#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3f84 s ILE 2 N 0.00 0.00 0.14 3.17 2.07 -1.26 -3.37 121.20 121.95 3f84 s ILE 2 Ca 0.00 -0.04 -0.21 0.00 -1.41 0.00 0.00 60.65 58.99 3f84 s ILE 2 Cb 0.00 -0.77 0.06 0.00 0.13 0.00 0.00 42.46 41.87 3f84 s ILE 2 CO 0.00 -0.02 0.54 -0.62 -1.91 0.00 0.00 174.94 172.93 3f84 s ASP 3 N 0.00 -0.46 -0.12 4.50 2.15 -0.51 -4.59 116.67 117.63 3f84 s ASP 3 Ca -0.02 -0.07 -0.00 0.00 0.43 0.00 0.00 52.55 52.89 3f84 s ASP 3 Cb -0.04 0.55 0.03 0.00 -0.30 0.00 0.00 42.92 43.17 3f84 s ASP 3 CO 0.02 -0.91 -0.07 -0.22 -0.17 0.00 0.00 175.17 173.82 3f84 s LEU 4 N -2.68 1.26 0.30 -1.34 2.96 -1.26 -0.45 118.68 117.47 3f84 s LEU 4 Ca 0.01 -0.38 0.11 0.00 -0.22 0.00 0.00 54.13 53.65 3f84 s LEU 4 Cb -0.00 -0.84 -0.05 0.00 0.50 0.00 0.00 46.19 45.79 3f84 s LEU 4 CO -0.11 -0.14 -0.15 -0.76 -1.32 0.00 0.00 176.35 173.87 3f84 s LEU 5 N 1.70 2.69 0.46 -0.68 1.43 -0.78 -4.54 118.68 118.96 3f84 s LEU 5 Ca 0.04 -1.04 -0.23 0.00 -1.03 0.00 0.00 54.13 51.87 3f84 s LEU 5 Cb -0.13 -1.13 -0.09 0.00 0.03 0.00 0.00 46.19 44.86 3f84 s LEU 5 CO -0.08 -0.04 0.99 0.00 0.23 0.00 0.00 176.35 177.44 3f84 n GLN 6 N -0.70 1.25 0.03 1.70 6.02 -0.11 -0.50 117.38 125.07 3f84 n GLN 6 Ca -0.05 0.45 0.22 0.00 -0.01 0.00 0.00 57.00 57.61 3f84 n GLN 6 Cb 0.61 -2.07 0.70 0.00 1.02 0.00 0.00 30.24 30.51 3f84 n GLN 6 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3f84 h ALA 7 N 1.29 2.27 -0.58 -1.58 0.00 -0.97 0.71 119.26 120.41 3f84 h ALA 7 Ca -0.45 -0.02 0.12 0.00 0.00 0.00 0.00 54.91 54.55 3f84 h ALA 7 Cb 1.34 0.04 -0.10 0.00 0.00 0.00 0.00 17.79 19.08 3f84 h ALA 7 CO 0.55 -0.84 -0.01 -0.44 0.00 0.00 0.00 179.25 178.51 3f84 h ASP 8 N 0.00 -0.28 0.00 0.00 3.32 -1.90 -3.47 116.42 114.08 3f84 h ASP 8 Ca 0.25 0.14 0.00 0.00 0.02 0.00 0.00 57.03 57.44 3f84 h ASP 8 Cb 1.38 0.26 0.00 0.00 0.22 0.00 0.00 39.33 41.19 3f84 h ASP 8 CO -0.00 -0.11 0.00 0.61 -1.72 0.00 0.00 179.24 178.02 3f84 n GLY 9 N -1.35 2.58 3.74 2.75 0.00 0.24 -5.13 105.19 108.03 3f84 n GLY 9 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.70 3f84 n GLY 9 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 3f84 n ASN 10 N 0.00 2.88 -4.76 1.61 5.03 -1.26 -4.82 115.26 113.94 3f84 n ASN 10 Ca 0.00 1.04 -0.40 0.00 0.87 0.00 0.00 54.58 56.09 3f84 n ASN 10 Cb 0.00 -1.58 0.02 0.00 -1.02 0.00 0.00 39.78 37.20 3f84 n ASN 10 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 3f84 n ALA 11 N -0.65 2.11 -1.72 5.41 0.00 -1.26 -0.93 120.51 123.46 3f84 n ALA 11 Ca 0.08 0.27 -0.41 0.00 0.00 0.00 0.00 53.44 53.38 3f84 n ALA 11 Cb 0.43 -2.40 0.01 0.00 0.00 0.00 0.00 19.45 17.49 3f84 n ALA 11 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3f84 n LEU 12 N -0.07 4.30 -4.72 0.00 4.77 -1.26 -4.63 117.00 115.40 3f84 n LEU 12 Ca 0.04 1.12 -0.41 0.00 -0.03 0.00 0.00 56.01 56.74 3f84 n LEU 12 Cb 0.41 -1.53 0.01 0.00 -2.33 0.00 0.00 43.42 39.97 3f84 n LEU 12 CO 0.60 -0.47 0.94 -2.65 -1.33 0.00 0.00 177.39 174.48 3f84 n PRO 13 N 0.04 2.11 0.13 3.23 -0.02 -1.26 -4.94 135.00 134.30 3f84 n PRO 13 Ca 0.06 0.75 0.01 0.00 -2.02 0.00 0.00 63.50 62.29 3f84 n PRO 13 Cb 0.40 -2.43 0.10 0.00 -0.02 0.00 0.00 33.50 31.55 3f84 n PRO 13 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 3f84 h SER 14 N 2.34 0.00 -4.67 2.55 4.64 -1.94 -3.44 113.55 113.03 3f84 h SER 14 Ca -0.48 0.00 -0.26 0.00 -0.47 0.00 0.00 61.79 60.58 3f84 h SER 14 Cb 1.28 0.00 -0.19 0.00 -0.31 0.00 0.00 62.40 63.19 3f84 h SER 14 CO 0.61 0.60 -0.72 0.00 -0.87 0.00 0.00 176.83 176.45 3f84 s ALA 15 N -3.17 0.79 -0.14 5.18 0.00 -1.26 0.37 121.76 123.52 3f84 s ALA 15 Ca 0.01 -1.03 -0.07 0.00 0.00 0.00 0.00 51.96 50.88 3f84 s ALA 15 Cb 0.10 0.08 0.06 0.00 0.00 0.00 0.00 23.12 23.36 3f84 s ALA 15 CO 0.75 -0.10 0.32 0.08 0.00 0.00 0.00 175.76 176.81 3f84 s VAL 16 N -2.30 -0.16 -0.21 0.00 1.01 0.88 -4.89 120.40 114.74 3f84 s VAL 16 Ca -0.00 0.16 -0.10 0.00 0.00 0.00 0.00 61.98 62.04 3f84 s VAL 16 Cb -0.04 -0.49 -0.05 0.00 0.00 0.00 0.00 36.38 35.80 3f84 s VAL 16 CO -0.02 0.06 0.12 -0.54 0.00 0.00 0.00 175.10 174.73 3f84 s LYS 17 N 1.63 4.12 -0.50 2.72 -0.14 -1.26 -1.47 119.74 124.84 3f84 s LYS 17 Ca -0.07 -0.26 -0.17 0.00 -1.36 0.00 0.00 55.97 54.11 3f84 s LYS 17 Cb -0.10 -3.40 0.08 0.00 -1.68 0.00 0.00 37.83 32.72 3f84 s LYS 17 CO -0.10 0.24 0.50 -0.51 -0.76 0.00 0.00 175.35 174.72 3f84 s LEU 18 N 0.52 5.48 -0.02 3.17 1.43 -0.81 -4.90 118.68 123.55 3f84 s LEU 18 Ca 0.07 -1.27 -0.34 0.00 -1.03 0.00 0.00 54.13 51.57 3f84 s LEU 18 Cb -0.12 -2.27 -0.12 0.00 0.03 0.00 0.00 46.19 43.71 3f84 s LEU 18 CO -0.00 -0.78 1.84 0.00 0.23 0.00 0.00 176.35 177.63 3f84 n ALA 19 N 5.59 1.10 -2.63 4.21 0.00 -1.26 -4.49 120.51 123.02 3f84 n ALA 19 Ca -0.11 0.31 -0.38 0.00 0.00 0.00 0.00 53.44 53.26 3f84 n ALA 19 Cb 0.44 -2.50 -0.06 0.00 0.00 0.00 0.00 19.45 17.33 3f84 n ALA 19 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3f84 s TYR 20 N 3.50 3.59 -0.29 0.00 5.04 -1.26 -0.29 117.35 127.63 3f84 s TYR 20 Ca 0.89 0.91 -0.07 0.00 -2.44 0.00 0.00 57.07 56.36 3f84 s TYR 20 Cb -0.65 -2.44 -0.00 0.00 0.35 0.00 0.00 41.96 39.21 3f84 s TYR 20 CO 0.48 0.35 0.09 -1.54 -1.34 0.00 0.00 175.55 173.58 3f84 s SER 21 N -0.01 5.18 0.38 4.32 1.04 -0.88 -5.00 113.70 118.72 3f84 s SER 21 Ca 0.24 -0.58 0.16 0.00 0.48 0.00 0.00 55.95 56.25 3f84 s SER 21 Cb -0.16 -1.91 1.03 0.00 0.10 0.00 0.00 66.02 65.09 3f84 s SER 21 CO 0.11 -0.16 1.77 -0.65 0.98 0.00 0.00 173.24 175.29 3f84 h PRO 22 N 8.25 0.45 0.33 4.02 0.11 -1.97 0.11 132.00 143.30 3f84 h PRO 22 Ca -0.33 -0.03 -0.00 0.00 0.11 0.00 0.00 66.00 65.75 3f84 h PRO 22 Cb 1.14 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 3f84 h PRO 22 CO 0.60 0.30 -0.29 0.00 -0.21 0.00 0.00 178.00 178.40 3f84 h ALA 23 N 1.64 -0.63 -0.00 -0.75 0.00 -1.97 -3.22 119.26 114.33 3f84 h ALA 23 Ca 0.59 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 55.40 3f84 h ALA 23 Cb 1.38 0.40 0.00 0.00 0.00 0.00 0.00 17.79 19.56 3f84 h ALA 23 CO -0.32 -0.88 -0.60 -1.13 0.00 0.00 0.00 179.25 176.32 3f84 n SER 24 N -5.41 0.91 -2.40 0.00 3.41 -1.17 -4.96 113.62 103.99 3f84 n SER 24 Ca -0.09 -0.72 -0.18 0.00 -0.26 0.00 0.00 58.87 57.62 3f84 n SER 24 Cb 0.31 0.47 -0.01 0.00 -0.26 0.00 0.00 64.21 64.72 3f84 n SER 24 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3f84 n LYS 25 N -1.19 -1.88 -4.45 4.33 5.02 0.37 -4.98 118.16 115.38 3f84 n LYS 25 Ca 0.07 0.86 -0.23 0.00 -2.02 0.00 0.00 58.31 56.98 3f84 n LYS 25 Cb 0.35 -5.49 -0.10 0.00 -0.02 0.00 0.00 35.03 29.77 3f84 n LYS 25 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 3f84 s THR 26 N -2.87 2.35 -0.14 -0.18 -4.23 -1.22 -4.58 115.64 104.76 3f84 s THR 26 Ca 0.00 -2.36 -0.13 0.00 -1.18 0.00 0.00 61.69 58.02 3f84 s THR 26 Cb 0.00 -2.25 -0.05 0.00 1.34 0.00 0.00 72.50 71.55 3f84 s THR 26 CO 0.00 -0.42 0.30 -0.36 -0.54 0.00 0.00 174.62 173.60 3f84 s PHE 27 N -2.54 3.50 0.16 3.99 0.40 -1.26 -2.06 117.98 120.16 3f84 s PHE 27 Ca 0.28 0.64 -0.30 0.00 -0.60 0.00 0.00 56.93 56.95 3f84 s PHE 27 Cb -0.04 -2.31 -0.08 0.00 0.51 0.00 0.00 43.02 41.10 3f84 s PHE 27 CO 0.13 0.32 1.32 -2.00 0.70 0.00 0.00 175.22 175.69 3f84 s GLU 28 N 0.18 4.38 0.38 0.44 2.12 0.60 -4.80 118.70 121.99 3f84 s GLU 28 Ca 0.17 2.02 -0.25 0.00 0.36 0.00 0.00 54.97 57.28 3f84 s GLU 28 Cb -0.13 -3.23 -0.09 0.00 0.26 0.00 0.00 34.13 30.93 3f84 s GLU 28 CO 0.05 -0.31 1.03 -1.12 -0.54 0.00 0.00 175.26 174.38 3f84 s SER 29 N 0.66 6.90 -0.01 -1.70 0.01 -1.26 -4.21 113.70 114.08 3f84 s SER 29 Ca 0.59 2.01 -0.29 0.00 1.31 0.00 0.00 55.95 59.58 3f84 s SER 29 Cb -0.36 -2.59 -0.03 0.00 0.21 0.00 0.00 66.02 63.26 3f84 s SER 29 CO 0.34 -0.39 0.92 -0.47 0.41 0.00 0.00 173.24 174.06 3f84 s TYR 30 N -1.63 3.64 -0.09 2.43 5.04 0.92 -4.93 117.35 122.75 3f84 s TYR 30 Ca 0.56 1.61 -0.01 0.00 -2.44 0.00 0.00 57.07 56.78 3f84 s TYR 30 Cb -0.22 -3.06 0.03 0.00 0.35 0.00 0.00 41.96 39.06 3f84 s TYR 30 CO 0.28 0.01 -0.02 1.03 -1.34 0.00 0.00 175.55 175.50 3f84 s ARG 31 N 0.96 0.91 0.00 4.97 0.52 -1.26 -0.49 118.95 124.57 3f84 s ARG 31 Ca 0.49 -0.01 0.01 0.00 -0.52 0.00 0.00 55.73 55.70 3f84 s ARG 31 Cb -0.20 -1.17 -0.00 0.00 0.52 0.00 0.00 34.95 34.09 3f84 s ARG 31 CO 0.26 -0.29 -0.03 0.54 0.02 0.00 0.00 175.30 175.80 3f84 s VAL 32 N 1.88 0.21 -0.05 3.52 0.11 -0.34 -5.00 120.40 120.74 3f84 s VAL 32 Ca 0.05 -0.21 -0.22 0.00 -2.93 0.00 0.00 61.98 58.67 3f84 s VAL 32 Cb -0.12 -0.20 -0.04 0.00 -1.53 0.00 0.00 36.38 34.48 3f84 s VAL 32 CO -0.06 -0.00 0.63 -0.04 -3.33 0.00 0.00 175.10 172.30 3f84 s MET 33 N -0.23 4.39 0.25 1.54 -1.94 -1.26 0.91 119.30 122.95 3f84 s MET 33 Ca -0.01 0.77 0.06 0.00 -1.71 0.00 0.00 55.69 54.81 3f84 s MET 33 Cb -0.02 -3.40 -0.05 0.00 2.01 0.00 0.00 34.83 33.36 3f84 s MET 33 CO -0.00 0.20 -0.07 0.95 -0.01 0.00 0.00 175.02 176.09 3f84 s THR 34 N 0.37 1.55 0.01 2.05 -4.23 0.73 -0.39 115.64 115.73 3f84 s THR 34 Ca 0.33 -2.13 0.01 0.00 -1.18 0.00 0.00 61.69 58.73 3f84 s THR 34 Cb -0.18 -2.31 -0.01 0.00 1.34 0.00 0.00 72.50 71.34 3f84 s THR 34 CO 0.17 -0.39 -0.05 -1.10 -0.54 0.00 0.00 174.62 172.71 3f84 s GLN 35 N -3.73 0.36 -0.12 3.99 -0.21 0.34 -0.47 119.66 119.83 3f84 s GLN 35 Ca 0.27 -0.27 -0.27 0.00 0.02 0.00 0.00 55.36 55.11 3f84 s GLN 35 Cb 0.03 -0.29 -0.02 0.00 1.00 0.00 0.00 33.01 33.73 3f84 s GLN 35 CO 0.10 0.07 0.88 0.08 -2.12 0.00 0.00 175.29 174.30 3f84 s VAL 36 N -0.38 4.88 -0.16 1.09 1.01 -1.26 -1.87 120.40 123.70 3f84 s VAL 36 Ca -0.01 1.77 -0.06 0.00 0.00 0.00 0.00 61.98 63.67 3f84 s VAL 36 Cb -0.03 -4.19 -0.04 0.00 0.00 0.00 0.00 36.38 32.12 3f84 s VAL 36 CO -0.00 0.07 0.04 -1.00 0.00 0.00 0.00 175.10 174.21 3f84 s HIS 37 N 1.76 3.22 0.14 5.22 3.76 0.41 -1.06 115.29 128.74 3f84 s HIS 37 Ca 0.43 0.04 -0.12 0.00 -0.15 0.00 0.00 55.06 55.26 3f84 s HIS 37 Cb -0.18 -2.02 0.01 0.00 1.11 0.00 0.00 32.58 31.50 3f84 s HIS 37 CO 0.17 0.18 0.33 -0.08 -0.85 0.00 0.00 174.74 174.49 3f84 s THR 38 N 0.16 0.08 -1.67 1.30 -1.32 -0.23 -1.42 115.64 112.53 3f84 s THR 38 Ca 0.03 -1.06 0.24 0.00 -1.21 0.00 0.00 61.69 59.69 3f84 s THR 38 Cb -0.13 -1.54 0.04 0.00 -1.51 0.00 0.00 72.50 69.37 3f84 s THR 38 CO 0.01 -0.35 1.24 -0.46 -2.21 0.00 0.00 174.62 172.85 3f84 n ASN 39 N -0.20 1.40 -3.48 8.08 6.94 -1.22 -4.57 115.26 122.20 3f84 n ASN 39 Ca -0.11 -1.11 -0.29 0.00 -0.02 0.00 0.00 54.58 53.05 3f84 n ASN 39 Cb 0.63 0.44 -0.13 0.00 -2.36 0.00 0.00 39.78 38.36 3f84 n ASN 39 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 3f84 s ASP 40 N -2.63 3.11 -0.88 0.53 2.15 -1.26 -5.02 116.67 112.67 3f84 s ASP 40 Ca 0.18 -1.90 0.00 0.00 0.43 0.00 0.00 52.55 51.26 3f84 s ASP 40 Cb 0.18 -0.36 0.34 0.00 -0.30 0.00 0.00 42.92 42.77 3f84 s ASP 40 CO 0.62 -0.35 1.67 0.00 -0.17 0.00 0.00 175.17 176.94 3f84 n ALA 41 N 4.42 5.86 0.00 3.66 0.00 -1.26 -4.12 120.51 129.08 3f84 n ALA 41 Ca 0.06 -4.51 0.00 0.00 0.00 0.00 0.00 53.44 48.99 3f84 n ALA 41 Cb 0.39 -1.79 0.00 0.00 0.00 0.00 0.00 19.45 18.04 3f84 n ALA 41 CO 0.00 0.00 0.00 2.41 0.00 0.00 0.00 177.50 179.91 3f84 n THR 42 N -0.21 0.00 -3.37 0.00 -1.04 -1.26 -4.93 114.28 103.46 3f84 n THR 42 Ca 0.45 0.00 -0.33 0.00 -2.04 0.00 0.00 64.05 62.13 3f84 n THR 42 Cb 0.30 0.00 -0.06 0.00 -1.82 0.00 0.00 70.33 68.76 3f84 n THR 42 CO 0.00 0.00 0.00 -0.54 -0.64 0.00 0.00 175.07 173.89 3f84 s LYS 43 N -0.66 3.88 0.24 -2.82 -0.14 -1.26 -4.69 119.74 114.29 3f84 s LYS 43 Ca 0.00 0.39 -0.31 0.00 -1.36 0.00 0.00 55.97 54.68 3f84 s LYS 43 Cb 0.00 -2.73 -0.12 0.00 -1.68 0.00 0.00 37.83 33.30 3f84 s LYS 43 CO 0.00 0.36 1.65 0.36 -0.76 0.00 0.00 175.35 176.96 3f84 n LYS 44 N 0.18 2.65 -2.92 1.68 2.85 -1.26 -4.15 118.16 117.19 3f84 n LYS 44 Ca -0.01 0.95 -0.42 0.00 -1.05 0.00 0.00 58.31 57.78 3f84 n LYS 44 Cb 0.52 -2.76 -0.05 0.00 -0.65 0.00 0.00 35.03 32.10 3f84 n LYS 44 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 177.40 177.43 3f84 s VAL 45 N 0.66 4.78 -0.35 0.58 1.01 -0.04 -2.48 120.40 124.56 3f84 s VAL 45 Ca 0.71 1.26 -0.11 0.00 0.00 0.00 0.00 61.98 63.85 3f84 s VAL 45 Cb -0.53 -4.16 0.01 0.00 0.00 0.00 0.00 36.38 31.71 3f84 s VAL 45 CO 0.39 -0.24 0.19 -0.63 0.00 0.00 0.00 175.10 174.81 3f84 s ILE 46 N 2.99 4.63 -0.21 2.22 1.01 0.84 -0.26 121.20 