -1.94 -1.24 1.74 -0.17 -4.93 116.66 109.74 3a8t n ARG 82 Ca 0.22 -0.23 -0.20 0.00 -0.77 0.00 0.00 57.85 56.87 3a8t n ARG 82 Cb 0.12 -1.50 -0.05 0.00 -1.02 0.00 0.00 32.46 30.01 3a8t n ARG 82 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3a8t n GLY 83 N 1.29 0.80 1.85 -0.13 0.00 -1.20 -0.28 105.19 107.52 3a8t n GLY 83 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 3a8t n GLY 83 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a8t n GLY 84 N -0.64 0.74 3.75 -0.02 0.00 -1.26 -5.01 105.19 102.76 3a8t n GLY 84 Ca -0.21 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.40 3a8t n GLY 84 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3a8t s VAL 85 N -2.71 3.46 0.05 1.61 1.01 0.62 -4.99 120.40 119.45 3a8t s VAL 85 Ca 0.00 1.40 -0.30 0.00 0.00 0.00 0.00 61.98 63.07 3a8t s VAL 85 Cb 0.00 -3.89 -0.05 0.00 0.00 0.00 0.00 36.38 32.44 3a8t s VAL 85 CO 0.00 0.30 1.12 -2.84 0.00 0.00 0.00 175.10 173.69 3a8t s PRO 86 N -1.15 4.49 0.08 2.72 0.02 -1.26 -4.92 135.00 134.97 3a8t s PRO 86 Ca 0.47 1.66 0.08 0.00 0.02 0.00 0.00 61.00 63.23 3a8t s PRO 86 Cb -0.33 -3.37 -0.04 0.00 0.02 0.00 0.00 34.50 30.78 3a8t s PRO 86 CO 0.41 -0.16 -0.17 -1.01 -0.33 0.00 0.00 177.00 175.74 3a8t s HIS 87 N 0.91 2.58 0.11 6.54 3.76 -1.26 -1.05 115.29 126.89 3a8t s HIS 87 Ca 0.56 -0.24 0.07 0.00 -0.15 0.00 0.00 55.06 55.30 3a8t s HIS 87 Cb -0.27 -1.41 -0.03 0.00 1.11 0.00 0.00 32.58 31.98 3a8t s HIS 87 CO 0.29 0.34 -0.17 -1.01 -0.85 0.00 0.00 174.74 173.34 3a8t s HIS 88 N -1.06 1.53 -1.64 1.40 3.76 0.14 -4.76 115.29 114.66 3a8t s HIS 88 Ca 0.17 -0.47 -0.02 0.00 -0.15 0.00 0.00 55.06 54.59 3a8t s HIS 88 Cb -0.11 -0.83 0.00 0.00 1.11 0.00 0.00 32.58 32.76 3a8t s HIS 88 CO 0.09 0.16 0.28 1.28 -0.85 0.00 0.00 174.74 175.70 3a8t n LEU 89 N 0.92 -2.28 -3.95 0.89 7.99 -1.26 -0.96 117.00 118.35 3a8t n LEU 89 Ca -0.18 -0.14 -0.31 0.00 -0.01 0.00 0.00 56.01 55.37 3a8t n LEU 89 Cb 0.55 -2.90 -0.15 0.00 -0.11 0.00 0.00 43.42 40.81 3a8t n LEU 89 CO 0.24 -0.01 -0.36 -0.22 -1.51 0.00 0.00 177.39 175.53 3a8t s LEU 90 N -6.15 3.66 -0.99 2.23 2.96 -1.26 -4.20 118.68 114.93 3a8t s LEU 90 Ca 0.14 -1.77 -0.04 0.00 -0.22 0.00 0.00 54.13 52.24 3a8t s LEU 90 Cb -0.06 -1.37 0.00 0.00 0.50 0.00 0.00 46.19 45.26 3a8t s LEU 90 CO 0.17 -0.34 0.51 0.61 -1.32 0.00 0.00 176.35 175.98 3a8t n GLY 91 N 4.48 -0.09 0.00 7.98 0.00 0.21 -4.92 105.19 112.84 3a8t n GLY 91 Ca -0.02 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.84 3a8t n GLY 91 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3a8t n GLU 92 N -3.05 1.21 -3.35 1.61 1.02 -0.70 -3.78 120.64 113.59 3a8t n GLU 92 Ca -0.05 -0.35 -0.38 0.00 -0.02 0.00 0.00 57.16 56.35 3a8t n GLU 92 Cb 0.57 -0.85 -0.06 0.00 -0.02 0.00 0.00 31.44 31.08 3a8t n GLU 92 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 3a8t s VAL 93 N -0.27 5.12 -0.48 2.62 1.01 -0.40 -4.81 120.40 123.18 3a8t s VAL 93 Ca 0.00 0.95 -0.28 0.00 0.00 0.00 0.00 61.98 62.64 3a8t s VAL 93 Cb 0.00 -3.80 0.03 0.00 0.00 0.00 0.00 36.38 32.61 3a8t s VAL 93 CO 0.00 0.40 1.11 -0.62 0.00 0.00 0.00 175.10 175.99 3a8t s ASP 94 N 0.12 6.61 0.43 3.32 -1.08 -1.26 -1.19 116.67 123.62 3a8t s ASP 94 Ca 0.26 0.40 0.24 0.00 -0.52 0.00 0.00 52.55 52.93 3a8t s ASP 94 Cb -0.16 -2.54 1.24 0.00 -1.46 0.00 0.00 42.92 40.01 3a8t s ASP 94 CO 0.12 -1.24 1.76 1.55 0.52 0.00 0.00 175.17 177.87 3a8t h PRO 95 N 9.23 0.26 -0.94 4.34 0.13 -1.87 0.92 132.00 144.06 3a8t h PRO 95 Ca -0.23 -0.02 0.19 0.00 -0.87 0.00 0.00 66.00 65.07 3a8t h PRO 95 Cb 1.06 -0.06 -0.08 0.00 0.13 0.00 0.00 31.00 32.05 3a8t h PRO 95 CO 1.12 0.17 0.60 0.00 -0.23 0.00 0.00 178.00 179.66 3a8t h ALA 96 N 1.57 1.95 0.00 -0.56 0.00 -1.96 -1.60 119.26 118.66 3a8t h ALA 96 Ca 0.62 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.57 3a8t h ALA 96 Cb 1.81 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.53 3a8t h ALA 96 CO -0.25 -0.26 0.00 0.54 0.00 0.00 0.00 179.25 179.28 3a8t n ARG 97 N -4.60 0.66 0.00 0.00 1.74 0.32 -5.00 116.66 109.78 3a8t n ARG 97 Ca 0.20 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 57.28 3a8t n ARG 97 Cb 0.61 -1.06 0.00 0.00 -1.02 0.00 0.00 32.46 31.00 3a8t n ARG 97 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 3a8t n GLY 98 N 0.18 -1.82 3.77 -0.13 0.00 -0.60 -4.96 105.19 101.62 3a8t n GLY 98 Ca 0.02 -1.79 -0.38 0.00 0.00 0.00 0.00 46.02 43.86 3a8t n GLY 98 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3a8t s GLU 99 N 0.00 4.54 -0.56 1.61 2.12 -1.26 -4.80 118.70 120.34 3a8t s GLU 99 Ca 0.00 1.56 -0.23 0.00 0.36 0.00 0.00 54.97 56.66 3a8t s GLU 99 Cb 0.00 -2.94 0.05 0.00 0.26 0.00 0.00 34.13 31.50 3a8t s GLU 99 CO 0.00 0.19 0.89 -1.17 -0.54 0.00 0.00 175.26 174.63 3a8t s LEU 100 N -1.87 4.32 0.84 2.70 2.96 -1.26 -5.02 118.68 121.35 3a8t s LEU 100 Ca 0.49 -0.58 -0.11 0.00 -0.22 0.00 0.00 54.13 53.70 3a8t s LEU 100 Cb -0.25 -2.68 0.09 0.00 0.50 0.00 0.00 46.19 43.86 3a8t s LEU 100 CO 0.32 -1.21 1.09 0.42 -1.32 0.00 0.00 176.35 175.65 3a8t s THR 101 N 3.72 2.98 0.52 3.68 -4.23 -1.26 -4.80 115.64 116.25 3a8t s THR 101 Ca 0.26 0.32 0.21 0.00 -1.18 0.00 0.00 61.69 61.30 3a8t s THR 101 Cb -0.15 -2.82 0.28 0.00 1.34 0.00 0.00 72.50 71.16 3a8t s THR 101 CO 0.16 -0.41 2.15 -0.65 -0.54 0.00 0.00 174.62 175.32 3a8t h PRO 102 N -1.34 0.00 -0.01 3.99 0.11 -1.95 -0.30 132.00 132.50 3a8t h PRO 102 Ca -0.47 0.00 -0.24 0.00 0.11 0.00 0.00 66.00 65.40 3a8t h PRO 102 Cb 1.26 0.00 0.01 0.00 0.11 0.00 0.00 31.00 32.38 3a8t h PRO 102 CO 0.53 0.05 -0.96 0.00 -0.21 0.00 0.00 178.00 177.41 3a8t h ALA 103 N 1.95 0.29 -0.60 -0.75 0.00 -1.94 -1.60 119.26 116.61 3a8t h ALA 103 Ca -0.00 -0.70 -0.01 0.00 0.00 0.00 0.00 54.91 54.20 3a8t h ALA 103 Cb 0.10 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 3a8t h ALA 103 CO 0.01 0.76 0.32 -0.44 0.00 0.00 0.00 179.25 179.90 3a8t h ASP 104 N 0.31 0.76 -0.16 0.00 3.32 -1.55 -2.63 116.42 116.46 3a8t h ASP 104 Ca -0.09 -0.10 -0.00 0.00 0.02 0.00 0.00 57.03 56.85 3a8t h ASP 104 Cb 1.60 -0.19 -0.01 0.00 0.22 0.00 0.00 39.33 40.95 3a8t h ASP 104 CO 0.18 0.65 0.09 0.15 -1.72 0.00 0.00 179.24 178.59 3a8t h PHE 105 N 0.82 0.22 -0.74 4.55 3.57 -1.03 -1.07 116.94 123.26 3a8t h PHE 105 Ca 0.21 -0.00 0.12 0.00 3.53 0.00 0.00 57.97 61.83 3a8t h PHE 105 Cb 0.06 -0.07 -0.09 0.00 2.79 0.00 0.00 35.95 38.65 3a8t h PHE 105 CO -0.01 0.20 0.32 -0.09 -2.23 0.00 0.00 178.31 176.51 3a8t h ARG 106 N 0.17 0.48 0.56 1.11 2.43 -1.15 0.20 114.38 118.18 3a8t h ARG 106 Ca 0.06 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.17 3a8t h ARG 106 Cb 0.06 -0.11 0.01 0.00 -0.42 0.00 0.00 29.97 29.50 3a8t h ARG 106 CO -0.01 0.32 -0.27 1.03 -1.51 0.00 0.00 179.97 179.53 3a8t h SER 107 N 0.50 -0.64 -0.33 -3.80 0.87 -1.16 -0.85 113.55 108.15 3a8t h SER 107 Ca 0.39 -0.05 0.05 0.00 -1.23 0.00 0.00 61.79 60.96 3a8t h SER 107 Cb 0.53 0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 62.61 3a8t h SER 107 CO -0.35 -0.28 0.05 -0.07 -0.53 0.00 0.00 176.83 175.64 3a8t h LEU 108 N -1.03 -0.03 -0.44 2.23 3.38 -0.99 -2.58 115.31 115.86 3a8t h LEU 108 Ca -0.08 0.06 -0.18 0.00 0.09 0.00 0.00 57.88 57.77 3a8t h LEU 108 Cb 0.64 0.09 -0.01 0.00 0.09 0.00 0.00 40.66 41.47 3a8t h LEU 108 CO 0.13 0.02 -0.71 0.00 0.09 0.00 0.00 178.44 177.97 3a8t h ALA 109 N 1.25 0.63 -0.54 1.53 0.00 -0.67 -2.76 119.26 118.70 3a8t h ALA 109 Ca 0.16 -0.60 -0.02 0.00 0.00 0.00 0.00 54.91 54.44 3a8t h ALA 109 Cb 0.18 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 3a8t h ALA 109 CO -0.22 0.76 0.24 0.78 0.00 0.00 0.00 179.25 180.81 3a8t h GLY 110 N 1.31 0.82 0.90 0.00 0.00 -1.12 0.17 103.07 105.16 3a8t h GLY 110 Ca -0.03 -0.39 -0.00 0.00 0.00 0.00 0.00 47.33 46.91 3a8t h GLY 110 CO 0.12 0.37 -0.01 0.50 0.00 0.00 0.00 176.54 177.52 3a8t h LYS 111 N 0.76 -0.03 -0.75 4.80 1.57 -1.28 -2.05 116.57 119.60 3a8t h LYS 111 Ca 0.19 0.00 -0.01 0.00 -1.87 0.00 0.00 60.65 58.96 3a8t h LYS 111 Cb 0.11 0.01 -0.04 0.00 0.08 0.00 0.00 32.23 32.39 3a8t h LYS 111 CO -0.02 0.08 