132.41 3f84 s ILE 46 Ca 0.33 -0.68 -0.05 0.00 0.00 0.00 0.00 60.65 60.26 3f84 s ILE 46 Cb -0.14 -3.50 -0.02 0.00 0.01 0.00 0.00 42.46 38.81 3f84 s ILE 46 CO 0.12 -0.12 -0.01 -0.69 0.00 0.00 0.00 174.94 174.24 3f84 s VAL 47 N 1.58 3.84 0.32 2.92 1.01 0.87 -0.85 120.40 130.10 3f84 s VAL 47 Ca 0.03 -0.35 0.05 0.00 0.00 0.00 0.00 61.98 61.72 3f84 s VAL 47 Cb -0.18 -2.74 -0.03 0.00 0.00 0.00 0.00 36.38 33.43 3f84 s VAL 47 CO 0.07 0.42 0.30 -1.59 0.00 0.00 0.00 175.10 174.30 3f84 s LYS 48 N 1.15 1.74 -0.08 2.72 -2.85 -0.46 -0.84 119.74 121.12 3f84 s LYS 48 Ca 0.03 -1.95 -0.03 0.00 -1.00 0.00 0.00 55.97 53.02 3f84 s LYS 48 Cb -0.14 0.34 -0.04 0.00 -2.06 0.00 0.00 37.83 35.93 3f84 s LYS 48 CO 0.01 -0.65 0.05 -0.51 0.10 0.00 0.00 175.35 174.35 3f84 s LEU 49 N -3.34 3.84 0.19 2.77 1.43 0.27 -0.75 118.68 123.09 3f84 s LEU 49 Ca 0.39 0.22 -0.03 0.00 -1.03 0.00 0.00 54.13 53.68 3f84 s LEU 49 Cb 0.02 -1.97 0.12 0.00 0.03 0.00 0.00 46.19 44.39 3f84 s LEU 49 CO 0.26 0.36 1.52 0.00 0.23 0.00 0.00 176.35 178.71 3f84 h ALA 50 N 4.88 0.72 -2.74 4.21 0.00 -1.33 -3.36 119.26 121.63 3f84 h ALA 50 Ca -0.51 -0.50 -0.21 0.00 0.00 0.00 0.00 54.91 53.68 3f84 h ALA 50 Cb 1.20 -0.09 -0.12 0.00 0.00 0.00 0.00 17.79 18.78 3f84 h ALA 50 CO 0.57 0.68 -0.40 0.16 0.00 0.00 0.00 179.25 180.27 3f84 s ASP 51 N -6.91 0.35 -0.29 0.00 3.84 -1.26 -4.99 116.67 107.40 3f84 s ASP 51 Ca -0.07 -1.31 -0.29 0.00 -0.00 0.00 0.00 52.55 50.88 3f84 s ASP 51 Cb 0.11 0.50 -0.02 0.00 -1.38 0.00 0.00 42.92 42.14 3f84 s ASP 51 CO 0.84 -1.02 1.62 -0.89 -0.00 0.00 0.00 175.17 175.72 3f84 s THR 52 N -3.88 3.68 0.22 2.11 2.01 -1.26 -4.80 115.64 113.72 3f84 s THR 52 Ca 0.33 0.74 -0.30 0.00 0.31 0.00 0.00 61.69 62.77 3f84 s THR 52 Cb 0.03 -3.80 -0.08 0.00 0.01 0.00 0.00 72.50 68.66 3f84 s THR 52 CO 0.14 -0.43 1.00 -2.16 -0.69 0.00 0.00 174.62 172.48 3f84 s PRO 53 N 5.01 4.75 -0.02 4.92 0.04 -1.26 -5.01 135.00 143.43 3f84 s PRO 53 Ca 0.72 1.58 0.00 0.00 0.04 0.00 0.00 61.00 63.34 3f84 s PRO 53 Cb -0.22 -3.28 0.02 0.00 0.04 0.00 0.00 34.50 31.07 3f84 s PRO 53 CO 0.31 0.34 0.01 -0.65 0.04 0.00 0.00 177.00 177.05 3f84 s GLN 54 N -0.91 0.06 -0.20 4.56 -1.52 -1.26 -1.66 119.66 118.73 3f84 s GLN 54 Ca 0.44 0.11 -0.28 0.00 -1.95 0.00 0.00 55.36 53.68 3f84 s GLN 54 Cb -0.27 -0.25 0.00 0.00 -0.22 0.00 0.00 33.01 32.26 3f84 s GLN 54 CO 0.34 -0.12 0.99 -0.51 -0.25 0.00 0.00 175.29 175.75 3f84 s LEU 55 N 0.79 4.14 -0.09 2.90 1.43 0.43 -4.05 118.68 124.23 3f84 s LEU 55 Ca -0.07 1.36 0.04 0.00 -1.03 0.00 0.00 54.13 54.43 3f84 s LEU 55 Cb -0.10 -3.48 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 3f84 s LEU 55 CO -0.02 -0.58 -0.22 -0.89 0.23 0.00 0.00 176.35 174.87 3f84 s THR 56 N 2.80 2.24 -0.11 5.49 2.01 -0.73 -0.22 115.64 127.12 3f84 s THR 56 Ca 0.44 -0.97 -0.36 0.00 0.31 0.00 0.00 61.69 61.11 3f84 s THR 56 Cb -0.16 -1.85 -0.13 0.00 0.01 0.00 0.00 72.50 70.37 3f84 s THR 56 CO 0.09 0.56 1.82 -0.67 -0.69 0.00 0.00 174.62 175.73 3f84 n ASP 57 N 3.26 3.13 0.19 3.53 -0.08 -0.42 -0.66 116.55 125.50 3f84 n ASP 57 Ca -0.18 1.01 0.14 0.00 -1.51 0.00 0.00 54.79 54.25 3f84 n ASP 57 Cb 0.53 -1.32 0.59 0.00 2.34 0.00 0.00 41.12 43.26 3f84 n ASP 57 CO 0.00 0.00 0.00 1.62 0.12 0.00 0.00 177.20 178.94 3f84 h VAL 58 N 5.23 0.00 -0.03 5.18 3.04 -0.58 -2.45 116.25 126.64 3f84 h VAL 58 Ca -0.48 -0.33 0.00 0.00 -1.01 0.00 0.00 66.70 64.89 3f84 h VAL 58 Cb 1.28 1.16 0.00 0.00 -2.01 0.00 0.00 31.29 31.72 3f84 h VAL 58 CO 0.94 0.00 0.00 0.18 -1.01 0.00 0.00 177.57 177.68 3f84 n LEU 59 N -2.59 2.23 -3.49 3.16 4.77 -1.26 -4.97 117.00 114.84 3f84 n LEU 59 Ca 0.01 -1.02 0.01 0.00 -0.03 0.00 0.00 56.01 54.98 3f84 n LEU 59 Cb 0.25 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.30 3f84 n LEU 59 CO 0.22 0.41 0.25 0.21 -1.33 0.00 0.00 177.39 177.16 3f84 s ASN 60 N -1.20 -1.18 0.34 -1.43 3.84 -0.92 -5.07 114.94 109.32 3f84 s ASN 60 Ca 0.17 1.33 0.24 0.00 0.21 0.00 0.00 52.86 54.82 3f84 s ASN 60 Cb 0.12 2.23 0.50 0.00 -0.55 0.00 0.00 41.25 43.55 3f84 s ASN 60 CO 0.18 -0.22 1.65 0.28 -2.79 0.00 0.00 177.10 176.20 3f84 h SER 61 N 7.98 0.00 1.04 -4.21 0.02 -1.94 -3.16 113.55 113.28 3f84 h SER 61 Ca -0.19 -0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.75 3f84 h SER 61 Cb 1.12 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.66 3f84 h SER 61 CO 0.14 0.00 0.00 0.35 -1.14 0.00 0.00 176.83 176.18 3f84 n THR 62 N -2.77 0.54 -3.54 -2.27 -2.24 -1.26 -4.71 114.28 98.04 3f84 n THR 62 Ca 0.04 -0.02 -0.41 0.00 -2.27 0.00 0.00 64.05 61.39 3f84 n THR 62 Cb 0.49 -0.75 -0.09 0.00 -2.10 0.00 0.00 70.33 67.89 3f84 n THR 62 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 3f84 s VAL 63 N -3.10 4.44 0.13 2.28 1.01 -1.19 -5.04 120.40 118.93 3f84 s VAL 63 Ca 0.10 -1.46 0.07 0.00 0.00 0.00 0.00 61.98 60.68 3f84 s VAL 63 Cb 0.13 -3.77 -0.04 0.00 0.00 0.00 0.00 36.38 32.70 3f84 s VAL 63 CO 0.49 -0.62 -0.17 -1.10 0.00 0.00 0.00 175.10 173.70 3f84 s GLN 64 N 1.45 1.11 -0.05 2.72 -0.21 -1.26 -1.30 119.66 122.12 3f84 s GLN 64 Ca 0.04 -1.27 0.00 0.00 0.02 0.00 0.00 55.36 54.15 3f84 s GLN 64 Cb -0.25 -1.12 0.02 0.00 1.00 0.00 0.00 33.01 32.67 3f84 s GLN 64 CO 0.02 0.23 -0.02 -1.64 -2.12 0.00 0.00 175.29 171.76 3f84 s MET 65 N -2.55 0.67 0.15 2.91 -1.94 0.69 -4.65 119.30 114.59 3f84 s MET 65 Ca 0.10 -0.02 -0.31 0.00 -1.71 0.00 0.00 55.69 53.75 3f84 s MET 65 Cb -0.06 -0.80 -0.10 0.00 2.01 0.00 0.00 34.83 35.88 3f84 s MET 65 CO 0.04 -0.15 1.56 -1.25 -0.01 0.00 0.00 175.02 175.22 3f84 s PRO 66 N 1.19 4.22 -0.01 2.03 0.04 -1.24 -0.43 135.00 140.81 3f84 s PRO 66 Ca -0.07 2.33 -0.28 0.00 0.04 0.00 0.00 61.00 63.03 3f84 s PRO 66 Cb -0.14 -3.21 -0.04 0.00 0.04 0.00 0.00 34.50 31.16 3f84 s PRO 66 CO -0.02 -0.60 0.88 0.42 0.04 0.00 0.00 177.00 177.72 3f84 s ILE 67 N 1.29 4.89 -0.06 0.56 1.01 -0.66 -3.55 121.20 124.68 3f84 s ILE 67 Ca 0.70 1.84 -0.05 0.00 0.00 0.00 0.00 60.65 63.14 3f84 s ILE 67 Cb -0.43 -4.22 -0.04 0.00 0.01 0.00 0.00 42.46 37.79 3f84 s ILE 67 CO 0.31 0.21 0.15 -0.44 0.00 0.00 0.00 174.94 175.18 3f84 s SER 68 N 0.79 6.31 -0.06 3.58 0.01 0.36 -4.65 113.70 120.04 3f84 s SER 68 Ca 0.46 0.39 0.00 0.00 1.31 0.00 0.00 55.95 58.11 3f84 s SER 68 Cb -0.20 -2.00 0.02 0.00 0.21 0.00 0.00 66.02 64.05 3f84 s SER 68 CO 0.25 0.33 -0.04 -0.69 0.41 0.00 0.00 173.24 173.50 3f84 s VAL 69 N -1.17 0.56 0.05 3.43 1.01 -1.26 -1.31 120.40 121.72 3f84 s VAL 69 Ca 0.21 -0.09 0.08 0.00 0.00 0.00 0.00 61.98 62.18 3f84 s VAL 69 Cb -0.12 -0.62 -0.03 0.00 0.00 0.00 0.00 36.38 35.61 3f84 s VAL 69 CO 0.11 0.25 -0.23 -0.94 0.00 0.00 0.00 175.10 174.29 3f84 s SER 70 N 1.23 2.75 -0.02 3.32 1.04 -0.52 -0.01 113.70 121.49 3f84 s SER 70 Ca -0.06 -0.57 0.00 0.00 0.48 0.00 0.00 55.95 55.81 3f84 s SER 70 Cb -0.14 -0.23 0.02 0.00 0.10 0.00 0.00 66.02 65.78 3f84 s SER 70 CO -0.02 0.19 0.01 0.86 0.98 0.00 0.00 173.24 175.26 3f84 s TRP 71 N -0.84 0.17 -1.44 5.02 -0.00 0.29 -1.42 118.94 120.73 3f84 s TRP 71 Ca 0.09 0.05 0.00 0.00 -0.00 0.00 0.00 56.10 56.24 3f84 s TRP 71 Cb -0.09 -0.29 0.00 0.00 -0.00 0.00 0.00 33.47 33.09 3f84 s TRP 71 CO 0.02 -0.09 0.00 0.41 -0.00 0.00 0.00 176.95 177.29 3f84 n GLY 72 N 3.98 0.04 2.27 5.86 0.00 -1.02 -1.46 105.19 114.86 3f84 n GLY 72 Ca -0.25 -0.22 0.00 0.00 0.00 0.00 0.00 46.02 45.55 3f84 n GLY 72 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f84 n GLY 73 N -1.01 0.81 3.19 -0.02 0.00 -1.26 -4.99 105.19 101.91 3f84 n GLY 73 Ca -0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.50 3f84 n GLY 73 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3f84 s GLN 74 N -0.15 3.08 -0.15 1.61 -1.52 -0.54 -5.08 119.66 116.90 3f84 s GLN 74 Ca 0.00 -0.80 -0.37 0.00 -1.95 0.00 0.00 55.36 52.24 3f84 s GLN 74 Cb 0.00 -2.79 -0.14 0.00 -0.22 0.00 0.00 33.01 29.86 3f84 s GLN 74 CO 0.00 -0.24 1.75 0.28 -0.25 0.00 0.00 175.29 176.83 3f84 n VAL 75 N 4.68 0.36 -3.80 1.09 0.31 -1.26 -0.55 118.33 119.17 3f84 n VAL 75 Ca -0.19 -0.06 -0.34 0.00 -0.01 0.00 0.00 64.34 63.73 3f84 n VAL 75 Cb 0.50 -1.45 -0.05 0.00 -0.91 0.00 0.00 33.84 31.93 3f84 n VAL 75 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3f84 s LEU 76 N 3.31 4.37 0.00 7.52 1.43 0.98 -4.93 118.68 131.35 3f84 s LEU 76 Ca 0.94 0.50 0.00 0.00 -1.03 0.00 0.00 54.13 54.54 3f84 s LEU 76 Cb -0.90 -2.67 -0.00 0.00 0.03 0.00 0.00 46.19 42.65 3f84 s LEU 76 CO 0.57 0.25 0.03 -1.54 0.23 0.00 0.00 176.35 175.89 3f84 n SER 77 N 1.04 -0.08 0.29 2.29 3.41 -1.26 -4.60 113.62 114.71 3f84 n SER 77 Ca -0.11 -1.18 0.16 0.00 -0.26 0.00 0.00 58.87 57.48 3f84 n SER 77 Cb 0.53 0.16 0.89 0.00 -0.26 0.00 0.00 64.21 65.53 3f84 n SER 77 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3f84 h THR 78 N 1.09 0.39 -3.40 6.66 1.35 -1.87 0.79 112.91 117.91 3f84 h THR 78 Ca -0.02 -0.24 -0.55 0.00 -0.55 0.00 0.00 66.41 65.05 3f84 h THR 78 Cb 0.10 1.17 -0.04 0.00 -1.73 0.00 0.00 68.15 67.65 3f84 h THR 78 CO 0.03 0.05 0.20 -0.89 -0.25 0.00 0.00 175.52 174.66 3f84 s THR 79 N -4.29 4.90 0.26 6.82 2.01 -1.26 -4.67 115.64 119.40 3f84 s THR 79 Ca -0.04 1.70 -0.30 0.00 0.31 0.00 0.00 61.69 63.36 3f84 s THR 79 Cb 0.13 -4.15 -0.09 0.00 0.01 0.00 0.00 72.50 68.40 3f84 s THR 79 CO 0.53 0.25 1.02 0.00 -0.69 0.00 0.00 174.62 175.74 3f84 s ALA 80 N 0.63 3.37 -0.10 7.40 0.00 -1.26 -4.81 121.76 126.99 3f84 s ALA 80 Ca 0.42 0.76 -0.02 0.00 0.00 0.00 0.00 51.96 53.13 3f84 s ALA 80 Cb -0.20 -3.27 -0.03 0.00 0.00 0.00 0.00 23.12 19.62 3f84 s ALA 80 CO 0.23 0.02 0.01 0.15 0.00 0.00 0.00 175.76 176.16 3f84 s LYS 81 N -1.32 3.09 -0.17 0.00 1.02 -0.02 -4.95 119.74 117.39 3f84 s LYS 81 Ca 0.43 -0.40 -0.06 0.00 0.02 0.00 0.00 55.97 55.95 3f84 s LYS 81 Cb -0.29 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.15 3f84 s LYS 81 CO 0.37 0.65 0.03 -1.21 -0.92 0.00 0.00 175.35 174.27 3f84 s GLU 82 N -0.74 3.84 -0.24 1.68 2.02 -1.26 -0.09 118.70 123.92 3f84 s GLU 82 Ca 0.12 -0.39 -0.08 0.00 0.02 0.00 0.00 54.97 54.63 3f84 s GLU 82 Cb -0.12 -3.11 -0.04 0.00 0.10 0.00 0.00 34.13 30.97 3f84 s GLU 82 CO 0.02 0.29 0.10 -0.06 0.02 0.00 0.00 175.26 175.64 3f84 s PHE 83 N 0.29 3.18 0.20 1.61 0.40 0.64 -4.95 117.98 119.34 3f84 s PHE 83 Ca 0.02 -0.11 -0.32 0.00 -0.60 0.00 0.00 56.93 55.92 3f84 s PHE 83 Cb -0.13 -2.23 -0.11 0.00 0.51 0.00 0.00 43.02 41.06 3f84 s PHE 83 CO 0.01 -0.14 1.66 -1.21 0.70 0.00 0.00 175.22 176.25 3f84 s GLU 84 N 1.26 4.15 0.23 0.44 0.41 -1.26 -0.86 118.70 123.07 3f84 s GLU 84 Ca 0.06 2.53 -0.14 0.00 -0.41 0.00 0.00 54.97 57.00 3f84 s GLU 84 Cb -0.14 -3.10 0.27 0.00 -1.78 0.00 0.00 34.13 29.38 3f84 s GLU 84 CO 0.05 -0.70 1.59 0.00 -0.49 0.00 0.00 175.26 175.71 3f84 h ALA 85 N 6.68 0.33 -0.88 5.21 0.00 -1.84 -1.84 119.26 126.92 3f84 h ALA 85 Ca -0.43 0.27 0.18 0.00 0.00 0.00 0.00 54.91 54.93 3f84 h ALA 85 Cb 1.20 0.70 -0.07 0.00 0.00 0.00 0.00 17.79 19.63 3f84 h ALA 85 CO 0.93 -0.50 0.58 0.00 0.00 0.00 0.00 179.25 180.26 3f84 h ALA 86 N 1.53 2.08 -0.66 0.00 0.00 -1.91 -1.92 119.26 118.38 3f84 h ALA 86 Ca 0.34 0.02 -0.07 0.00 0.00 0.00 0.00 54.91 55.19 3f84 h ALA 86 Cb 0.57 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.28 3f84 h ALA 86 CO -0.80 -0.35 0.13 0.00 0.00 0.00 0.00 179.25 178.23 3f84 h ALA 87 N 1.62 0.99 0.00 0.00 0.00 -1.72 -2.67 119.26 117.48 3f84 h ALA 87 Ca 0.45 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.11 3f84 h ALA 87 Cb 1.00 -0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.54 3f84 h ALA 87 CO -0.19 0.65 0.00 -0.07 0.00 0.00 0.00 179.25 179.64 3f84 h LEU 88 N 1.00 0.00 -2.55 0.00 3.38 -1.31 -3.47 115.31 112.36 3f84 h LEU 88 Ca 0.20 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.97 3f84 h LEU 88 Cb 0.39 0.00 0.16 0.00 0.09 0.00 0.00 40.66 41.30 3f84 h LEU 88 CO 0.01 0.00 -0.69 0.61 0.09 0.00 0.00 178.44 178.46 3f84 n GLY 89 N 0.78 -0.75 3.76 0.83 0.00 -1.00 -1.37 105.19 107.44 3f84 n GLY 89 Ca 0.04 0.41 -0.39 0.00 0.00 0.00 0.00 46.02 46.08 3f84 n GLY 89 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f84 s TYR 90 N -3.31 2.40 -0.01 1.61 1.51 -1.26 -3.52 117.35 114.77 3f84 s TYR 90 Ca 0.36 1.36 -0.12 0.00 -1.01 0.00 0.00 57.07 57.66 3f84 s TYR 90 Cb -0.05 -3.80 -0.05 0.00 -0.11 0.00 0.00 41.96 37.95 3f84 s TYR 90 CO 0.59 -2.77 