0.44 0.00 -0.57 0.00 0.00 179.45 179.38 3a8t h ALA 112 N 0.85 1.37 -0.57 3.86 0.00 -1.20 0.11 119.26 123.67 3a8t h ALA 112 Ca -0.00 -0.09 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 3a8t h ALA 112 Cb 0.12 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.58 3a8t h ALA 112 CO 0.01 0.54 0.29 0.28 0.00 0.00 0.00 179.25 180.36 3a8t h VAL 113 N 1.03 1.20 -0.58 0.00 2.07 -0.41 -1.67 116.25 117.89 3a8t h VAL 113 Ca 0.27 -0.55 -0.09 0.00 0.82 0.00 0.00 66.70 67.15 3a8t h VAL 113 Cb -0.03 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 3a8t h VAL 113 CO -0.05 0.22 0.02 -1.28 0.02 0.00 0.00 177.57 176.51 3a8t h SER 114 N 0.77 0.96 -0.38 0.57 0.87 -0.61 -2.69 113.55 113.04 3a8t h SER 114 Ca 0.20 -0.25 -0.15 0.00 -1.23 0.00 0.00 61.79 60.35 3a8t h SER 114 Cb 0.10 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.79 3a8t h SER 114 CO -0.03 1.01 -0.35 -0.33 -0.53 0.00 0.00 176.83 176.60 3a8t h GLU 115 N 0.92 0.92 -0.23 2.24 5.08 -0.56 -2.23 114.58 120.71 3a8t h GLU 115 Ca 0.17 -0.47 -0.03 0.00 -1.00 0.00 0.00 59.36 58.03 3a8t h GLU 115 Cb 0.50 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.76 3a8t h GLU 115 CO 0.02 1.13 0.05 0.82 -1.00 0.00 0.00 179.01 180.02 3a8t h ILE 116 N 0.73 1.22 -0.74 3.13 2.04 -1.21 -2.06 117.51 120.62 3a8t h ILE 116 Ca 0.07 -0.73 0.00 0.00 1.00 0.00 0.00 64.86 65.20 3a8t h ILE 116 Cb 0.94 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.24 3a8t h ILE 116 CO 0.09 0.23 0.47 0.74 0.00 0.00 0.00 178.15 179.68 3a8t h THR 117 N 0.19 1.20 -0.57 -0.27 2.02 -1.53 -1.20 112.91 112.75 3a8t h THR 117 Ca 0.07 -0.40 0.07 0.00 0.77 0.00 0.00 66.41 66.92 3a8t h THR 117 Cb 0.31 0.13 -0.06 0.00 -1.74 0.00 0.00 68.15 66.79 3a8t h THR 117 CO 0.00 0.20 0.25 1.23 0.37 0.00 0.00 175.52 177.58 3a8t h GLY 118 N 1.02 0.80 -0.37 2.16 0.00 -0.75 0.19 103.07 106.12 3a8t h GLY 118 Ca 0.27 -0.16 0.00 0.00 0.00 0.00 0.00 47.33 47.44 3a8t h GLY 118 CO -0.05 0.06 0.00 0.54 0.00 0.00 0.00 176.54 177.08 3a8t n ARG 119 N -4.93 0.97 -1.99 4.80 1.74 -0.51 -4.86 116.66 111.88 3a8t n ARG 119 Ca 0.07 0.00 -0.18 0.00 -0.77 0.00 0.00 57.85 56.97 3a8t n ARG 119 Cb 0.20 -1.18 -0.04 0.00 -1.02 0.00 0.00 32.46 30.42 3a8t n ARG 119 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 3a8t n ARG 120 N -0.31 -1.37 -4.26 5.56 1.74 0.66 -5.02 116.66 113.67 3a8t n ARG 120 Ca 0.00 0.99 -0.25 0.00 -0.77 0.00 0.00 57.85 57.82 3a8t n ARG 120 Cb 0.09 -5.40 -0.08 0.00 -1.02 0.00 0.00 32.46 26.05 3a8t n ARG 120 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 3a8t s LYS 121 N -4.31 2.27 -0.05 5.56 1.02 -0.84 -4.99 119.74 118.39 3a8t s LYS 121 Ca 0.00 -1.25 -0.30 0.00 0.02 0.00 0.00 55.97 54.44 3a8t s LYS 121 Cb 0.00 -2.24 -0.03 0.00 -0.52 0.00 0.00 37.83 35.05 3a8t s LYS 121 CO 0.00 0.42 1.09 -1.17 -0.92 0.00 0.00 175.35 174.77 3a8t s LEU 122 N -3.14 4.29 0.22 3.17 2.96 -0.67 -3.61 118.68 121.90 3a8t s LEU 122 Ca 0.28 1.70 -0.29 0.00 -0.22 0.00 0.00 54.13 55.60 3a8t s LEU 122 Cb -0.08 -3.56 -0.09 0.00 0.50 0.00 0.00 46.19 42.96 3a8t s LEU 122 CO 0.18 -0.46 0.92 -2.16 -1.32 0.00 0.00 176.35 173.51 3a8t s PRO 123 N 1.77 4.81 -0.18 0.98 0.04 -1.26 -1.95 135.00 139.21 3a8t s PRO 123 Ca 0.53 1.45 -0.00 0.00 0.04 0.00 0.00 61.00 63.01 3a8t s PRO 123 Cb -0.22 -3.29 0.04 0.00 0.04 0.00 0.00 34.50 31.07 3a8t s PRO 123 CO 0.22 0.49 -0.05 0.08 0.04 0.00 0.00 177.00 177.78 3a8t s VAL 124 N -1.04 1.17 -0.36 -0.36 1.01 -0.53 -1.62 120.40 118.65 3a8t s VAL 124 Ca 0.41 -0.72 -0.28 0.00 0.00 0.00 0.00 61.98 61.38 3a8t s VAL 124 Cb -0.25 -1.36 0.02 0.00 0.00 0.00 0.00 36.38 34.78 3a8t s VAL 124 CO 0.31 0.09 1.05 -0.22 0.00 0.00 0.00 175.10 176.33 3a8t s LEU 125 N 1.60 3.88 -0.22 3.92 2.96 0.12 -1.09 118.68 129.85 3a8t s LEU 125 Ca -0.00 0.81 0.02 0.00 -0.22 0.00 0.00 54.13 54.74 3a8t s LEU 125 Cb -0.16 -3.47 0.04 0.00 0.50 0.00 0.00 46.19 43.10 3a8t s LEU 125 CO -0.08 -0.95 -0.15 -0.69 -1.32 0.00 0.00 176.35 173.16 3a8t s VAL 126 N 3.78 2.12 0.00 1.68 1.01 0.31 -0.32 120.40 128.97 3a8t s VAL 126 Ca 0.44 -1.29 0.00 0.00 0.00 0.00 0.00 61.98 61.13 3a8t s VAL 126 Cb -0.11 -2.07 0.00 0.00 0.00 0.00 0.00 36.38 34.20 3a8t s VAL 126 CO 0.20 0.25 0.00 0.61 0.00 0.00 0.00 175.10 176.16 3a8t n GLY 127 N 4.52 1.09 0.10 4.51 0.00 -1.17 -0.68 105.19 113.57 3a8t n GLY 127 Ca -0.17 -1.19 0.06 0.00 0.00 0.00 0.00 46.02 44.72 3a8t n GLY 127 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3a8t n GLY 128 N -1.02 4.06 3.41 -0.02 0.00 -1.26 -4.50 105.19 105.87 3a8t n GLY 128 Ca 0.00 -0.68 -0.44 0.00 0.00 0.00 0.00 46.02 44.90 3a8t n GLY 128 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 3a8t s SER 129 N -2.06 6.33 0.59 1.61 0.01 -1.12 -4.86 113.70 114.20 3a8t s SER 129 Ca 0.20 -1.56 0.29 0.00 1.31 0.00 0.00 55.95 56.20 3a8t s SER 129 Cb 0.17 -2.35 1.73 0.00 0.21 0.00 0.00 66.02 65.78 3a8t s SER 129 CO 0.03 -1.15 2.16 0.78 0.41 0.00 0.00 173.24 175.47 3a8t h ASN 130 N 9.10 0.00 0.28 2.44 2.35 -1.91 0.25 115.58 128.10 3a8t h ASN 130 Ca -0.16 0.00 -0.12 0.00 -0.55 0.00 0.00 56.30 55.47 3a8t h ASN 130 Cb 1.06 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 39.42 3a8t h ASN 130 CO 1.10 0.00 -0.49 0.77 -1.65 0.00 0.00 177.43 177.16 3a8t h SER 131 N 0.00 0.26 0.24 5.81 4.64 -1.95 -1.01 113.55 121.55 3a8t h SER 131 Ca 0.05 -0.12 -0.32 0.00 -0.47 0.00 0.00 61.79 60.93 3a8t h SER 131 Cb 0.29 -0.07 0.04 0.00 -0.31 0.00 0.00 62.40 62.34 3a8t h SER 131 CO -0.00 0.71 -1.40 -0.26 -0.87 0.00 0.00 176.83 175.01 3a8t h PHE 132 N 0.19 0.92 -0.29 4.77 -1.00 -0.90 -2.38 116.94 118.26 3a8t h PHE 132 Ca 0.01 -0.67 0.00 0.00 2.81 0.00 0.00 57.97 60.12 3a8t h PHE 132 Cb 0.93 -0.04 -0.01 0.00 3.61 0.00 0.00 35.95 40.44 3a8t h PHE 132 CO 0.02 1.53 0.18 0.82 -1.61 0.00 0.00 178.31 179.26 3a8t h ILE 133 N 0.07 1.09 -0.09 -0.55 2.04 -0.97 -2.21 117.51 116.88 3a8t h ILE 133 Ca -0.25 -0.19 -0.01 0.00 1.00 0.00 0.00 64.86 65.42 3a8t h ILE 133 Cb 2.09 0.69 -0.00 0.00 -0.74 0.00 0.00 36.82 38.86 3a8t h ILE 133 CO 0.26 0.09 0.02 -0.74 0.00 0.00 0.00 178.15 177.77 3a8t h HIS 134 N 0.38 0.15 -0.63 1.37 -0.00 -1.28 -1.70 115.15 113.45 3a8t h HIS 134 Ca 0.11 -0.02 0.11 0.00 -0.00 0.00 0.00 60.37 60.57 3a8t h HIS 134 Cb -0.02 -0.04 -0.08 0.00 -0.00 0.00 0.00 27.41 27.27 3a8t h HIS 134 CO -0.05 0.33 0.21 0.00 -0.00 0.00 0.00 177.93 178.42 3a8t h ALA 135 N 0.81 0.81 -0.34 5.26 0.00 -1.38 -2.34 119.26 122.09 3a8t h ALA 135 Ca 0.03 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.96 3a8t h ALA 135 Cb 0.25 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 3a8t h ALA 135 CO 0.00 -0.23 -0.12 1.25 0.00 0.00 0.00 179.25 180.15 3a8t h LEU 136 N 0.37 0.69 -0.13 0.00 5.85 -1.31 -3.36 115.31 117.43 3a8t h LEU 136 Ca 0.33 -0.39 -0.20 0.00 0.84 0.00 0.00 57.88 58.46 3a8t h LEU 136 Cb 0.45 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.27 3a8t h LEU 136 CO -0.35 0.92 -0.94 -0.07 -0.34 0.00 0.00 178.44 177.65 3a8t h LEU 137 N 0.46 0.02-10.28 2.25 3.38 -0.96 -3.47 115.31 106.71 3a8t h LEU 137 Ca 0.08 -0.02 -0.51 0.00 0.09 0.00 0.00 57.88 57.52 3a8t h LEU 137 Cb 0.64 -0.01 0.17 0.00 0.09 0.00 0.00 40.66 41.56 3a8t h LEU 137 CO 0.04 0.95 0.24 0.68 0.09 0.00 0.00 178.44 180.44 3a8t s VAL 138 N -2.87 2.48 0.04 1.22 -7.23 -0.91 0.07 120.40 113.20 3a8t s VAL 138 Ca 0.00 0.16 -0.18 0.00 -1.81 0.00 0.00 61.98 60.15 3a8t s VAL 138 Cb 0.10 -2.36 -0.17 0.00 0.56 0.00 0.00 36.38 34.51 3a8t s VAL 138 CO 0.81 -0.21 1.24 -0.78 -0.31 0.00 0.00 175.10 175.86 3a8t h ASP 139 N -1.69 0.58 -3.21 4.85 1.82 -0.70 -3.37 116.42 114.70 3a8t h ASP 139 Ca -0.45 -0.62 -0.55 0.00 -0.39 0.00 0.00 57.03 55.02 3a8t h ASP 139 Cb 1.26 -0.17 -0.36 0.00 0.68 0.00 0.00 39.33 40.75 3a8t h ASP 139 CO 0.46 1.10 -0.81 -0.13 -1.61 0.00 0.00 179.24 178.25 3a8t s ARG 140 N -3.75 1.76 -0.05 0.28 0.52 -1.26 -4.96 118.95 111.50 3a8t s ARG 140 Ca -0.13 -0.36 -0.23 0.00 -0.52 0.00 0.00 55.73 54.48 3a8t s ARG 140 Cb 0.05 -1.69 -0.04 0.00 0.52 0.00 0.00 34.95 33.79 3a8t s ARG 140 CO 0.81 -0.20 0.70 0.12 0.02 0.00 0.00 175.30 176.75 3a8t s PHE 141 N 1.46 3.60 -1.03 -0.53 5.36 -1.26 -4.96 117.98 120.62 3a8t s PHE 141 Ca 0.01 1.28 -0.19 0.00 -0.96 0.00 0.00 56.93 57.07 3a8t s PHE 141 Cb -0.13 -2.80 0.11 0.00 -0.34 0.00 0.00 43.02 39.87 3a8t s PHE 141 CO -0.07 0.13 1.31 0.34 -1.46 0.00 0.00 175.22 175.47 3a8t s ASP 142 N 0.63 6.70 0.07 6.13 -1.08 -1.26 -4.87 116.67 122.99 3a8t s ASP 142 Ca 0.37 -2.12 -0.16 0.00 -0.52 0.00 0.00 52.55 50.13 3a8t s ASP 142 Cb -0.18 -2.45 -0.05 0.00 -1.46 0.00 0.00 42.92 38.78 3a8t s ASP 142 CO 0.19 -1.12 1.26 0.28 0.52 0.00 0.00 175.17 176.30 3a8t h SER 143 N 8.64 -0.96 -0.87 -0.34 0.02 -1.99 0.39 113.55 118.44 3a8t h SER 143 Ca 0.22 0.13 -0.51 0.00 -0.84 0.00 0.00 61.79 60.79 3a8t h SER 143 Cb 0.98 0.41 -0.21 0.00 0.14 0.00 0.00 62.40 63.72 3a8t h SER 143 CO 1.24 -0.16 0.63 -1.54 -1.14 0.00 0.00 176.83 175.86 3a8t n SER 144 N -4.03 7.01 -0.13 3.07 3.41 -1.26 -4.65 113.62 117.03 3a8t n SER 144 Ca -0.01 -3.41 -0.08 0.00 -0.26 0.00 0.00 58.87 55.11 3a8t n SER 144 Cb 0.15 -1.05 -0.06 0.00 -0.26 0.00 0.00 64.21 62.98 3a8t n SER 144 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 3a8t h GLY 145 N 2.56 -1.42 -1.11 5.00 0.00 -1.30 -3.56 103.07 103.24 3a8t h GLY 145 Ca 0.44 0.81 0.00 0.00 0.00 0.00 0.00 47.33 48.58 3a8t h GLY 145 CO 1.13 -0.36 0.00 -1.55 0.00 0.00 0.00 176.54 175.76 3a8t n PRO 146 N -4.36 1.56 0.00 4.80 -0.04 -1.26 -5.14 135.00 130.57 3a8t n PRO 146 Ca -0.01 -0.54 0.00 0.00 -0.04 0.00 0.00 63.50 62.91 3a8t n PRO 146 Cb 0.20 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.22 3a8t n PRO 146 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 3a8t n GLU 160 N 0.03 0.00 -3.53 0.54 2.13 -1.26 -5.11 120.64 113.44 3a8t n GLU 160 Ca 0.05 0.00 -0.38 0.00 0.66 0.00 0.00 57.16 57.49 3a8t n GLU 160 Cb 0.31 0.00 -0.06 0.00 0.27 0.00 0.00 31.44 31.96 3a8t n GLU 160 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3a8t s LEU 161 N 0.00 4.47 0.28 4.31 1.43 -1.26 0.02 118.68 127.92 3a8t s LEU 161 Ca 0.00 0.92 0.03 0.00 -1.03 0.00 0.00 54.13 54.05 3a8t s LEU 161 Cb 0.00 -2.54 0.39 0.00 0.03 0.00 0.00 46.19 44.07 3a8t s LEU 161 CO 0.00 0.33 1.69 -0.09 0.23 0.00 0.00 176.35 178.51 3a8t h ARG 162 N 4.75 0.41 -5.41 1.70 2.43 -0.53 -3.44 114.38 114.29 3a8t h ARG 162 Ca -0.52 -0.18 -0.65 0.00 -0.81 0.00 0.00 59.98 57.82 3a8t h ARG 162 Cb 1.22 -0.01 -0.11 0.00 -0.42 0.00 0.00 29.97 30.65 3a8t h ARG 162 CO 0.61 0.70 -0.46 0.71 -1.51 0.00 0.00 179.97 180.02 3a8t s TYR 163 N -4.32 1.83 -0.70 2.20 2.02 -1.26 -4.70 117.35 112.43 3a8t s TYR 163 Ca -0.06 -0.91 -0.16 0.00 -0.37 0.00 0.00 57.07 55.57 3a8t s TYR 163 Cb 0.13 -1.70 0.16 0.00 -0.40 0.00 0.00 41.96 40.15 3a8t s TYR 163 CO 0.79 0.05 0.70 0.34 -1.57 0.00 0.00 175.55 175.86 3a8t s ASP 164 N -3.98 6.45 0.14 2.29 2.15 0.07 -4.98 116.67 118.83 3a8t s ASP 164 Ca 0.14 -2.11 -0.07 0.00 0.43 0.00 0.00 52.55 50.95 3a8t s ASP 164 Cb 0.01 -2.24 -0.06 0.00 -0.30 0.00 0.00 42.92 40.33 3a8t s ASP 164 CO 0.08 -0.81 0.42 0.00 -0.17 0.00 0.00 175.17 174.69 3a8t s PHE 167 N 0.85 3.12 -0.21 0.00 0.08 -1.26 0.18 117.98 120.73 3a8t s PHE 167 Ca -0.09 -1.30 -0.08 0.00 0.12 0.00 0.00 56.93 55.57 3a8t s PHE 167 Cb -0.15 -2.15 -0.04 0.00 -0.57 0.00 0.00 43.02 40.10 3a8t s PHE 167 CO 0.01 -0.66 0.10 -0.51 -0.10 0.00 0.00 175.22 174.05 3a8t s LEU 168 N 1.40 3.84 -0.26 -0.37 1.43 0.54 -1.23 118.68 124.03 3a8t s LEU 168 Ca 0.01 0.04 -0.02 0.00 -1.03 0.00 0.00 54.13 53.13 3a8t s LEU 168 Cb -0.17 -2.00 0.03 0.00 0.03 0.00 0.00 46.19 44.08 3a8t s LEU 168 CO -0.01 0.10 -0.04 0.86 0.23 0.00 0.00 176.35 177.49 3a8t s TRP 169 N 0.82 3.12 -0.36 0.29 -0.00 -0.34 0.25 118.94 122.73 3a8t s TRP 169 Ca 0.05 -1.61 -0.21 0.00 -0.00 0.00 0.00 56.10 54.33 3a8t s TRP 169 Cb -0.13 -2.08 0.00 0.00 -0.00 0.00 0.00 33.47 31.26 3a8t s TRP 169 CO 0.02 -0.74 0.68 0.08 -0.00 0.00 0.00 176.95 176.99 3a8t s VAL 170 N 1.31 4.85 0.06 5.86 1.01 0.27 0.49 120.40 134.25 3a8t s VAL 170 Ca -0.01 0.67 0.05 0.00 0.00 0.00 0.00 61.98 62.69 3a8t s VAL 170 Cb -0.17 -4.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 3a8t s VAL 170 CO -0.03 -0.35 -0.06 -0.62 0.00 0.00 0.00 175.10 174.04 3a8t s ASP 171 N 1.80 4.64 -0.01 3.32 2.15 0.14 -4.49 116.67 124.24 3a8t s ASP 171 Ca 0.26 -0.24 0.01 0.00 0.43 0.00 0.00 52.55 53.02 3a8t s ASP 171 Cb -0.14 -1.02 0.00 0.00 -0.30 0.00 0.00 42.92 41.46 3a8t s ASP 171 CO 0.15 0.22 -0.03 -0.69 -0.17 0.00 0.00 175.17 174.65 3a8t s VAL 172 N -1.15 0.27 0.37 1.11 1.01 -1.26 -0.44 120.40 120.31 3a8t s VAL 172 Ca 0.21 -0.13 -0.28 0.00 0.00 0.00 0.00 61.98 61.78 3a8t s VAL 172 Cb -0.11 -0.25 -0.11 0.00 0.00 0.00 0.00 36.38 35.90 3a8t s VAL 172 CO 0.12 0.09 1.41 -1.20 0.00 0.00 0.00 175.10 175.53 3a8t n SER 173 N 3.13 3.40 -0.17 3.32 7.64 -1.26 -4.74 113.62 124.93 3a8t n SER 173 Ca -0.14 1.22 -0.05 0.00 1.01 0.00 0.00 58.87 60.90 3a8t n SER 173 Cb 0.58 -1.57 0.01 0.00 -1.01 0.00 0.00 64.21 62.21 3a8t n SER 173 CO 0.00 0.00 0.00 -0.37 -3.01 0.00 0.00 175.04 171.66 3a8t h VAL 174 N 2.77 0.22 -0.45 0.44 -1.51 -2.00 -0.21 116.25 115.51 3a8t h VAL 174 Ca -0.49 0.00 0.08 0.00 -1.23 0.00 0.00 66.70 65.06 3a8t h VAL 174 Cb 1.26 0.22 -0.07 0.00 -2.13 0.00 0.00 31.29 30.57 3a8t h VAL 174 CO 0.63 0.00 0.07 0.50 -1.23 0.00 0.00 177.57 177.54 3a8t h LYS 175 N -0.17 0.19 -0.72 5.19 1.63 -1.99 0.68 116.57 121.38 3a8t h LYS 175 Ca 0.22 -0.01 -0.05 0.00 -0.85 0.00 0.00 60.65 59.96 3a8t h LYS 175 Cb 0.53 -0.04 -0.03 0.00 -0.60 0.00 0.00 32.23 32.09 3a8t h LYS 175 CO -0.62 0.13 0.27 0.28 -3.45 0.00 0.00 179.45 176.05 3a8t h VAL 176 N 0.20 1.25 0.15 2.00 2.07 -1.72 -1.49 116.25 118.71 3a8t h VAL 176 Ca 0.22 -0.82 -0.01 0.00 0.82 0.00 0.00 66.70 66.92 3a8t h VAL 176 Cb 0.30 0.44 0.00 0.00 -1.52 0.00 0.00 31.29 30.51 3a8t h VAL 176 CO -0.31 0.32 -0.07 0.25 0.02 0.00 0.00 177.57 177.78 3a8t h LEU 177 N 1.04 -0.17 -0.30 2.57 5.85 0.06 0.21 115.31 124.56 3a8t h LEU 177 Ca 0.24 -0.10 0.06 0.00 0.84 0.00 0.00 57.88 58.91 3a8t h LEU 177 Cb 0.24 0.04 -0.08 0.00 0.37 0.00 0.00 40.66 41.23 3a8t h LEU 177 CO -0.02 -0.00 -0.44 0.74 -0.34 0.00 0.00 178.44 178.39 3a8t h THR 178 N -0.33 0.11 -0.92 1.05 2.02 0.43 0.31 112.91 115.58 3a8t h THR 178 Ca -0.02 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.17 3a8t h THR 178 Cb 0.26 0.11 -0.05 0.00 -1.74 0.00 0.00 68.15 66.74 3a8t h THR 178 CO 0.03 0.00 0.60 0.44 0.37 0.00 0.00 175.52 176.96 3a8t h ASP 179 N -0.39 1.07 -0.48 4.18 3.45 -1.07 -1.78 116.42 121.39 3a8t h ASP 179 Ca 0.11 -0.04 -0.11 0.00 0.43 0.00 0.00 57.03 57.43 3a8t h ASP 179 Cb 0.60 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 39.09 3a8t h ASP 179 CO -0.51 0.79 -0.12 0.22 -1.57 0.00 0.00 179.24 178.04 3a8t h TYR 180 N 1.26 1.05 -0.27 4.55 3.20 0.56 -1.72 116.97 125.59 3a8t h TYR 180 Ca 0.34 -0.23 -0.01 0.00 3.14 0.00 0.00 58.73 61.98 3a8t h TYR 180 Cb -0.13 -0.25 -0.01 0.00 1.54 0.00 0.00 36.73 37.87 3a8t h TYR 180 CO 0.00 1.01 0.14 -0.07 -1.64 0.00 0.00 178.16 177.60 3a8t h LEU 181 N 0.78 0.32 -0.06 2.82 4.07 -0.08 0.17 115.31 123.33 3a8t h LEU 181 Ca 0.12 -0.02 -0.13 0.00 0.08 0.00 0.00 57.88 57.93 3a8t h LEU 181 Cb 0.68 -0.08 0.01 0.00 1.08 0.00 0.00 40.66 42.34 3a8t h LEU 181 CO 0.05 0.26 -0.49 0.00 -1.08 0.00 0.00 178.44 177.18 3a8t h ALA 182 N 1.79 0.14 -0.58 1.53 0.00 -1.16 -2.40 119.26 118.58 3a8t h ALA 182 Ca 0.10 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.50 3a8t h ALA 182 Cb 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 17.78 3a8t h ALA 182 CO -0.02 0.32 0.38 -0.22 0.00 0.00 0.00 179.25 179.71 3a8t h LYS 183 N -0.04 0.77 -0.18 0.00 3.64 -0.49 -2.00 116.57 118.27 3a8t h LYS 183 Ca -0.04 -0.05 -0.00 0.00 -1.27 0.00 0.00 60.65 59.28 3a8t h LYS 183 Cb 1.16 -0.17 -0.01 0.00 -0.41 0.00 0.00 32.23 32.80 3a8t h LYS 183 CO 0.10 0.52 0.10 -0.09 -2.27 0.00 0.00 179.45 177.81 3a8t h ARG 184 N 0.79 0.25 -0.49 1.90 2.43 -0.66 0.88 114.38 119.48 3a8t h ARG 184 Ca 0.21 -0.02 -0.04 0.00 -0.81 0.00 0.00 