0.35 -1.54 -1.11 0.00 0.00 175.55 171.07 3f84 s SER 91 N -0.85 6.69 -0.18 2.29 1.04 -0.40 -4.97 113.70 117.32 3f84 s SER 91 Ca 0.67 0.82 0.17 0.00 0.48 0.00 0.00 55.95 58.10 3f84 s SER 91 Cb -0.40 -2.20 0.45 0.00 0.10 0.00 0.00 66.02 63.97 3f84 s SER 91 CO 0.49 0.32 1.17 0.00 0.98 0.00 0.00 173.24 176.20 3f84 n ALA 92 N 1.69 3.36 0.03 5.32 0.00 -1.26 -1.80 120.51 127.85 3f84 n ALA 92 Ca -0.14 -3.02 -0.11 0.00 0.00 0.00 0.00 53.44 50.16 3f84 n ALA 92 Cb 0.53 -0.58 -0.08 0.00 0.00 0.00 0.00 19.45 19.32 3f84 n ALA 92 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 3f84 h SER 93 N 1.67 -0.14 0.00 0.00 0.87 -1.99 -3.45 113.55 110.51 3f84 h SER 93 Ca -0.01 -0.42 0.00 0.00 -1.23 0.00 0.00 61.79 60.13 3f84 h SER 93 Cb 1.43 0.04 0.00 0.00 -0.44 0.00 0.00 62.40 63.43 3f84 h SER 93 CO 0.25 0.43 0.00 0.61 -0.53 0.00 0.00 176.83 177.59 3f84 n GLY 94 N 0.62 1.00 3.02 5.77 0.00 -1.26 -5.00 105.19 109.34 3f84 n GLY 94 Ca -0.08 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.57 3f84 n GLY 94 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3f84 n VAL 95 N 0.00 3.59 -2.51 1.61 0.24 -1.26 -5.07 118.33 114.93 3f84 n VAL 95 Ca 0.00 -5.33 -0.42 0.00 -2.04 0.00 0.00 64.34 56.55 3f84 n VAL 95 Cb 0.08 -2.31 -0.03 0.00 -1.47 0.00 0.00 33.84 30.11 3f84 n VAL 95 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 3f84 s ASN 96 N -0.62 6.27 0.00 -1.34 4.22 -1.26 -3.65 114.94 118.56 3f84 s ASN 96 Ca 0.31 0.03 0.00 0.00 -2.14 0.00 0.00 52.86 51.05 3f84 s ASN 96 Cb -0.02 -2.55 0.00 0.00 1.28 0.00 0.00 41.25 39.96 3f84 s ASN 96 CO -0.06 -1.65 0.00 0.61 -2.04 0.00 0.00 177.10 173.96 3f84 n GLY 97 N 5.20 1.34 2.83 0.45 0.00 -0.74 -4.95 105.19 109.31 3f84 n GLY 97 Ca 0.08 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.89 3f84 n GLY 97 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f84 s VAL 98 N -1.96 0.44 0.73 1.61 1.01 -1.24 -1.07 120.40 119.92 3f84 s VAL 98 Ca 0.00 0.01 -0.11 0.00 0.00 0.00 0.00 61.98 61.89 3f84 s VAL 98 Cb 0.00 -0.54 0.03 0.00 0.00 0.00 0.00 36.38 35.87 3f84 s VAL 98 CO 0.00 0.24 1.07 -0.94 0.00 0.00 0.00 175.10 175.47 3f84 s SER 99 N 1.48 5.06 0.73 3.32 1.04 -0.22 -1.28 113.70 123.82 3f84 s SER 99 Ca -0.02 1.64 -0.16 0.00 0.48 0.00 0.00 55.95 57.88 3f84 s SER 99 Cb -0.13 -2.46 -0.05 0.00 0.10 0.00 0.00 66.02 63.48 3f84 s SER 99 CO -0.03 -1.65 0.38 -1.54 0.98 0.00 0.00 173.24 171.38 3f84 n SER 100 N -3.27 -1.76 -4.72 7.02 3.41 -0.47 -4.58 113.62 109.26 3f84 n SER 100 Ca 0.08 0.56 -0.42 0.00 -0.26 0.00 0.00 58.87 58.83 3f84 n SER 100 Cb 0.54 -1.15 -0.03 0.00 -0.26 0.00 0.00 64.21 63.30 3f84 n SER 100 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 3f84 s SER 101 N -1.42 6.68 -0.06 4.04 0.01 -1.26 -4.65 113.70 117.04 3f84 s SER 101 Ca 0.63 2.51 0.03 0.00 1.31 0.00 0.00 55.95 60.43 3f84 s SER 101 Cb -0.35 -2.59 0.01 0.00 0.21 0.00 0.00 66.02 63.30 3f84 s SER 101 CO 0.61 -0.76 -0.15 -1.10 0.41 0.00 0.00 173.24 172.25 3f84 s GLN 102 N 1.07 1.83 0.03 12.44 -1.52 0.37 -4.89 119.66 128.99 3f84 s GLN 102 Ca 0.68 -0.51 -0.30 0.00 -1.95 0.00 0.00 55.36 53.27 3f84 s GLN 102 Cb -0.41 -1.51 -0.05 0.00 -0.22 0.00 0.00 33.01 30.82 3f84 s GLN 102 CO 0.31 0.11 1.21 -2.00 -0.25 0.00 0.00 175.29 174.67 3f84 s GLU 103 N 0.43 4.41 -0.19 2.91 2.12 -1.26 -0.19 118.70 126.93 3f84 s GLU 103 Ca -0.11 1.75 -0.18 0.00 0.36 0.00 0.00 54.97 56.79 3f84 s GLU 103 Cb -0.14 -3.41 -0.04 0.00 0.26 0.00 0.00 34.13 30.80 3f84 s GLU 103 CO 0.04 -0.32 0.47 -1.17 -0.54 0.00 0.00 175.26 173.75 3f84 s LEU 104 N 1.40 4.17 -0.17 2.70 2.96 0.26 -2.44 118.68 127.57 3f84 s LEU 104 Ca 0.58 0.65 0.01 0.00 -0.22 0.00 0.00 54.13 55.16 3f84 s LEU 104 Cb -0.28 -2.65 0.02 0.00 0.50 0.00 0.00 46.19 43.78 3f84 s LEU 104 CO 0.27 -0.11 -0.20 -0.69 -1.32 0.00 0.00 176.35 174.30 3f84 s VAL 105 N 1.35 2.02 -0.28 1.68 1.01 -0.50 -1.19 120.40 124.48 3f84 s VAL 105 Ca 0.23 -0.93 -0.02 0.00 0.00 0.00 0.00 61.98 61.26 3f84 s VAL 105 Cb -0.15 -1.82 0.04 0.00 0.00 0.00 0.00 36.38 34.45 3f84 s VAL 105 CO 0.09 0.54 -0.01 -0.63 0.00 0.00 0.00 175.10 175.09 3f84 s ILE 106 N 1.18 3.07 0.21 2.22 1.01 0.36 -1.44 121.20 127.81 3f84 s ILE 106 Ca 0.02 -1.18 0.11 0.00 0.00 0.00 0.00 60.65 59.60 3f84 s ILE 106 Cb -0.14 -2.67 -0.05 0.00 0.01 0.00 0.00 42.46 39.61 3f84 s ILE 106 CO -0.10 0.02 -0.21 -0.94 0.00 0.00 0.00 174.94 173.71 3f84 s SER 107 N 1.31 3.60 0.05 3.58 1.04 -0.42 -0.06 113.70 122.80 3f84 s SER 107 Ca -0.02 -0.86 0.00 0.00 0.48 0.00 0.00 55.95 55.55 3f84 s SER 107 Cb -0.18 -0.34 -0.03 0.00 0.10 0.00 0.00 66.02 65.56 3f84 s SER 107 CO -0.02 0.10 -0.05 0.00 0.98 0.00 0.00 173.24 174.26 3f84 s ALA 108 N -1.86 0.54 0.09 5.32 0.00 -1.26 -0.49 121.76 124.10 3f84 s ALA 108 Ca 0.23 -1.03 -0.27 0.00 0.00 0.00 0.00 51.96 50.90 3f84 s ALA 108 Cb -0.07 0.18 0.08 0.00 0.00 0.00 0.00 23.12 23.31 3f84 s ALA 108 CO 0.12 -0.23 0.93 0.00 0.00 0.00 0.00 175.76 176.58 3f84 s ALA 109 N -2.86 -1.73 0.73 0.00 0.00 -1.23 -4.44 121.76 112.22 3f84 s ALA 109 Ca -0.00 0.49 -0.16 0.00 0.00 0.00 0.00 51.96 52.30 3f84 s ALA 109 Cb 0.00 0.55 0.02 0.00 0.00 0.00 0.00 23.12 23.69 3f84 s ALA 109 CO -0.05 -0.90 1.01 -2.30 0.00 0.00 0.00 175.76 173.52 3f84 n PRO 110 N -0.38 0.49 0.07 0.00 -0.02 -1.26 -3.67 135.00 130.23 3f84 n PRO 110 Ca -0.07 0.23 0.00 0.00 -2.02 0.00 0.00 63.50 61.63 3f84 n PRO 110 Cb 0.61 -2.26 0.31 0.00 -0.02 0.00 0.00 33.50 32.14 3f84 n PRO 110 CO 0.00 0.00 0.00 -0.22 1.98 0.00 0.00 175.50 177.26 3f84 h LYS 111 N -0.31 0.34 -4.40 -0.52 3.64 -1.93 -3.34 116.57 110.05 3f84 h LYS 111 Ca -0.47 -0.10 -0.72 0.00 -1.27 0.00 0.00 60.65 58.09 3f84 h LYS 111 Cb 1.33 -0.04 -0.26 0.00 -0.41 0.00 0.00 32.23 32.85 3f84 h LYS 111 CO 0.47 0.51 -0.42 0.95 -2.27 0.00 0.00 179.45 178.69 3f84 s THR 112 N -4.64 4.61 0.32 1.00 -4.23 -1.26 -5.06 115.64 106.37 3f84 s THR 112 Ca -0.06 -1.27 -0.29 0.00 -1.18 0.00 0.00 61.69 58.89 3f84 s THR 112 Cb 0.15 -3.79 -0.10 0.00 1.34 0.00 0.00 72.50 70.10 3f84 s THR 112 CO 0.76 -0.53 1.30 0.00 -0.54 0.00 0.00 174.62 175.60 3f84 s ALA 113 N 1.51 3.50 0.00 3.99 0.00 -1.26 -2.83 121.76 126.67 3f84 s ALA 113 Ca 0.03 1.24 0.00 0.00 0.00 0.00 0.00 51.96 53.23 3f84 s ALA 113 Cb -0.23 -3.47 0.00 0.00 0.00 0.00 0.00 23.12 19.41 3f84 s ALA 113 CO 0.04 -0.61 0.00 0.41 0.00 0.00 0.00 175.76 175.59 3f84 n GLY 114 N 0.88 0.48 3.75 0.00 0.00 -1.26 -5.08 105.19 103.96 3f84 n GLY 114 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.79 3f84 n GLY 114 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 3f84 s THR 115 N -2.20 4.08 0.27 2.61 -4.23 -1.13 -5.06 115.64 109.98 3f84 s THR 115 Ca 0.00 -1.48 -0.20 0.00 -1.18 0.00 0.00 61.69 58.83 3f84 s THR 115 Cb 0.00 -3.15 -0.09 0.00 1.34 0.00 0.00 72.50 70.60 3f84 s THR 115 CO 0.00 -0.28 0.77 0.00 -0.54 0.00 0.00 174.62 174.58 3f84 s ALA 116 N -2.05 3.34 0.35 3.99 0.00 -1.26 -4.71 121.76 121.42 3f84 s ALA 116 Ca 0.31 0.21 -0.26 0.00 0.00 0.00 0.00 51.96 52.22 3f84 s ALA 116 Cb -0.08 -2.89 -0.09 0.00 0.00 0.00 0.00 23.12 20.06 3f84 s ALA 116 CO 0.22 0.29 1.07 -1.25 0.00 0.00 0.00 175.76 176.10 3f84 s PRO 117 N -2.24 4.37 0.23 0.00 0.04 -1.26 -4.96 135.00 131.18 3f84 s PRO 117 Ca 0.47 1.64 -0.30 0.00 0.04 0.00 0.00 61.00 62.85 3f84 s PRO 117 Cb -0.15 -2.83 -0.09 0.00 0.04 0.00 0.00 34.50 31.47 3f84 s PRO 117 CO 0.20 0.01 1.38 0.99 0.04 0.00 0.00 177.00 179.62 3f84 s THR 118 N -1.44 2.90 -0.01 1.26 2.01 -1.26 -4.92 115.64 114.18 3f84 s THR 118 Ca 0.52 0.76 -0.34 0.00 0.31 0.00 0.00 61.69 62.94 3f84 s THR 118 Cb -0.26 -3.48 -0.17 0.00 0.01 0.00 0.00 72.50 68.59 3f84 s THR 118 CO 0.33 0.12 0.91 0.00 -0.69 0.00 0.00 174.62 175.30 3f84 n ALA 119 N 2.41 -3.14 0.00 7.40 0.00 -0.74 -4.72 120.51 121.72 3f84 n ALA 119 Ca 0.06 0.51 0.00 0.00 0.00 0.00 0.00 53.44 54.01 3f84 n ALA 119 Cb 0.41 -1.49 0.00 0.00 0.00 0.00 0.00 19.45 18.37 3f84 n ALA 119 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f84 n GLY 120 N 1.31 2.66 3.73 0.00 0.00 0.38 -4.95 105.19 108.32 3f84 n GLY 120 Ca 0.17 -1.19 -0.36 0.00 0.00 0.00 0.00 46.02 44.65 3f84 n GLY 120 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3f84 s ASN 121 N 0.00 6.30 0.01 1.61 0.01 -1.26 -0.49 114.94 121.13 3f84 s ASN 121 Ca 0.00 0.35 0.08 0.00 -0.71 0.00 0.00 52.86 52.57 3f84 s ASN 121 Cb 0.00 -2.13 -0.03 0.00 0.41 0.00 0.00 41.25 39.51 3f84 s ASN 121 CO 0.00 0.16 -0.23 -0.31 -1.51 0.00 0.00 177.10 175.20 3f84 s TYR 122 N 0.35 2.41 -0.01 2.20 1.51 0.09 0.23 117.35 124.14 3f84 s TYR 122 Ca 0.11 -0.36 0.02 0.00 -1.01 0.00 0.00 57.07 55.83 3f84 s TYR 122 Cb -0.12 -1.47 -0.00 0.00 -0.11 0.00 0.00 41.96 40.26 3f84 s TYR 122 CO 0.00 0.11 -0.05 0.45 -1.11 0.00 0.00 175.55 174.95 3f84 s SER 123 N -1.03 0.67 0.00 2.29 0.15 0.16 -1.65 113.70 114.30 3f84 s SER 123 Ca 0.12 -0.10 0.00 0.00 0.70 0.00 0.00 55.95 56.67 3f84 s SER 123 Cb -0.10 -0.10 0.00 0.00 -1.71 0.00 0.00 66.02 64.11 3f84 s SER 123 CO 0.02 0.06 0.00 0.61 1.20 0.00 0.00 173.24 175.12 3f84 n GLY 124 N 3.03 2.61 2.88 9.45 0.00 0.10 -1.76 105.19 121.50 3f84 n GLY 124 Ca -0.14 -0.91 -0.12 0.00 0.00 0.00 0.00 46.02 44.85 3f84 n GLY 124 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f84 s VAL 125 N -2.93 -0.00 -0.41 1.61 1.01 -1.26 -0.19 120.40 118.22 3f84 s VAL 125 Ca 0.00 0.01 -0.15 0.00 0.00 0.00 0.00 61.98 61.83 3f84 s VAL 125 Cb 0.00 -0.03 0.02 0.00 0.00 0.00 0.00 36.38 36.37 3f84 s VAL 125 CO 0.00 0.00 0.32 -0.69 0.00 0.00 0.00 175.10 174.73 3f84 s VAL 126 N 0.04 5.24 -0.67 2.92 1.01 0.47 -4.59 120.40 124.82 3f84 s VAL 126 Ca -0.00 -0.64 -0.17 0.00 0.00 0.00 0.00 61.98 61.17 3f84 s VAL 126 Cb -0.01 -3.95 0.14 0.00 0.00 0.00 0.00 36.38 32.56 3f84 s VAL 126 CO -0.00 -0.34 0.72 -0.44 0.00 0.00 0.00 175.10 175.04 3f84 s SER 127 N 1.73 6.36 -0.13 3.32 0.01 -1.26 -0.84 113.70 122.90 3f84 s SER 127 Ca 0.06 -1.86 -0.23 0.00 1.31 0.00 0.00 55.95 55.23 3f84 s SER 127 Cb -0.19 -2.27 -0.03 0.00 0.21 0.00 0.00 66.02 63.74 3f84 s SER 127 CO 0.10 -0.93 0.70 -0.22 0.41 0.00 0.00 173.24 173.30 3f84 s LEU 128 N 1.88 4.24 -0.16 2.44 2.96 0.20 -0.87 118.68 129.37 3f84 s LEU 128 Ca 0.13 1.07 0.01 0.00 -0.22 0.00 0.00 54.13 55.13 3f84 s LEU 128 Cb -0.20 -3.05 0.01 0.00 0.50 0.00 0.00 46.19 43.45 3f84 s LEU 128 CO 0.00 -0.21 -0.18 -0.69 -1.32 0.00 0.00 176.35 173.95 3f84 s VAL 129 N 1.37 2.35 -0.09 1.68 1.01 0.07 -1.51 120.40 125.28 3f84 s VAL 129 Ca 0.35 -0.87 0.04 0.00 0.00 0.00 0.00 61.98 61.49 3f84 s VAL 129 Cb -0.17 -1.97 0.00 0.00 0.00 0.00 0.00 36.38 34.24 3f84 s VAL 129 CO 0.14 0.53 -0.21 -0.04 0.00 0.00 0.00 175.10 175.52 3f84 s MET 130 N 0.92 2.67 0.17 2.72 -1.94 -0.55 -1.36 119.30 121.92 3f84 s MET 130 Ca -0.04 -0.76 0.07 0.00 -1.71 0.00 0.00 55.69 53.26 3f84 s MET 130 Cb -0.15 -2.06 -0.04 0.00 2.01 0.00 0.00 34.83 34.59 3f84 s MET 130 CO -0.03 0.15 -0.16 0.99 -0.01 0.00 0.00 175.02 175.96 3f84 s THR 131 N 0.40 1.64 -0.24 2.05 2.01 -0.03 -1.28 115.64 120.20 3f84 s THR 131 Ca -0.17 -1.96 -0.11 0.00 0.31 0.00 0.00 61.69 59.75 3f84 s THR 131 Cb -0.17 -1.82 -0.05 0.00 0.01 0.00 0.00 72.50 70.47 3f84 s THR 131 CO 0.07 -0.44 0.19 -0.76 -0.69 0.00 0.00 174.62 172.99 3f84 s LEU 132 N -2.83 4.12 -1.16 4.42 1.43 -1.16 -0.12 118.68 123.38 3f84 s LEU 132 Ca 0.16 0.16 -0.06 0.00 -1.03 0.00 0.00 54.13 53.37 3f84 s LEU 132 Cb -0.04 -2.16 0.04 0.00 0.03 0.00 0.00 46.19 44.06 3f84 s LEU 132 CO 0.05 0.04 0.31 0.61 0.23 0.00 0.00 176.35 177.60 3f84 n GLY 133 N 4.25 -0.49 7.00 -3.19 0.00 -1.04 -4.46 105.19 107.26 3f84 n GLY 133 Ca -0.14 0.06 0.00 0.00 0.00 0.00 0.00 46.02 45.94 3f84 n GLY 133 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 3f84 n SER 134 N -2.10 0.00 0.00 1.61 2.88 -1.26 -5.07 113.62 109.68 3f84 n SER 134 Ca -0.06 0.00 0.00 0.00 -1.33 0.00 0.00 58.87 57.48 3f84 n SER 134 Cb 0.57 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.03 3f84 n SER 134 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 3f84 n ASP 135 N 2.49 -1.23 -2.86 -3.46 9.92 -1.26 -3.98 116.55 116.16 3f84 n ASP 135 Ca 0.00 0.00 -0.29 0.00 -0.53 0.00 0.00 54.79 53.97 3f84 n ASP 135 Cb 0.00 0.00 -0.02 0.00 -0.64 0.00 0.00 41.12 40.46 3f84 n ASP 135 CO 0.00 0.00 0.00 0.59 0.13 0.00 0.00 177.20 177.92 3f84 n ASN 