59.98 59.32 3a8t h ARG 184 Cb -0.08 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 29.40 3a8t h ARG 184 CO -0.04 0.19 0.14 0.28 -1.51 0.00 0.00 179.97 179.02 3a8t h VAL 185 N 0.25 1.23 -0.67 0.20 2.07 -0.84 -1.09 116.25 117.40 3a8t h VAL 185 Ca 0.07 -0.80 0.03 0.00 0.82 0.00 0.00 66.70 66.81 3a8t h VAL 185 Cb 0.02 0.82 -0.04 0.00 -1.52 0.00 0.00 31.29 30.57 3a8t h VAL 185 CO -0.01 0.29 0.42 0.44 0.02 0.00 0.00 177.57 178.73 3a8t h ASP 186 N 0.67 0.69 -0.17 0.57 5.19 -0.48 -1.34 116.42 121.55 3a8t h ASP 186 Ca 0.16 0.00 -0.04 0.00 -0.62 0.00 0.00 57.03 56.52 3a8t h ASP 186 Cb 0.30 -0.15 -0.02 0.00 0.18 0.00 0.00 39.33 39.65 3a8t h ASP 186 CO -0.00 0.48 -0.01 0.44 -3.12 0.00 0.00 179.24 177.03 3a8t h ASP 187 N 0.82 0.39 -0.24 6.45 3.32 -0.71 -0.33 116.42 126.12 3a8t h ASP 187 Ca 0.27 -0.07 -0.13 0.00 0.02 0.00 0.00 57.03 57.12 3a8t h ASP 187 Cb 0.02 -0.10 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 3a8t h ASP 187 CO -0.11 0.47 -0.33 0.24 -1.72 0.00 0.00 179.24 177.80 3a8t h MET 188 N 0.41 0.76 -0.24 3.56 2.86 -0.48 -1.66 114.93 120.13 3a8t h MET 188 Ca 0.09 -0.36 -0.15 0.00 -2.06 0.00 0.00 59.70 57.22 3a8t h MET 188 Cb 0.29 -0.01 0.00 0.00 0.06 0.00 0.00 31.60 31.95 3a8t h MET 188 CO 0.01 0.98 -0.44 -0.07 1.06 0.00 0.00 176.91 178.44 3a8t h LEU 189 N 0.64 0.81 -1.66 1.22 -0.00 -0.86 0.25 115.31 115.70 3a8t h LEU 189 Ca 0.07 -0.53 -0.03 0.00 -0.00 0.00 0.00 57.88 57.38 3a8t h LEU 189 Cb 0.86 -0.23 -0.01 0.00 -0.00 0.00 0.00 40.66 41.28 3a8t h LEU 189 CO 0.08 1.19 -0.12 -0.08 -0.00 0.00 0.00 178.44 179.51 3a8t h GLU 190 N 0.46 0.06 0.00 1.13 4.81 -0.97 -1.61 114.58 118.45 3a8t h GLU 190 Ca 0.01 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 3a8t h GLU 190 Cb 1.04 -0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.41 3a8t h GLU 190 CO 0.10 0.19 0.00 1.25 -0.73 0.00 0.00 179.01 179.82 3a8t h LEU 191 N 0.06 0.00 0.00 1.64 5.85 -1.12 -3.47 115.31 118.28 3a8t h LEU 191 Ca 0.01 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.73 3a8t h LEU 191 Cb 0.25 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.28 3a8t h LEU 191 CO 0.02 0.00 0.00 0.61 -0.34 0.00 0.00 178.44 178.73 3a8t n GLY 192 N 1.18 1.79 0.36 3.75 0.00 -0.61 -5.02 105.19 106.64 3a8t n GLY 192 Ca 0.05 0.00 0.05 0.00 0.00 0.00 0.00 46.02 46.13 3a8t n GLY 192 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 3a8t h MET 193 N 0.00 0.99 -0.49 1.61 4.05 -0.61 -2.22 114.93 118.26 3a8t h MET 193 Ca 0.00 -0.06 -0.02 0.00 -0.28 0.00 0.00 59.70 59.34 3a8t h MET 193 Cb 0.00 -0.22 -0.02 0.00 -0.80 0.00 0.00 31.60 30.56 3a8t h MET 193 CO 0.00 0.65 0.23 0.35 0.23 0.00 0.00 176.91 178.38 3a8t h PHE 194 N 1.02 0.72 -0.05 1.39 3.57 -1.82 -1.07 116.94 120.70 3a8t h PHE 194 Ca 0.47 -0.04 -0.09 0.00 3.53 0.00 0.00 57.97 61.84 3a8t h PHE 194 Cb 0.39 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 3a8t h PHE 194 CO -0.01 0.57 -0.40 -0.44 -2.23 0.00 0.00 178.31 175.80 3a8t h ASP 195 N 0.65 0.11 -0.34 0.41 3.32 -1.89 0.13 116.42 118.81 3a8t h ASP 195 Ca 0.17 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 3a8t h ASP 195 Cb 0.13 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 3a8t h ASP 195 CO -0.02 0.50 0.01 -0.08 -1.72 0.00 0.00 179.24 177.93 3a8t h GLU 196 N 0.09 0.60 -0.09 3.56 4.81 -0.93 -2.04 114.58 120.57 3a8t h GLU 196 Ca 0.01 -0.19 -0.16 0.00 -0.13 0.00 0.00 59.36 58.89 3a8t h GLU 196 Cb 0.75 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.07 3a8t h GLU 196 CO 0.06 0.72 -0.64 -0.07 -0.73 0.00 0.00 179.01 178.34 3a8t h LEU 197 N 0.41 0.38 -1.13 1.64 3.38 -0.83 -1.16 115.31 118.00 3a8t h LEU 197 Ca 0.10 -0.23 -0.06 0.00 0.09 0.00 0.00 57.88 57.78 3a8t h LEU 197 Cb 0.44 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3a8t h LEU 197 CO 0.02 0.92 -0.07 0.00 0.09 0.00 0.00 178.44 179.39 3a8t h ALA 198 N 1.08 1.28 0.00 1.53 0.00 -0.58 -0.52 119.26 122.06 3a8t h ALA 198 Ca -0.01 -0.24 -0.16 0.00 0.00 0.00 0.00 54.91 54.50 3a8t h ALA 198 Cb 1.17 -0.14 -0.02 0.00 0.00 0.00 0.00 17.79 18.80 3a8t h ALA 198 CO 0.11 0.48 -0.76 1.49 0.00 0.00 0.00 179.25 180.56 3a8t h GLU 199 N 0.49 0.00 0.00 0.00 4.57 -1.11 -3.12 114.58 115.42 3a8t h GLU 199 Ca 0.10 0.00 -0.14 0.00 -1.18 0.00 0.00 59.36 58.14 3a8t h GLU 199 Cb 0.43 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.00 3a8t h GLU 199 CO 0.02 0.76 -0.66 0.35 -1.18 0.00 0.00 179.01 178.30 3a8t h PHE 200 N 0.00 0.00 -3.37 0.92 3.57 -0.77 -3.46 116.94 113.83 3a8t h PHE 200 Ca -0.01 0.00 -0.57 0.00 3.53 0.00 0.00 57.97 60.93 3a8t h PHE 200 Cb 1.49 0.00 0.11 0.00 2.79 0.00 0.00 35.95 40.34 3a8t h PHE 200 CO 0.00 0.66 0.51 0.98 -2.23 0.00 0.00 178.31 178.23 3a8t n TYR 201 N -3.60 2.27 -3.62 0.41 9.36 -0.24 -5.02 117.16 116.72 3a8t n TYR 201 Ca -0.00 0.54 -0.06 0.00 3.32 0.00 0.00 57.90 61.69 3a8t n TYR 201 Cb 0.68 -2.41 -0.08 0.00 -0.63 0.00 0.00 39.34 36.90 3a8t n TYR 201 CO 0.00 0.00 0.00 0.45 0.22 0.00 0.00 176.86 177.53 3a8t s SER 202 N -0.34 -0.47 0.00 2.98 0.15 -1.26 -5.02 113.70 109.74 3a8t s SER 202 Ca 0.56 1.08 0.06 0.00 0.70 0.00 0.00 55.95 58.35 3a8t s SER 202 Cb -0.56 1.59 0.29 0.00 -1.71 0.00 0.00 66.02 65.63 3a8t s SER 202 CO 0.62 -0.23 1.10 -2.65 1.20 0.00 0.00 173.24 173.27 3a8t n PRO 203 N 5.40 0.05 -0.00 5.44 -0.02 -1.26 -1.12 135.00 143.49 3a8t n PRO 203 Ca -0.09 0.29 0.14 0.00 -2.02 0.00 0.00 63.50 61.83 3a8t n PRO 203 Cb 0.49 -1.50 0.77 0.00 -0.02 0.00 0.00 33.50 33.24 3a8t n PRO 203 CO 0.00 0.00 0.00 -1.91 1.98 0.00 0.00 175.50 175.57 3a8t n GLU 204 N -1.37 1.19 -2.86 -0.52 2.13 -1.26 -4.81 120.64 113.15 3a8t n GLU 204 Ca 0.02 -0.28 -0.41 0.00 0.66 0.00 0.00 57.16 57.15 3a8t n GLU 204 Cb 0.06 -1.46 -0.05 0.00 0.27 0.00 0.00 31.44 30.26 3a8t n GLU 204 CO 0.00 0.00 0.00 -0.51 -0.41 0.00 0.00 177.13 176.21 3a8t s ASP 205 N -1.92 7.34 0.00 4.31 1.01 -0.28 -4.95 116.67 122.18 3a8t s ASP 205 Ca 0.42 1.60 0.21 0.00 0.71 0.00 0.00 52.55 55.49 3a8t s ASP 205 Cb 0.20 -2.52 0.54 0.00 1.01 0.00 0.00 42.92 42.15 3a8t s ASP 205 CO 0.34 -0.04 1.46 -0.62 0.21 0.00 0.00 175.17 176.51 3a8t n GLU 206 N 2.89 2.41 -0.36 8.23 1.02 -1.26 -4.39 120.64 129.18 3a8t n GLU 206 Ca 0.00 -2.17 0.07 0.00 -0.02 0.00 0.00 57.16 55.05 3a8t n GLU 206 Cb 0.50 -1.49 0.23 0.00 -0.02 0.00 0.00 31.44 30.66 3a8t n GLU 206 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 3a8t n ASP 207 N 1.29 3.60 0.14 1.62 5.68 -1.26 -4.76 116.55 122.86 3a8t n ASP 207 Ca 0.20 -2.59 0.16 0.00 -0.50 0.00 0.00 54.79 52.06 3a8t n ASP 207 Cb 0.53 -0.43 0.72 0.00 -1.14 0.00 0.00 41.12 40.81 3a8t n ASP 207 CO 0.00 0.00 0.00 0.45 -1.33 0.00 0.00 177.20 176.32 3a8t h HIS 208 N 2.06 0.00 -0.57 2.11 3.86 -1.98 -0.61 115.15 120.02 3a8t h HIS 208 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 3a8t h HIS 208 Cb 1.18 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.65 3a8t h HIS 208 CO 0.42 0.00 0.00 -0.40 0.86 0.00 0.00 177.93 178.81 3a8t n ASP 209 N -4.24 4.43 -4.33 2.45 5.68 -1.26 -4.45 116.55 114.83 3a8t n ASP 209 Ca 0.04 -2.47 -0.29 0.00 -0.50 0.00 0.00 54.79 51.57 3a8t n ASP 209 Cb 0.37 -0.57 -0.15 0.00 -1.14 0.00 0.00 41.12 39.64 3a8t n ASP 209 CO 0.00 0.00 0.00 -0.70 -1.33 0.00 0.00 177.20 175.17 3a8t s GLU 210 N -1.94 1.71 0.72 0.11 2.12 -0.24 -5.13 118.70 116.05 3a8t s GLU 210 Ca 0.46 -1.09 -0.13 0.00 0.36 0.00 0.00 54.97 54.57 3a8t s GLU 210 Cb 0.31 -1.89 0.03 0.00 0.26 0.00 0.00 34.13 32.83 3a8t s GLU 210 CO 0.20 0.49 1.10 0.34 -0.54 0.00 0.00 175.26 176.85 3a8t s ASP 211 N -1.26 4.79 0.34 -1.70 -1.08 -1.26 -4.85 116.67 111.65 3a8t s ASP 211 Ca 0.11 1.92 0.08 0.00 -0.52 0.00 0.00 52.55 54.14 3a8t s ASP 211 Cb -0.10 -2.54 0.80 0.00 -1.46 0.00 0.00 42.92 39.63 3a8t s ASP 211 CO 0.02 -1.84 1.83 0.28 0.52 0.00 0.00 175.17 175.98 3a8t h SER 212 N -0.55 0.70 -0.81 -0.34 0.02 -1.89 -2.74 113.55 107.94 3a8t h SER 212 Ca -0.45 0.06 0.18 0.00 -0.84 0.00 0.00 61.79 60.74 3a8t h SER 212 Cb 1.24 -0.07 -0.11 0.00 0.14 0.00 0.00 62.40 63.60 3a8t h SER 212 CO 0.53 0.30 0.29 0.00 -1.14 0.00 0.00 176.83 176.81 3a8t h ALA 213 N 1.61 1.17 -0.21 3.77 0.00 -1.92 -2.08 119.26 121.60 3a8t h ALA 213 Ca 0.51 0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.57 3a8t h ALA 213 Cb 0.85 0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.80 3a8t h ALA 213 CO -0.27 -0.30 0.00 0.25 0.00 0.00 0.00 179.25 178.92 3a8t n THR 214 N -5.07 0.61 -1.48 0.00 -2.24 -1.17 -5.00 114.28 99.93 3a8t n THR 214 Ca 0.17 -0.80 -0.29 0.00 -2.27 0.00 0.00 64.05 60.86 3a8t n THR 214 Cb 0.52 0.79 0.19 0.00 -2.10 0.00 0.00 70.33 69.73 3a8t n THR 214 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 3a8t s ARG 215 N -0.97 0.16 -0.06 -0.78 0.52 -0.78 -5.03 118.95 112.02 3a8t s ARG 215 Ca 0.19 -0.02 0.06 0.00 -0.52 0.00 0.00 55.73 55.44 3a8t s ARG 215 Cb 0.11 -1.75 -0.01 0.00 0.52 0.00 0.00 34.95 33.82 3a8t s ARG 215 CO 0.15 -2.80 -0.23 -0.08 0.02 0.00 0.00 175.30 172.35 3a8t s THR 216 N -3.34 1.94 0.00 0.02 -1.32 -1.26 -4.82 115.64 106.85 3a8t s THR 216 Ca 0.69 -1.00 0.00 0.00 -1.21 0.00 0.00 61.69 60.17 3a8t s THR 216 Cb -0.10 -1.64 0.00 0.00 -1.51 0.00 0.00 72.50 69.24 3a8t s THR 216 CO 0.54 0.54 0.00 0.61 -2.21 0.00 0.00 174.62 174.10 3a8t n GLY 217 N 3.03 1.92 0.38 6.08 0.00 -1.26 -2.97 105.19 112.36 3a8t n GLY 217 Ca -0.18 -0.54 0.20 0.00 0.00 0.00 0.00 46.02 45.49 3a8t n GLY 217 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 3a8t h LEU 218 N 0.00 0.00 0.00 0.99 5.85 -1.90 0.15 115.31 120.40 3a8t h LEU 218 Ca 0.00 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.72 3a8t h LEU 218 Cb 0.00 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.03 3a8t h LEU 218 CO 0.00 0.00 0.00 0.54 -0.34 0.00 0.00 178.44 178.64 3a8t n ARG 219 N -3.53 0.26 0.20 1.25 1.74 -1.16 -2.22 116.66 113.20 3a8t n ARG 219 Ca 0.06 0.11 0.12 0.00 -0.77 0.00 0.00 57.85 57.36 3a8t n ARG 219 Cb 0.62 -1.50 0.14 0.00 -1.02 0.00 0.00 32.46 30.70 3a8t n ARG 219 CO 0.00 0.00 0.00 0.87 -1.52 0.00 0.00 177.63 176.98 3a8t h LYS 220 N 0.00 0.00 -6.22 5.56 1.57 -0.85 -3.41 116.57 113.22 3a8t h LYS 220 Ca 0.00 0.00 -0.68 0.00 -1.87 0.00 0.00 60.65 58.10 3a8t h LYS 220 Cb 0.19 0.00 0.08 0.00 0.08 0.00 0.00 32.23 32.58 3a8t h LYS 220 CO 0.00 0.02 0.12 0.00 -0.57 0.00 0.00 179.45 179.02 3a8t n ALA 221 N -2.12 -1.65 -1.82 3.86 0.00 -0.94 -4.69 120.51 113.16 3a8t n ALA 221 Ca 0.03 0.49 -0.42 0.00 0.00 0.00 0.00 53.44 53.54 3a8t n ALA 221 Cb 0.54 -1.92 -0.02 0.00 0.00 0.00 0.00 19.45 18.05 3a8t n ALA 221 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 3a8t s ILE 222 N -0.25 2.29 0.00 0.00 -1.09 -1.26 -1.98 121.20 118.91 3a8t s ILE 222 Ca 0.76 0.23 0.00 0.00 -2.23 0.00 0.00 60.65 59.41 3a8t s ILE 222 Cb -0.95 -3.15 0.00 0.00 -1.58 0.00 0.00 42.46 36.78 3a8t s ILE 222 CO 0.53 0.03 0.00 0.61 -1.23 0.00 0.00 174.94 174.88 3a8t n GLY 223 N 2.94 2.60 0.09 6.18 0.00 -1.26 -4.90 105.19 110.85 3a8t n GLY 223 Ca 0.11 -0.86 -0.13 0.00 0.00 0.00 0.00 46.02 45.14 3a8t n GLY 223 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 3a8t h VAL 224 N 0.00 1.19 -0.52 1.61 2.07 -1.71 -1.96 116.25 116.93 3a8t h VAL 224 Ca 0.00 -1.02 -0.05 0.00 0.82 0.00 0.00 66.70 66.45 3a8t h VAL 224 Cb 0.00 1.84 -0.02 0.00 -1.52 0.00 0.00 31.29 31.58 3a8t h VAL 224 CO 0.00 0.25 0.12 -0.65 0.02 0.00 0.00 177.57 177.31 3a8t h PRO 225 N -0.57 0.80 0.05 1.57 0.11 -1.80 -1.78 132.00 130.38 3a8t h PRO 225 Ca -0.01 -0.16 -0.00 0.00 0.11 0.00 0.00 66.00 65.94 3a8t h PRO 225 Cb 0.48 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.47 3a8t h PRO 225 CO 0.02 0.73 -0.02 0.93 -0.21 0.00 0.00 178.00 179.44 3a8t h GLU 226 N 0.77 -0.07 0.00 1.05 3.07 -1.92 -2.65 114.58 114.83 3a8t h GLU 226 Ca 0.17 0.00 -0.08 0.00 -0.50 0.00 0.00 59.36 58.96 3a8t h GLU 226 Cb 0.29 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 28.21 3a8t h GLU 226 CO -0.00 0.13 -0.37 0.74 -1.40 0.00 0.00 179.01 178.12 3a8t h PHE 227 N -0.26 0.00 -0.73 4.33 0.04 -1.32 -2.74 116.94 116.27 3a8t h PHE 227 Ca -0.01 0.00 0.03 0.00 2.80 0.00 0.00 57.97 60.79 3a8t h PHE 227 Cb 0.23 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 38.34 3a8t h PHE 227 CO -0.01 0.37 0.48 -0.44 -0.60 0.00 0.00 178.31 178.11 3a8t h ASP 228 N 0.00 0.78 -0.62 2.17 3.32 -1.06 0.39 116.42 121.40 3a8t h ASP 228 Ca -0.00 -0.01 -0.03 0.00 0.02 0.00 0.00 57.03 57.00 3a8t h ASP 228 Cb 0.91 -0.19 -0.03 0.00 0.22 0.00 0.00 39.33 40.25 3a8t h ASP 228 CO 0.05 0.55 0.27 -0.09 -1.72 0.00 0.00 179.24 178.30 3a8t h ARG 229 N 0.91 0.91 0.01 3.56 2.43 -1.17 0.14 114.38 121.18 3a8t h ARG 229 Ca 0.28 -0.15 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 3a8t h ARG 229 Cb 0.01 -0.16 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 3a8t h ARG 229 CO -0.08 0.75 -0.00 -0.92 -1.51 0.00 0.00 179.97 178.22 3a8t h TYR 230 N 0.86 -0.01 0.00 2.20 3.20 -1.09 -2.85 116.97 119.28 3a8t h TYR 230 Ca 0.21 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.07 3a8t h TYR 230 Cb 0.16 0.00 -0.00 0.00 1.54 0.00 0.00 36.73 38.44 3a8t h TYR 230 CO 0.01 0.32 -0.04 0.74 -1.64 0.00 0.00 178.16 177.54 3a8t h PHE 231 N -0.33 0.00 -0.40 -3.82 0.04 -0.11 0.03 116.94 112.35 3a8t h PHE 231 Ca -0.00 0.00 0.08 0.00 2.80 0.00 0.00 57.97 60.85 3a8t h PHE 231 Cb 0.33 0.00 -0.08 0.00 2.20 0.00 0.00 35.95 38.40 3a8t h PHE 231 CO 0.04 0.04 -0.11 1.49 -0.60 0.00 0.00 178.31 179.17 3a8t h GLU 232 N 0.00 -0.01 0.20 1.51 4.57 -0.47 -2.64 114.58 117.75 3a8t h GLU 232 Ca -0.00 0.00 -0.34 0.00 -1.18 0.00 0.00 59.36 57.84 3a8t h GLU 232 Cb 0.21 0.00 0.02 0.00 -0.16 0.00 0.00 28.75 28.82 3a8t h GLU 232 CO 0.01 -0.01 -1.62 0.87 -1.18 0.00 0.00 179.01 177.08 3a8t h LYS 233 N -0.01 0.43 -3.14 1.92 1.57 -1.46 -3.42 116.57 112.46 3a8t h LYS 233 Ca 0.19 -0.73 -0.62 0.00 -1.87 0.00 0.00 60.65 57.62 3a8t h LYS 233 Cb 0.30 0.27 -0.42 0.00 0.08 0.00 0.00 32.23 32.47 3a8t h LYS 233 CO -0.42 1.34 -0.59 -0.06 -0.57 0.00 0.00 179.45 179.15 3a8t s PHE 234 N -2.59 3.49 0.52 -1.35 0.08 -0.06 -5.09 117.98 112.97 3a8t s PHE 234 Ca -0.12 -3.31 -0.21 0.00 0.12 0.00 0.00 56.93 53.41 3a8t s PHE 234 Cb 0.05 -2.72 -0.07 0.00 -0.57 0.00 0.00 43.02 39.71 3a8t s PHE 234 CO 0.89 -0.58 0.99 0.54 -0.10 0.00 0.00 175.22 176.96 3a8t n ARG 235 N 2.20 1.15 -1.63 0.44 5.12 -1.01 -4.26 116.66 118.65 3a8t n ARG 235 Ca 0.17 0.43 -0.53 0.00 -1.93 0.00 0.00 57.85 55.99 3a8t n ARG 235 Cb 0.34 -2.13 -0.06 0.00 -1.16 0.00 0.00 32.46 29.45 3a8t n ARG 235 CO 0.00 0.00 0.00 -2.30 -1.93 0.00 0.00 177.63 173.40 3a8t n PRO 236 N -0.48 1.48 -0.00 5.56 -0.02 -1.26 -1.37 135.00 138.91 3a8t n PRO 236 Ca 0.11 0.52 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 3a8t n PRO 236 Cb 0.44 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.53 3a8t n PRO 236 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 3a8t n GLY 237 N 4.92 1.01 3.75 -1.23 0.00 -1.26 -5.03 105.19 107.35 3a8t n GLY 237 Ca 0.29 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.91 3a8t n GLY 237 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 3a8t s ASP 238 N -2.68 7.30 0.30 1.61 -1.08 -0.47 -5.02 116.67 116.63 3a8t s ASP 238 Ca 0.00 2.21 0.04 0.00 -0.52 0.00 0.00 52.55 54.28 3a8t s ASP 238 Cb 0.00 -2.62 -0.06 0.00 -1.46 0.00 0.00 42.92 38.78 3a8t s ASP 238 CO 0.00 -0.13 0.02 0.68 0.52 0.00 0.00 175.17 176.26 3a8t s VAL 239 N -0.98 1.29 -0.11 1.11 -7.23 -1.26 -4.88 120.40 108.33 3a8t s VAL 239 Ca 0.45 -2.04 -0.08 0.00 -1.81 0.00 0.00 61.98 58.51 3a8t s VAL 239 Cb -0.31 -2.62 -0.27 0.00 0.56 0.00 0.00 36.38 33.74 3a8t s VAL 239 CO 0.39 -0.14 0.41 -0.33 -0.31 0.00 0.00 175.10 175.12 3a8t h GLU 240 N 2.22 0.29 0.00 4.82 4.39 -2.01 -3.49 114.58 120.80 3a8t h GLU 240 Ca -0.40 -0.49 0.00 0.00 0.34 0.00 0.00 59.36 58.81 3a8t h GLU 240 Cb 1.24 0.18 0.00 0.00 -0.10 0.00 0.00 28.75 30.07 3a8t h GLU 240 CO 0.68 1.23 0.00 0.41 -1.16 0.00 0.00 179.01 180.18 3a8t n GLY 241 N 1.97 1.15 0.84 -3.84 0.00 -1.26 -4.64 105.19 99.42 3a8t n GLY 241 Ca -0.31 -0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.71 3a8t n GLY 241 