136 N -3.41 4.90 -3.77 -2.24 4.13 -1.26 -4.81 115.26 108.79 3f84 n ASN 136 Ca 0.00 -3.70 -0.42 0.00 1.68 0.00 0.00 54.58 52.13 3f84 n ASN 136 Cb 0.00 -0.60 0.00 0.00 -1.54 0.00 0.00 39.78 37.64 3f84 n ASN 136 CO 0.00 0.00 0.00 1.17 0.28 0.00 0.00 177.26 178.71 3f84 n LYS 137 N -0.31 3.02 -4.39 3.52 4.81 -1.26 -5.02 118.16 118.52 3f84 n LYS 137 Ca 0.35 -2.80 -0.21 0.00 -0.87 0.00 0.00 58.31 54.78 3f84 n LYS 137 Cb 0.45 -3.22 -0.13 0.00 0.02 0.00 0.00 35.03 32.15 3f84 n LYS 137 CO 0.00 0.00 0.00 -1.14 1.17 0.00 0.00 177.40 177.43 3f84 s GLN 138 N 2.63 0.98 -0.02 1.64 0.74 -1.26 -3.00 119.66 121.37 3f84 s GLN 138 Ca 0.46 -0.75 0.02 0.00 0.05 0.00 0.00 55.36 55.13 3f84 s GLN 138 Cb 0.13 -0.99 0.00 0.00 1.10 0.00 0.00 33.01 33.25 3f84 s GLN 138 CO -0.07 0.25 -0.07 0.54 -0.55 0.00 0.00 175.29 175.39 3f84 s VAL 139 N -0.81 0.64 -0.22 1.34 0.11 -0.41 -4.85 120.40 116.21 3f84 s VAL 139 Ca 0.02 -0.30 -0.04 0.00 -2.93 0.00 0.00 61.98 58.73 3f84 s VAL 139 Cb -0.08 -0.57 -0.01 0.00 -1.53 0.00 0.00 36.38 34.19 3f84 s VAL 139 CO 0.01 0.20 -0.03 -0.70 -3.33 0.00 0.00 175.10 171.26 3f84 s GLU 140 N 0.14 3.44 -0.31 1.54 2.12 -1.26 -1.49 118.70 122.88 3f84 s GLU 140 Ca -0.02 -0.60 -0.10 0.00 0.36 0.00 0.00 54.97 54.61 3f84 s GLU 140 Cb -0.07 -3.05 -0.02 0.00 0.26 0.00 0.00 34.13 31.26 3f84 s GLU 140 CO 0.00 -0.16 0.17 0.15 -0.54 0.00 0.00 175.26 174.88 3f84 s LYS 141 N 1.42 3.49 -0.22 4.30 -0.14 -0.57 -4.98 119.74 123.04 3f84 s LYS 141 Ca 0.05 -0.62 -0.11 0.00 -1.36 0.00 0.00 55.97 53.93 3f84 s LYS 141 Cb -0.14 -3.62 -0.05 0.00 -1.68 0.00 0.00 37.83 32.34 3f84 s LYS 141 CO -0.02 -0.37 0.19 -0.80 -0.76 0.00 0.00 175.35 173.59 3f84 s ASN 142 N 1.66 6.21 -0.19 2.83 0.01 -1.26 -0.63 114.94 123.57 3f84 s ASN 142 Ca 0.05 0.22 -0.00 0.00 -0.71 0.00 0.00 52.86 52.43 3f84 s ASN 142 Cb -0.17 -2.12 0.01 0.00 0.41 0.00 0.00 41.25 39.39 3f84 s ASN 142 CO 0.08 0.09 -0.16 -0.63 -1.51 0.00 0.00 177.10 174.96 3f84 s ILE 143 N 0.83 2.36 0.07 0.60 1.01 -0.02 -4.66 121.20 121.39 3f84 s ILE 143 Ca 0.10 -0.85 -0.31 0.00 0.00 0.00 0.00 60.65 59.59 3f84 s ILE 143 Cb -0.13 -2.02 -0.07 0.00 0.01 0.00 0.00 42.46 40.26 3f84 s ILE 143 CO 0.03 0.51 1.33 -0.89 0.00 0.00 0.00 174.94 175.92 3f84 s THR 144 N 1.33 3.62 -0.19 2.92 2.01 0.16 -0.40 115.64 125.09 3f84 s THR 144 Ca 0.05 1.14 0.01 0.00 0.31 0.00 0.00 61.69 63.19 3f84 s THR 144 Cb -0.13 -3.73 0.02 0.00 0.01 0.00 0.00 72.50 68.67 3f84 s THR 144 CO -0.11 0.07 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.03 3f84 s VAL 145 N 1.37 2.22 0.13 3.82 1.01 0.74 -0.08 120.40 129.61 3f84 s VAL 145 Ca 0.62 -0.95 0.11 0.00 0.00 0.00 0.00 61.98 61.76 3f84 s VAL 145 Cb -0.33 -1.97 -0.04 0.00 0.00 0.00 0.00 36.38 34.03 3f84 s VAL 145 CO 0.29 0.48 -0.26 0.42 0.00 0.00 0.00 175.10 176.03 3f84 s THR 146 N 1.29 2.16 0.09 3.92 -4.23 -0.54 0.00 115.64 118.34 3f84 s THR 146 Ca 0.04 -1.74 -0.00 0.00 -1.18 0.00 0.00 61.69 58.80 3f84 s THR 146 Cb -0.14 -1.93 -0.04 0.00 1.34 0.00 0.00 72.50 71.73 3f84 s THR 146 CO -0.11 0.04 -0.02 0.00 -0.54 0.00 0.00 174.62 173.99 3f84 s ALA 147 N -1.14 0.78 -0.13 3.99 0.00 -0.66 -1.92 121.76 122.69 3f84 s ALA 147 Ca 0.13 -1.33 -0.01 0.00 0.00 0.00 0.00 51.96 50.75 3f84 s ALA 147 Cb -0.10 0.39 0.04 0.00 0.00 0.00 0.00 23.12 23.44 3f84 s ALA 147 CO 0.06 -0.35 -0.03 -1.12 0.00 0.00 0.00 175.76 174.32 3f84 s SER 148 N -3.00 2.30 -0.48 0.00 0.01 -1.26 -0.73 113.70 110.54 3f84 s SER 148 Ca 0.13 -0.42 -0.15 0.00 1.31 0.00 0.00 55.95 56.82 3f84 s SER 148 Cb 0.07 -0.71 0.08 0.00 0.21 0.00 0.00 66.02 65.67 3f84 s SER 148 CO -0.05 -0.19 0.40 -0.69 0.41 0.00 0.00 173.24 173.12 3f84 s VAL 149 N 1.79 5.17 0.11 3.43 1.01 0.36 -4.66 120.40 127.60 3f84 s VAL 149 Ca 0.03 -1.13 -0.31 0.00 0.00 0.00 0.00 61.98 60.57 3f84 s VAL 149 Cb -0.14 -4.11 -0.10 0.00 0.00 0.00 0.00 36.38 32.02 3f84 s VAL 149 CO -0.07 -0.60 1.86 0.47 0.00 0.00 0.00 175.10 176.76 3f84 n ASP 150 N 5.19 4.07 -4.53 3.32 8.00 -1.26 -0.47 116.55 130.86 3f84 n ASP 150 Ca -0.12 0.97 -0.52 0.00 0.71 0.00 0.00 54.79 55.83 3f84 n ASP 150 Cb 0.43 -1.54 -0.05 0.00 -0.02 0.00 0.00 41.12 39.94 3f84 n ASP 150 CO 0.00 0.00 0.00 -2.65 -0.39 0.00 0.00 177.20 174.16 3f84 n PRO 151 N 5.92 0.68 -3.79 -0.24 -0.02 -1.26 -4.83 135.00 131.46 3f84 n PRO 151 Ca 0.18 0.24 -0.13 0.00 -2.02 0.00 0.00 63.50 61.78 3f84 n PRO 151 Cb 0.38 -1.70 -0.13 0.00 -0.02 0.00 0.00 33.50 32.03 3f84 n PRO 151 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 3f84 s VAL 152 N -0.14 -0.01 -0.03 -1.45 -7.23 -1.26 -4.97 120.40 105.31 3f84 s VAL 152 Ca 0.79 0.03 -0.01 0.00 -1.81 0.00 0.00 61.98 60.98 3f84 s VAL 152 Cb -0.99 -0.27 0.03 0.00 0.56 0.00 0.00 36.38 35.71 3f84 s VAL 152 CO 0.53 0.01 0.05 -0.51 -0.31 0.00 0.00 175.10 174.87 3f84 s ILE 153 N 0.32 -0.08 0.08 -0.62 2.07 -1.26 -1.85 121.20 119.86 3f84 s ILE 153 Ca -0.02 0.30 0.07 0.00 -1.41 0.00 0.00 60.65 59.59 3f84 s ILE 153 Cb -0.03 -0.12 -0.03 0.00 0.13 0.00 0.00 42.46 42.41 3f84 s ILE 153 CO -0.01 0.13 -0.19 -1.61 -1.91 0.00 0.00 174.94 171.34 3f84 s GLU 154 N 1.53 1.12 -0.18 3.50 2.02 -0.08 -4.67 118.70 121.94 3f84 s GLU 154 Ca -0.03 -1.03 0.01 0.00 0.02 0.00 0.00 54.97 53.94 3f84 s GLU 154 Cb -0.13 -1.28 0.02 0.00 0.10 0.00 0.00 34.13 32.85 3f84 s GLU 154 CO -0.03 0.30 -0.18 -1.17 0.02 0.00 0.00 175.26 174.20 3f84 s LEU 155 N -1.62 2.20 0.19 1.80 2.96 -1.26 -1.48 118.68 121.47 3f84 s LEU 155 Ca 0.05 -0.71 0.08 0.00 -0.22 0.00 0.00 54.13 53.33 3f84 s LEU 155 Cb -0.09 -1.44 -0.04 0.00 0.50 0.00 0.00 46.19 45.11 3f84 s LEU 155 CO 0.03 -0.03 -0.17 -0.76 -1.32 0.00 0.00 176.35 174.10 3f84 s LEU 156 N 1.30 2.50 0.46 -0.68 1.43 -0.67 -4.55 118.68 118.47 3f84 s LEU 156 Ca 0.03 -0.94 -0.23 0.00 -1.03 0.00 0.00 54.13 51.97 3f84 s LEU 156 Cb -0.14 -0.78 -0.10 0.00 0.03 0.00 0.00 46.19 45.21 3f84 s LEU 156 CO -0.12 -0.09 0.92 0.00 0.23 0.00 0.00 176.35 177.29 3f84 n GLN 157 N -0.04 1.12 0.28 1.70 6.02 -0.15 -0.41 117.38 125.91 3f84 n GLN 157 Ca -0.11 0.41 0.18 0.00 -0.01 0.00 0.00 57.00 57.48 3f84 n GLN 157 Cb 0.59 -1.98 0.97 0.00 1.02 0.00 0.00 30.24 