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 3a8t n GLU 242 N 0.00 0.00 -3.18 1.61 1.02 -1.26 -5.07 120.64 113.77 3a8t n GLU 242 Ca 0.00 0.00 -0.21 0.00 -0.02 0.00 0.00 57.16 56.93 3a8t n GLU 242 Cb 0.00 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.38 3a8t n GLU 242 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3a8t n ASP 243 N -1.82 1.10 -4.63 1.62 9.92 -1.26 -5.10 116.55 116.38 3a8t n ASP 243 Ca 0.00 -3.01 -0.34 0.00 -0.53 0.00 0.00 54.79 50.91 3a8t n ASP 243 Cb 0.00 -0.62 -0.10 0.00 -0.64 0.00 0.00 41.12 39.76 3a8t n ASP 243 CO 0.00 0.00 0.00 -2.16 0.13 0.00 0.00 177.20 175.17 3a8t s PRO 244 N -2.22 3.70 0.00 -0.24 0.04 -1.26 -4.91 135.00 130.11 3a8t s PRO 244 Ca 0.40 -0.38 0.10 0.00 0.04 0.00 0.00 61.00 61.16 3a8t s PRO 244 Cb 0.29 -3.07 0.53 0.00 0.04 0.00 0.00 34.50 32.30 3a8t s PRO 244 CO -0.09 0.38 1.22 0.41 0.04 0.00 0.00 177.00 178.95 3a8t n GLY 245 N 3.18 -0.62 0.52 0.56 0.00 -1.26 -2.98 105.19 104.59 3a8t n GLY 245 Ca -0.17 -0.05 0.34 0.00 0.00 0.00 0.00 46.02 46.13 3a8t n GLY 245 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 173.32 173.23 3a8t h ARG 246 N 0.00 0.00 -0.79 1.61 2.43 -2.02 -2.72 114.38 112.89 3a8t h ARG 246 Ca 0.00 0.00 0.18 0.00 -0.81 0.00 0.00 59.98 59.35 3a8t h ARG 246 Cb 0.09 0.00 -0.11 0.00 -0.42 0.00 0.00 29.97 29.53 3a8t h ARG 246 CO 0.00 0.00 0.25 -0.44 -1.51 0.00 0.00 179.97 178.27 3a8t h ASP 247 N 0.00 0.12 0.18 -3.80 5.19 -1.98 -1.08 116.42 115.05 3a8t h ASP 247 Ca 0.53 0.15 -0.02 0.00 -0.62 0.00 0.00 57.03 57.07 3a8t h ASP 247 Cb 2.15 0.17 -0.00 0.00 0.18 0.00 0.00 39.33 41.83 3a8t h ASP 247 CO -0.01 -0.02 -0.11 0.03 -3.12 0.00 0.00 179.24 176.02 3a8t h ARG 248 N 0.32 0.00 0.19 3.56 3.08 -1.80 -1.36 114.38 118.38 3a8t h ARG 248 Ca 0.46 0.00 -0.33 0.00 0.07 0.00 0.00 59.98 60.18 3a8t h ARG 248 Cb 0.80 0.00 0.02 0.00 0.08 0.00 0.00 29.97 30.87 3a8t h ARG 248 CO -0.51 0.11 -1.57 -0.24 -1.07 0.00 0.00 179.97 176.68 3a8t h VAL 249 N 0.00 1.15 -0.45 2.04 3.04 -1.42 -2.73 116.25 117.88 3a8t h VAL 249 Ca -0.00 -2.69 0.00 0.00 -1.01 0.00 0.00 66.70 63.00 3a8t h VAL 249 Cb 0.22 2.87 -0.02 0.00 -2.01 0.00 0.00 31.29 32.36 3a8t h VAL 249 CO 0.01 0.84 0.28 -0.09 -1.01 0.00 0.00 177.57 177.61 3a8t h ARG 250 N 0.11 0.60 -0.46 4.17 2.43 -0.88 0.64 114.38 120.99 3a8t h ARG 250 Ca -0.27 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 58.74 3a8t h ARG 250 Cb 2.10 -0.13 -0.01 0.00 -0.42 0.00 0.00 29.97 31.50 3a8t h ARG 250 CO 0.21 0.42 -0.14 -0.09 -1.51 0.00 0.00 179.97 178.86 3a8t h ARG 251 N 0.60 0.90 -0.56 0.20 2.43 -1.38 -1.04 114.38 115.53 3a8t h ARG 251 Ca 0.16 -0.36 -0.09 0.00 -0.81 0.00 0.00 59.98 58.88 3a8t h ARG 251 Cb -0.04 -0.04 -0.02 0.00 -0.42 0.00 0.00 29.97 29.45 3a8t h ARG 251 CO -0.03 1.01 -0.01 0.78 -1.51 0.00 0.00 179.97 180.21 3a8t h GLY 252 N 0.74 1.08 1.26 2.80 0.00 -1.15 -1.61 103.07 106.19 3a8t h GLY 252 Ca 0.11 -0.80 -0.15 0.00 0.00 0.00 0.00 47.33 46.49 3a8t h GLY 252 CO 0.05 0.73 -0.39 0.00 0.00 0.00 0.00 176.54 176.93 3a8t h ALA 253 N 0.96 0.67 0.28 3.60 0.00 0.49 -1.02 119.26 124.24 3a8t h ALA 253 Ca 0.16 -0.45 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 3a8t h ALA 253 Cb 0.55 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.23 3a8t h ALA 253 CO 0.03 0.67 -0.13 0.35 0.00 0.00 0.00 179.25 180.17 3a8t h PHE 254 N 0.66 -0.34 -0.59 0.00 3.57 -1.11 -1.05 116.94 118.08 3a8t h PHE 254 Ca 0.05 -0.01 0.08 0.00 3.53 0.00 0.00 57.97 61.63 3a8t h PHE 254 Cb 0.95 0.11 -0.06 0.00 2.79 0.00 0.00 35.95 39.74 3a8t h PHE 254 CO 0.05 -0.17 0.25 1.49 -2.23 0.00 0.00 178.31 177.70 3a8t h GLU 255 N -0.44 0.44 -0.66 1.11 4.81 -1.24 -0.93 114.58 117.67 3a8t h GLU 255 Ca -0.04 -0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.13 3a8t h GLU 255 Cb 0.33 -0.10 -0.03 0.00 0.63 0.00 0.00 28.75 29.58 3a8t h GLU 255 CO 0.06 0.29 0.28 1.49 -0.73 0.00 0.00 179.01 180.40 3a8t h GLU 256 N 0.45 0.98 -0.12 1.92 4.81 -0.97 -1.68 114.58 119.97 3a8t h GLU 256 Ca 0.29 -0.17 0.01 0.00 -0.13 0.00 0.00 59.36 59.35 3a8t h GLU 256 Cb 0.31 -0.16 -0.01 0.00 0.63 0.00 0.00 28.75 29.52 3a8t h GLU 256 CO -0.26 0.81 0.06 0.00 -0.73 0.00 0.00 179.01 178.89 3a8t h ALA 257 N 1.12 0.14 -0.70 2.92 0.00 -0.33 -1.30 119.26 121.11 3a8t h ALA 257 Ca 0.22 0.00 0.04 0.00 0.00 0.00 0.00 54.91 55.18 3a8t h ALA 257 Cb 0.19 -0.02 -0.05 0.00 0.00 0.00 0.00 17.79 17.90 3a8t h ALA 257 CO -0.02 -0.39 0.42 0.28 0.00 0.00 0.00 179.25 179.54 3a8t h VAL 258 N 0.13 1.05 -0.39 0.00 2.07 -0.81 -0.31 116.25 117.98 3a8t h VAL 258 Ca 0.05 -0.28 -0.09 0.00 0.82 0.00 0.00 66.70 67.20 3a8t h VAL 258 Cb 0.00 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 29.93 3a8t h VAL 258 CO -0.03 0.15 -0.14 0.03 0.02 0.00 0.00 177.57 177.60 3a8t h ARG 259 N 0.81 0.71 -0.59 1.57 3.08 -1.17 -2.13 114.38 116.67 3a8t h ARG 259 Ca 0.29 -0.24 -0.08 0.00 0.07 0.00 0.00 59.98 60.02 3a8t h ARG 259 Cb 0.08 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.05 3a8t h ARG 259 CO -0.14 0.82 0.03 0.00 -1.07 0.00 0.00 179.97 179.61 3a8t h ALA 260 N 1.21 0.94 -0.49 0.04 0.00 -0.48 -0.17 119.26 120.32 3a8t h ALA 260 Ca 0.11 -0.29 -0.07 0.00 0.00 0.00 0.00 54.91 54.66 3a8t h ALA 260 Cb 0.60 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 3a8t h ALA 260 CO 0.04 0.64 0.02 0.82 0.00 0.00 0.00 179.25 180.77 3a8t h ILE 261 N 0.92 1.26 -0.25 0.00 2.04 -0.78 -0.08 117.51 120.62 3a8t h ILE 261 Ca 0.17 -1.04 -0.02 0.00 1.00 0.00 0.00 64.86 64.97 3a8t h ILE 261 Cb 0.49 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.54 3a8t h ILE 261 CO 0.02 0.36 0.06 0.11 0.00 0.00 0.00 178.15 178.71 3a8t h LYS 262 N 0.70 0.39 -0.21 2.37 1.57 -1.11 -2.56 116.57 117.72 3a8t h LYS 262 Ca 0.14 -0.09 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 3a8t h LYS 262 Cb 0.48 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.72 3a8t h LYS 262 CO 0.02 0.49 0.10 0.93 -0.57 0.00 0.00 179.45 180.42 3a8t h GLU 263 N 0.22 0.21 -0.05 3.15 5.08 -0.93 -1.41 114.58 120.86 3a8t h GLU 263 Ca 0.08 -0.01 -0.02 0.00 -1.00 0.00 0.00 59.36 58.40 3a8t h GLU 263 Cb 0.27 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.46 3a8t h GLU 263 CO -0.00 0.14 -0.07 -0.91 -1.00 0.00 0.00 179.01 177.17 3a8t h ASN 264 N 0.22 0.07 -0.16 1.42 2.35 -0.97 0.04 115.58 118.55 3a8t h ASN 264 Ca 0.09 -0.01 -0.16 0.00 -0.55 0.00 0.00 56.30 55.67 3a8t h ASN 264 Cb 0.03 -0.02 0.00 0.00 0.05 0.00 0.00 38.32 38.38 3a8t h ASN 264 CO -0.06 0.16 -0.51 0.74 -1.65 0.00 0.00 177.43 176.10 3a8t h THR 265 N 0.08 1.33 -0.46 2.81 2.02 -1.18 0.01 112.91 117.52 3a8t h THR 265 Ca 0.02 -1.77 -0.07 0.00 0.77 0.00 0.00 66.41 65.36 3a8t h THR 265 Cb 0.18 1.99 -0.02 0.00 -1.74 0.00 0.00 68.15 68.57 3a8t h THR 265 CO 0.01 0.55 0.02 0.00 0.37 0.00 0.00 175.52 176.47 3a8t h HIS 267 N 0.65 1.10 -0.84 0.00 -0.00 -0.85 -2.64 115.15 112.58 3a8t h HIS 267 Ca 0.13 -0.25 -0.01 0.00 -0.00 0.00 0.00 60.37 60.25 3a8t h HIS 267 Cb 0.46 -0.26 -0.04 0.00 -0.00 0.00 0.00 27.41 27.57 3a8t h HIS 267 CO 0.03 1.06 0.50 1.25 -0.00 0.00 0.00 177.93 180.77 3a8t h LEU 268 N 0.85 1.01 -0.95 2.43 5.85 -0.76 -1.75 115.31 121.98 3a8t h LEU 268 Ca 0.12 -0.06 0.01 0.00 0.84 0.00 0.00 57.88 58.79 3a8t h LEU 268 Cb 0.74 -0.25 -0.05 0.00 0.37 0.00 0.00 40.66 41.47 3a8t h LEU 268 CO 0.06 0.78 0.63 0.00 -0.34 0.00 0.00 178.44 179.57 3a8t h ALA 269 N 1.39 1.21 -0.46 1.25 0.00 -0.83 -1.40 119.26 120.43 3a8t h ALA 269 Ca 0.30 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.05 3a8t h ALA 269 Cb -0.04 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.35 3a8t h ALA 269 CO -0.06 0.60 -0.10 0.87 0.00 0.00 0.00 179.25 180.57 3a8t h LYS 270 N 1.29 0.89 -0.00 0.00 1.57 -1.05 -2.05 116.57 117.21 3a8t h LYS 270 Ca 0.35 -0.33 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 3a8t h LYS 270 Cb -0.15 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.10 3a8t h LYS 270 CO -0.08 0.98 -0.45 0.00 -0.57 0.00 0.00 179.45 179.33 3a8t h ARG 271 N 0.73 0.01 -0.20 3.15 3.08 -0.89 -2.46 114.38 117.80 3a8t h ARG 271 Ca 0.12 -0.00 -0.08 0.00 0.07 0.00 0.00 59.98 60.09 3a8t h ARG 271 Cb 0.64 -0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.69 3a8t h ARG 271 CO 0.04 0.46 -0.18 1.96 -1.07 0.00 0.00 179.97 181.18 3a8t h GLN 272 N 0.01 0.47 0.04 0.04 4.20 -1.05 -2.20 115.11 116.61 3a8t h GLN 272 Ca -0.00 -0.24 -0.00 0.00 0.06 0.00 0.00 58.65 58.46 3a8t h GLN 272 Cb 0.81 0.01 0.00 0.00 0.30 0.00 0.00 27.48 28.59 3a8t h GLN 272 CO 0.06 0.81 -0.02 0.82 -0.67 0.00 0.00 178.83 179.83 3a8t h ILE 273 N 0.14 0.99 -0.78 2.54 2.04 -1.32 0.23 117.51 121.36 3a8t h ILE 273 Ca 0.03 -0.09 0.04 0.00 1.00 0.00 0.00 64.86 65.84 3a8t h ILE 273 Cb 0.72 1.05 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 3a8t h ILE 273 CO 0.05 0.02 0.49 1.23 0.00 0.00 0.00 178.15 179.94 3a8t h GLY 274 N -0.09 1.13 1.00 5.37 0.00 -1.49 0.40 103.07 109.39 3a8t h GLY 274 Ca -0.01 -0.37 0.00 0.00 0.00 0.00 0.00 47.33 46.96 3a8t h GLY 274 CO 0.01 0.31 0.25 1.70 0.00 0.00 0.00 176.54 178.80 3a8t h LYS 275 N 0.95 0.49 -0.76 4.80 3.64 -1.07 -0.96 116.57 123.66 3a8t h LYS 275 Ca 0.32 -0.03 -0.02 0.00 -1.27 0.00 0.00 60.65 59.65 3a8t h LYS 275 Cb 0.03 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 31.71 3a8t h LYS 275 CO -0.12 0.32 0.39 0.82 -2.27 0.00 0.00 179.45 178.60 3a8t h ILE 276 N 0.50 1.23 -0.33 2.00 2.04 0.11 -0.86 117.51 122.21 3a8t h ILE 276 Ca 0.14 -0.62 0.06 0.00 1.00 0.00 0.00 64.86 65.44 3a8t h ILE 276 Cb -0.06 0.25 -0.02 0.00 -0.74 0.00 0.00 36.82 36.26 3a8t h ILE 276 CO -0.03 0.27 0.23 -0.07 0.00 0.00 0.00 178.15 178.55 3a8t h LEU 277 N 1.06 0.15 -0.80 1.44 3.38 0.40 -1.40 115.31 119.55 3a8t h LEU 277 Ca 0.26 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.19 3a8t h LEU 277 Cb 0.07 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.78 3a8t h LEU 277 CO -0.04 0.10 -0.19 0.03 0.09 0.00 0.00 178.44 178.43 3a8t h ARG 278 N 0.18 0.00 0.00 1.13 -0.00 0.18 -2.44 114.38 113.42 3a8t h ARG 278 Ca 0.15 0.00 0.00 0.00 -0.50 0.00 0.00 59.98 59.63 3a8t h ARG 278 Cb 0.37 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.34 3a8t h ARG 278 CO -0.02 0.19 -0.13 1.28 0.00 0.00 0.00 179.97 181.29 3a8t n LEU 279 N -3.26 0.63 -2.11 3.04 4.32 -0.55 -2.36 117.00 116.72 3a8t n LEU 279 Ca 0.01 0.48 -0.25 0.00 -0.02 0.00 0.00 56.01 56.23 3a8t n LEU 279 Cb 0.48 -0.32 0.11 0.00 -1.62 0.00 0.00 43.42 42.06 3a8t n LEU 279 CO 0.33 -0.11 1.27 1.17 -1.22 0.00 0.00 177.39 178.83 3a8t n LYS 280 N -2.06 2.23 0.03 3.23 4.81 -0.92 -3.27 118.16 122.20 3a8t n LYS 280 Ca 0.05 -2.63 0.00 0.00 -0.87 0.00 0.00 58.31 54.87 3a8t n LYS 280 Cb 0.41 -2.03 0.00 0.00 0.02 0.00 0.00 35.03 33.43 3a8t n LYS 280 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 3a8t n GLY 281 N -0.70 -0.06 0.17 3.14 0.00 -1.00 -4.72 105.19 102.01 3a8t n GLY 281 Ca 0.51 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.53 3a8t n GLY 281 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3a8t n ALA 282 N -2.71 1.37 0.00 4.61 0.00 -0.99 -4.80 120.51 117.98 3a8t n ALA 282 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 3a8t n ALA 282 Cb 0.02 -1.00 0.00 0.00 0.00 0.00 0.00 19.45 18.47 3a8t n ALA 282 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3a8t n GLY 283 N -0.15 1.07 0.25 0.00 0.00 -1.23 -5.02 105.19 100.10 3a8t n GLY 283 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 3a8t n GLY 283 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 3a8t n TRP 284 N 0.00 0.00 -2.26 1.61 7.02 -1.21 -4.62 117.44 117.98 3a8t n TRP 284 Ca 0.00 0.00 -0.33 0.00 -1.02 0.00 0.00 57.50 56.15 3a8t n TRP 284 Cb 0.00 -0.10 -0.04 0.00 -2.42 0.00 0.00 31.31 28.75 3a8t n TRP 284 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 3a8t s ASP 285 N 0.00 5.70 -0.15 -0.99 2.15 -1.26 -4.64 116.67 117.48 3a8t s ASP 285 Ca 0.00 -1.01 -0.19 0.00 0.43 0.00 0.00 52.55 51.78 3a8t s ASP 285 Cb 0.00 -2.56 -0.04 0.00 -0.30 0.00 0.00 42.92 40.02 3a8t s ASP 285 CO 0.00 -2.24 0.53 -0.76 -0.17 0.00 0.00 175.17 172.53 3a8t s LEU 286 N 7.98 4.22 -0.47 -1.34 1.43 -1.26 -4.34 118.68 124.90 3a8t s LEU 286 Ca 0.60 0.80 -0.21 0.00 -1.03 0.00 0.00 54.13 54.29 3a8t s LEU 286 Cb -0.04 -2.76 0.03 0.00 0.03 0.00 0.00 46.19 43.46 3a8t s LEU 286 CO -0.04 -0.10 0.67 -0.13 0.23 0.00 0.00 176.35 176.97 3a8t s ARG 287 N 1.15 3.24 -0.02 1.70 1.81 -0.37 -4.90 118.95 121.56 3a8t s ARG 287 Ca 0.27 -0.49 -0.28 0.00 -1.72 0.00 0.00 55.73 53.51 3a8t s ARG 287 Cb -0.16 -4.00 -0.03 0.00 -0.45 0.00 0.00 34.95 30.31 3a8t s ARG 287 CO 0.11 -1.11 0.88 0.50 -0.68 0.00 0.00 175.30 174.99 3a8t s ARG 288 N 2.89 4.52 -0.17 3.54 3.52 -1.26 -1.19 118.95 130.80 3a8t s ARG 288 Ca 0.22 1.22 -0.02 0.00 -0.13 0.00 0.00 55.73 57.02 3a8t s ARG 288 Cb -0.15 -3.45 -0.01 0.00 -1.56 0.00 0.00 34.95 29.78 3a8t s ARG 288 CO 0.17 0.01 -0.09 -0.51 -0.81 0.00 0.00 175.30 174.07 3a8t s LEU 289 N 0.88 2.83 -0.56 -0.88 1.43 0.18 -4.94 118.68 117.62 3a8t s LEU 289 Ca 0.46 -0.34 -0.18 0.00 -1.03 0.00 0.00 54.13 53.04 3a8t s LEU 289 Cb -0.20 -1.68 0.10 0.00 0.03 0.00 0.00 46.19 44.44 3a8t s LEU 289 CO 0.24 0.08 0.62 -0.62 0.23 0.00 0.00 176.35 176.91 3a8t s ASP 290 N 0.87 6.19 0.00 2.29 -1.08 -1.26 0.27 116.67 123.95 3a8t s ASP 290 Ca -0.02 -1.39 0.16 0.00 -0.52 0.00 0.00 52.55 50.78 3a8t s ASP 290 Cb -0.15 -2.27 0.67 0.00 -1.46 0.00 0.00 42.92 39.71 3a8t s ASP 290 CO 0.01 -0.98 1.47 0.00 0.52 0.00 0.00 175.17 176.19 3a8t n ALA 291 N 6.00 2.52 -0.15 3.66 0.00 0.41 -4.59 120.51 128.36 3a8t n ALA 291 Ca -0.10 -0.41 -0.03 0.00 0.00 0.00 0.00 53.44 52.90 3a8t n ALA 291 Cb 0.43 -1.10 0.05 0.00 0.00 0.00 0.00 19.45 18.83 3a8t n ALA 291 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 3a8t h THR 292 N 1.53 0.66 0.00 0.00 2.02 -1.89 -1.62 112.91 113.60 3a8t h THR 292 Ca 0.00 -0.05 -0.02 0.00 0.77 0.00 0.00 66.41 67.11 3a8t h THR 292 Cb 0.34 0.50 -0.00 0.00 -1.74 0.00 0.00 68.15 67.25 3a8t h THR 292 CO 0.00 0.03 -0.09 -0.33 0.37 0.00 0.00 175.52 175.50 3a8t h GLU 293 N 0.14 0.00 -0.32 6.66 4.39 -1.96 -1.34 114.58 122.15 3a8t h GLU 293 Ca 0.24 0.00 -0.12 0.00 0.34 0.00 0.00 59.36 59.82 3a8t h GLU 293 Cb 0.35 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 3a8t h GLU 293 CO -0.38 0.09 -0.28 0.77 -1.16 0.00 0.00 179.01 178.06 3a8t h SER 294 N 0.00 0.81 -0.26 1.42 0.02 -1.65 -1.91 113.55 111.98 3a8t h SER 294 Ca -0.00 -0.46 -0.15 0.00 -0.84 0.00 0.00 61.79 60.35 3a8t h SER 294 Cb 0.74 -0.23 -0.00 0.00 0.14 0.00 0.00 62.40 63.05 3a8t h SER 294 CO 0.01 1.09 -0.42 -0.26 -1.14 0.00 0.00 176.83 176.11 3a8t h PHE 295 N 0.53 0.92 0.17 3.45 0.04 -0.99 0.32 116.94 121.38 3a8t h PHE 295 Ca 0.06 -0.32 0.01 0.00 2.80 0.00 0.00 57.97 60.53 3a8t h PHE 295 Cb 0.85 -0.18 -0.03 0.00 2.20 0.00 0.00 35.95 38.79 3a8t h PHE 295 CO 0.07 1.10 -0.31 -0.09 -0.60 0.00 0.00 178.31 178.48 3a8t h ARG 296 N 0.47 -0.54 -0.48 1.51 2.43 -1.26 -0.44 114.38 116.07 3a8t h ARG 296 Ca 0.02 0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 3a8t h ARG 296 Cb 1.02 0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 30.67 3a8t h ARG 296 CO 0.10 -0.36 0.31 0.00 -1.51 0.00 0.00 179.97 178.50 3a8t h ALA 297 N 0.07 1.63 0.00 2.80 0.00 -1.33 -1.67 119.26 120.77 3a8t h ALA 297 Ca 0.02 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.88 3a8t h ALA 297 Cb 0.57 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.17 3a8t h ALA 297 CO -0.15 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.43 3a8t h ALA 298 N 1.68 1.00 -0.10 0.00 0.00 0.62 -2.83 119.26 119.63 3a8t h ALA 298 Ca 0.18 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.99 3a8t h ALA 298 Cb -0.05 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.72 3a8t h ALA 298 CO -0.04 0.00 -0.38 0.52 0.00 0.00 0.00 179.25 179.35 3a8t h MET 299 N 0.00 0.21 -6.88 0.00 2.07 -0.20 -3.41 114.93 106.72 3a8t h MET 299 Ca 0.00 -0.09 -0.52 0.00 -2.07 0.00 0.00 59.70 57.02 3a8t h MET 299 Cb 0.23 -0.01 0.05 0.00 -1.87 0.00 0.00 31.60 30.01 3a8t h MET 299 CO 0.00 0.57 0.58 0.99 1.07 0.00 0.00 176.91 180.12 3a8t s THR 300 N -4.19 2.94 -0.71 2.22 2.01 -1.07 -4.82 115.64 112.02 3a8t s THR 300 Ca -0.04 0.91 0.00 0.00 0.31 0.00 0.00 61.69 62.87 3a8t s THR 300 Cb 0.14 -3.57 0.00 0.00 0.01 0.00 0.00 72.50 69.08 3a8t s THR 300 CO 0.76 0.19 0.34 -1.20 -0.69 0.00 0.00 174.62 174.03 3a8t n SER 301 N 0.72 0.83 -0.90 3.53 7.64 -1.26 -0.77 113.62 123.41 3a8t n SER 301 Ca 0.01 -1.06 0.02 0.00 1.01 0.00 0.00 58.87 58.85 3a8t n SER 301 Cb 0.43 -0.26 0.21 0.00 -1.01 0.00 0.00 64.21 63.58 3a8t n SER 301 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 3a8t n ASP 302 N 0.38 2.76 -3.93 6.43 8.00 -1.26 -4.95 116.55 123.98 3a8t n ASP 302 Ca 0.00 -3.50 -0.37 0.00 0.71 0.00 0.00 54.79 51.63 3a8t n ASP 302 Cb 0.17 -0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 40.61 3a8t n ASP 302 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 3a8t n SER 303 N -1.00 2.09 0.00 -2.24 2.88 0.05 -4.30 113.62 111.11 3a8t n SER 303 Ca 0.27 -2.61 0.00 0.00 -1.33 0.00 0.00 58.87 55.19 3a8t n SER 303 Cb 0.92 -1.17 0.00 0.00 -0.75 0.00 0.00 64.21 63.20 3a8t n SER 303 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 3a8t n GLY 304 N 5.14 0.42 0.26 0.46 0.00 -1.26 -4.91 105.19 105.29 3a8t n GLY 304 Ca 0.47 0.29 0.01 0.00 0.00 0.00 0.00 46.02 46.79 3a8t n GLY 304 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 3a8t h GLU 305 N 0.00 0.01 -0.05 1.61 3.07 -1.99 0.24 114.58 117.47 3a8t h GLU 305 Ca 0.00 -0.00 -0.01 0.00 -0.50 0.00 0.00 59.36 58.85 3a8t h GLU 305 Cb 0.00 -0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 27.91 3a8t h GLU 305 CO 0.00 0.01 -0.03 0.87 -1.40 0.00 0.00 179.01 178.46 3a8t h LYS 306 N 0.01 0.10 -0.65 2.33 1.57 -1.95 -2.19 116.57 115.80 3a8t h LYS 306 Ca 0.34 -0.05 -0.01 0.00 -1.87 0.00 0.00 60.65 59.06 3a8t h LYS 306 Cb 0.53 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.81 3a8t h LYS 306 CO -0.71 0.50 0.35 0.00 -0.57 0.00 0.00 179.45 179.02 3a8t h THR 308 N 0.90 1.29 -0.25 0.00 2.02 -0.52 -2.41 112.91 113.94 3a8t h THR 308 Ca 0.23 -1.55 0.05 0.00 0.77 0.00 0.00 66.41 65.91 3a8t h THR 308 Cb 0.04 1.56 -0.05 0.00 -1.74 0.00 0.00 68.15 67.96 3a8t h THR 308 CO -0.04 0.51 -0.07 -0.33 0.37 0.00 0.00 175.52 175.96 3a8t h GLU 309 N 0.57 -0.00 0.00 6.66 5.08 -1.16 -0.46 114.58 125.26 3a8t h GLU 309 Ca 0.04 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 3a8t h GLU 309 Cb 0.96 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 3a8t h GLU 309 CO 0.09 -0.00 -0.00 0.82 -1.00 0.00 0.00 179.01 178.92 3a8t h ILE 310 N -0.00 1.19 -0.99 3.13 2.04 -1.52 -2.37 117.51 118.98 3a8t h ILE 310 Ca 0.12 -0.56 0.05 0.00 1.00 0.00 0.00 64.86 65.47 3a8t h ILE 310 Cb 0.19 1.57 -0.06 0.00 -0.74 0.00 0.00 36.82 37.78 3a8t h ILE 310 CO -0.26 0.15 0.64 -0.25 0.00 0.00 0.00 178.15 178.42 3a8t h TRP 311 N -0.24 1.20 0.07 1.37 2.91 -1.36 0.69 115.95 120.58 3a8t h TRP 311 Ca -0.00 0.03 -0.00 0.00 1.13 0.00 0.00 58.89 60.05 3a8t h TRP 311 Cb 0.24 -0.39 0.00 0.00 -0.51 0.00 0.00 29.16 28.50 3a8t h TRP 311 CO 0.01 0.65 -0.03 1.49 -1.03 0.00 0.00 178.44 179.52 3a8t h GLU 312 N 1.20 -0.09 -0.08 2.65 4.81 -0.87 0.14 114.58 122.33 3a8t h GLU 312 Ca 0.41 0.01 -0.09 0.00 -0.13 0.00 0.00 59.36 59.56 3a8t h GLU 312 Cb 0.10 0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.50 3a8t h GLU 312 CO -0.15 -0.05 -0.31 0.87 -0.73 0.00 0.00 179.01 178.64 3a8t h LYS 313 N -0.10 0.35 0.00 1.92 1.57 -1.03 0.79 116.57 120.08 3a8t h LYS 313 Ca -0.01 -0.27 -0.08 0.00 -1.87 0.00 0.00 60.65 58.42 3a8t h LYS 313 Cb 0.08 0.05 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 3a8t h LYS 313 CO 0.02 0.90 -1.03 1.96 -0.57 0.00 0.00 179.45 180.73 3a8t h GLN 314 N -0.12 0.00 0.00 3.15 4.20 0.40 -3.40 115.11 119.35 3a8t h GLN 314 Ca -0.02 0.00 -0.03 0.00 0.06 0.00 0.00 58.65 58.66 3a8t h GLN 314 Cb 0.95 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.72 3a8t h GLN 314 CO 0.07 0.17 -1.02 0.28 -0.67 0.00 0.00 178.83 177.66 3a8t n VAL 315 N -2.86 0.22 0.15 -0.54 0.31 0.02 -4.46 118.33 111.17 3a8t n VAL 315 Ca -0.03 0.01 -0.10 0.00 -0.01 0.00 0.00 64.34 64.21 3a8t n VAL 315 Cb 0.69 -1.54 -0.06 0.00 -0.91 0.00 0.00 33.84 32.02 3a8t n VAL 315 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 3a8t h LEU 316 N -0.08 -0.38 -0.60 7.52 5.85 -0.83 -2.91 115.31 123.88 3a8t h LEU 316 Ca -0.05 -0.12 0.12 0.00 0.84 0.00 0.00 57.88 58.67 3a8t h LEU 316 Cb 0.96 0.10 -0.10 0.00 0.37 0.00 0.00 40.66 41.98 3a8t h LEU 316 CO -0.03 0.09 -0.01 1.05 -0.34 0.00 0.00 178.44 179.20 3a8t h GLU 317 N -1.02 0.11 -0.55 1.25 4.11 -1.04 -0.92 114.58 116.52 3a8t h GLU 317 Ca -0.05 -0.01 0.01 0.00 0.07 0.00 0.00 59.36 59.38 3a8t h GLU 317 Cb 0.48 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.67 3a8t h GLU 317 CO 0.07 0.07 0.37 -1.35 0.07 0.00 0.00 179.01 178.24 3a8t h PRO 318 N 0.11 0.73 -0.76 1.06 0.11 -1.78 -2.77 132.00 128.70 3a8t h PRO 318 Ca 0.31 -0.04 0.01 0.00 0.11 0.00 0.00 66.00 66.39 3a8t h PRO 318 Cb 0.50 -0.16 -0.04 0.00 0.11 0.00 0.00 31.00 31.41 3a8t h PRO 318 CO -0.52 0.48 0.50 0.77 -0.21 0.00 0.00 178.00 179.02 3a8t h SER 319 N 0.75 0.85 -0.33 -2.05 0.02 -1.00 -1.64 113.55 110.15 3a8t h SER 319 Ca 0.20 -0.02 0.05 0.00 -0.84 0.00 0.00 61.79 61.19 3a8t h SER 319 Cb -0.08 -0.21 -0.05 0.00 0.14 0.00 0.00 62.40 62.20 3a8t h SER 319 CO -0.04 0.61 0.05 0.58 -1.14 0.00 0.00 176.83 176.89 3a8t h VAL 320 N 1.01 0.81 -0.18 2.27 2.07 -1.04 0.34 116.25 121.54 3a8t h VAL 320 Ca 0.28 -0.05 0.02 0.00 0.82 0.00 0.00 66.70 67.77 3a8t h VAL 320 Cb -0.09 0.64 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 3a8t h VAL 320 CO -0.07 0.03 0.04 0.11 0.02 0.00 0.00 177.57 177.70 3a8t h LYS 321 N 0.16 0.11 -0.18 1.57 1.57 -1.21 0.19 116.57 118.78 3a8t h LYS 321 Ca 0.16 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.93 3a8t h LYS 321 Cb 0.19 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.46 3a8t h LYS 321 CO -0.22 0.07 0.10 0.82 -0.57 0.00 0.00 179.45 179.65 3a8t h ILE 322 N 0.11 1.08 -0.41 1.86 2.04 -0.81 -1.15 117.51 120.24 3a8t h ILE 322 Ca 0.08 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.69 3a8t h ILE 322 Cb 0.07 0.91 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 3a8t h ILE 322 CO -0.10 0.08 0.12 0.58 0.00 0.00 0.00 178.15 178.82 3a8t h VAL 323 N 0.20 1.22 -0.67 1.67 2.07 -0.68 -1.72 116.25 118.34 3a8t h VAL 323 Ca 0.06 -0.75 0.13 0.00 0.82 0.00 0.00 66.70 66.97 3a8t h VAL 323 Cb 0.04 0.93 -0.10 0.00 -1.52 0.00 0.00 31.29 30.65 3a8t h VAL 323 CO -0.01 0.26 0.15 -1.28 0.02 0.00 0.00 177.57 176.71 3a8t h SER 324 N 0.52 0.01 0.85 0.57 0.87 -0.50 0.20 113.55 116.07 3a8t h SER 324 Ca 0.13 0.13 -0.09 0.00 -1.23 0.00 0.00 61.79 60.73 3a8t h SER 324 Cb 0.28 0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.40 3a8t h SER 324 CO -0.00 -0.01 -0.44 0.03 -0.53 0.00 0.00 176.83 175.88 3a8t h ARG 325 N 0.27 0.00 -0.05 2.24 3.08 -0.52 -2.92 114.38 116.48 3a8t h ARG 325 Ca 0.36 0.00 -0.16 0.00 0.07 0.00 0.00 59.98 60.25 3a8t h ARG 325 Cb 0.57 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 3a8t h ARG 325 CO -0.45 0.44 -0.68 0.35 -1.07 0.00 0.00 179.97 178.56 3a8t h PHE 326 N 0.00 0.30 0.00 3.04 3.57 -0.31 -3.07 116.94 120.47 3a8t h PHE 326 Ca -0.00 -0.13 0.00 0.00 3.53 0.00 0.00 57.97 61.37 3a8t h PHE 326 Cb 0.99 -0.05 0.00 0.00 2.79 0.00 0.00 35.95 39.68 3a8t h PHE 326 CO 0.00 0.84 0.00 -0.07 -2.23 0.00 0.00 178.31 176.85 3a8t h LEU 327 N 0.16 0.00 0.00 0.59 3.38 -0.49 -3.37 115.31 115.58 3a8t h LEU 327 Ca -0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.95 3a8t h LEU 327 Cb 1.22 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 3a8t h LEU 327 CO 0.11 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.11 3a8t n ASP 328 N -3.03 0.00 -0.34 -0.43 8.00 -1.16 -5.11 116.55 114.48 3a8t n ASP 328 Ca 0.03 0.10 0.15 0.00 0.71 0.00 0.00 54.79 55.78 3a8t n ASP 328 Cb 0.43 -0.07 0.65 0.00 -0.02 0.00 0.00 41.12 42.11 3a8t n ASP 328 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19