30.83 3f84 n GLN 157 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 3f84 h ALA 158 N 1.18 1.43 -0.00 -1.58 0.00 -1.45 0.15 119.26 118.99 3f84 h ALA 158 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.46 3f84 h ALA 158 Cb 1.35 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.15 3f84 h ALA 158 CO 0.54 -0.16 -0.02 -0.40 0.00 0.00 0.00 179.25 179.22 3f84 n ASP 159 N -3.44 0.21 0.00 0.00 3.85 -1.26 -4.92 116.55 110.99 3f84 n ASP 159 Ca -0.01 -0.77 0.00 0.00 -0.71 0.00 0.00 54.79 53.30 3f84 n ASP 159 Cb 0.21 -0.08 0.00 0.00 -1.35 0.00 0.00 41.12 39.90 3f84 n ASP 159 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 3f84 n GLY 160 N 1.13 0.73 3.80 6.12 0.00 0.52 -5.07 105.19 112.42 3f84 n GLY 160 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.89 3f84 n GLY 160 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3f84 s ASN 161 N -2.58 5.96 0.45 1.61 -0.87 -1.26 -4.81 114.94 113.44 3f84 s ASN 161 Ca 0.00 1.85 -0.25 0.00 -1.57 0.00 0.00 52.86 52.89 3f84 s ASN 161 Cb 0.00 -2.54 -0.08 0.00 -0.02 0.00 0.00 41.25 38.61 3f84 s ASN 161 CO 0.00 -1.05 1.40 0.00 -2.57 0.00 0.00 177.10 174.88 3f84 s ALA 162 N -2.32 3.21 0.44 0.60 0.00 -1.26 -0.98 121.76 121.46 3f84 s ALA 162 Ca 0.65 1.42 -0.24 0.00 0.00 0.00 0.00 51.96 53.78 3f84 s ALA 162 Cb -0.16 -3.57 -0.09 0.00 0.00 0.00 0.00 23.12 19.30 3f84 s ALA 162 CO 0.32 -1.15 1.21 1.28 0.00 0.00 0.00 175.76 177.43 3f84 n LEU 163 N -0.22 3.90 -4.68 0.00 4.77 -1.26 -4.64 117.00 114.87 3f84 n LEU 163 Ca 0.05 1.06 -0.45 0.00 -0.03 0.00 0.00 56.01 56.65 3f84 n LEU 163 Cb 0.42 -1.47 -0.03 0.00 -2.33 0.00 0.00 43.42 40.01 3f84 n LEU 163 CO 0.58 -0.86 1.11 -2.65 -1.33 0.00 0.00 177.39 174.23 3f84 n PRO 164 N -0.10 2.16 0.07 3.23 -0.02 -1.26 -4.91 135.00 134.16 3f84 n PRO 164 Ca 0.08 0.77 0.13 0.00 -2.02 0.00 0.00 63.50 62.46 3f84 n PRO 164 Cb 0.40 -2.48 0.48 0.00 -0.02 0.00 0.00 33.50 31.88 3f84 n PRO 164 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 3f84 n SER 165 N 2.62 0.50 -3.86 2.55 3.41 -1.26 -4.77 113.62 112.82 3f84 n SER 165 Ca 0.13 0.56 -0.15 0.00 -0.26 0.00 0.00 58.87 59.15 3f84 n SER 165 Cb 0.31 -0.69 -0.15 0.00 -0.26 0.00 0.00 64.21 63.42 3f84 n SER 165 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 3f84 s ALA 166 N -3.08 0.19 -0.02 7.33 0.00 -1.26 -0.28 121.76 124.63 3f84 s ALA 166 Ca 0.11 0.05 0.01 0.00 0.00 0.00 0.00 51.96 52.13 3f84 s ALA 166 Cb 0.14 -0.15 0.01 0.00 0.00 0.00 0.00 23.12 23.12 3f84 s ALA 166 CO 0.54 -0.01 -0.04 0.08 0.00 0.00 0.00 175.76 176.32 3f84 s VAL 167 N 0.43 0.41 -0.18 0.00 1.01 0.23 -4.95 120.40 117.35 3f84 s VAL 167 Ca -0.04 -0.15 -0.00 0.00 0.00 0.00 0.00 61.98 61.79 3f84 s VAL 167 Cb -0.06 -0.40 0.01 0.00 0.00 0.00 0.00 36.38 35.93 3f84 s VAL 167 CO -0.01 0.15 -0.16 -0.75 0.00 0.00 0.00 175.10 174.33 3f84 s LYS 168 N 0.32 3.10 -0.24 2.72 2.36 -1.26 -0.25 119.74 126.50 3f84 s LYS 168 Ca -0.04 -0.78 -0.13 0.00 -2.55 0.00 0.00 55.97 52.48 3f84 s LYS 168 Cb -0.07 -2.67 -0.04 0.00 -1.05 0.00 0.00 37.83 34.00 3f84 s LYS 168 CO -0.00 -0.17 0.27 -0.51 1.55 0.00 0.00 175.35 176.49 3f84 s LEU 169 N 1.25 4.10 0.36 5.43 1.43 -0.07 -4.91 118.68 126.27 3f84 s LEU 169 Ca 0.03 0.25 -0.27 0.00 -1.03 0.00 0.00 54.13 53.11 3f84 s LEU 169 Cb -0.14 -2.29 -0.09 0.00 0.03 0.00 0.00 46.19 43.70 3f84 s LEU 169 CO -0.09 -0.04 1.19 0.00 0.23 0.00 0.00 176.35 177.64 3f84 s ALA 170 N 1.42 3.28 -0.21 4.21 0.00 -1.25 -4.40 121.76 124.80 3f84 s ALA 170 Ca 0.12 1.03 -0.08 0.00 0.00 0.00 0.00 51.96 53.03 3f84 s ALA 170 Cb -0.15 -3.39 -0.04 0.00 0.00 0.00 0.00 23.12 19.54 3f84 s ALA 170 CO 0.07 -0.49 0.09 -0.47 0.00 0.00 0.00 175.76 174.96 3f84 s TYR 171 N -1.30 3.22 -0.48 0.00 5.04 -1.26 -0.55 117.35 122.01 3f84 s TYR 171 Ca 0.53 -0.00 -0.20 0.00 -2.44 0.00 0.00 57.07 54.96 3f84 s TYR 171 Cb -0.33 -2.17 0.05 0.00 0.35 0.00 0.00 41.96 39.86 3f84 s TYR 171 CO 0.42 0.01 0.62 0.45 -1.34 0.00 0.00 175.55 175.71 3f84 s SER 172 N 0.85 6.25 0.50 4.32 0.15 0.77 -4.95 113.70 121.58 3f84 s SER 172 Ca 0.05 -0.73 0.29 0.00 0.70 0.00 0.00 55.95 56.25 3f84 s SER 172 Cb -0.13 -2.30 1.12 0.00 -1.71 0.00 0.00 66.02 63.00 3f84 s SER 172 CO 0.03 -0.85 1.90 -0.65 1.20 0.00 0.00 173.24 174.86 3f84 h PRO 173 N 8.96 0.00 0.36 5.44 0.11 -1.86 0.56 132.00 145.57 3f84 h PRO 173 Ca -0.27 0.00 -0.02 0.00 0.11 0.00 0.00 66.00 65.82 3f84 h PRO 173 Cb 1.10 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.21 3f84 h PRO 173 CO 0.94 0.11 -0.17 0.00 -0.21 0.00 0.00 178.00 178.66 3f84 h ALA 174 N 1.89 -0.86 0.00 -0.75 0.00 -1.96 -3.34 119.26 114.24 3f84 h ALA 174 Ca -0.00 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 54.80 3f84 h ALA 174 Cb 0.64 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.61 3f84 h ALA 174 CO 0.01 -0.83 0.00 -1.13 0.00 0.00 0.00 179.25 177.31 3f84 n SER 175 N -3.65 0.69 -1.71 0.00 3.41 -1.22 -4.90 113.62 106.24 3f84 n SER 175 Ca -0.06 0.64 -0.18 0.00 -0.26 0.00 0.00 58.87 59.02 3f84 n SER 175 Cb 0.19 -0.80 -0.04 0.00 -0.26 0.00 0.00 64.21 63.30 3f84 n SER 175 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 3f84 n LYS 176 N -2.23 -1.33 -4.62 4.33 4.76 0.17 -5.00 118.16 114.24 3f84 n LYS 176 Ca 0.03 0.98 -0.29 0.00 -2.87 0.00 0.00 58.31 56.16 3f84 n LYS 176 Cb 0.27 -5.35 -0.08 0.00 -1.84 0.00 0.00 35.03 28.03 3f84 n LYS 176 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 3f84 s THR 177 N -2.78 0.87 -0.05 -0.18 -4.23 -1.09 -4.74 115.64 103.44 3f84 s THR 177 Ca 0.00 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.51 3f84 s THR 177 Cb 0.00 -2.28 -0.03 0.00 1.34 0.00 0.00 72.50 71.52 3f84 s THR 177 CO 0.00 0.00 -0.04 -0.36 -0.54 0.00 0.00 174.62 173.68 3f84 s PHE 178 N -3.06 3.02 -0.24 3.99 0.40 -1.26 -0.16 117.98 120.67 3f84 s PHE 178 Ca 0.16 0.08 -0.29 0.00 -0.60 0.00 0.00 56.93 56.28 3f84 s PHE 178 Cb 0.02 -1.71 -0.01 0.00 0.51 0.00 0.00 43.02 41.83 3f84 s PHE 178 CO 0.10 0.40 1.30 -2.00 0.70 0.00 0.00 175.22 175.71 3f84 s GLU 179 N -1.03 4.05 0.20 0.44 2.56 0.29 -4.87 118.70 120.33 3f84 s GLU 179 Ca 0.14 1.44 -0.32 0.00 0.00 0.00 0.00 54.97 56.23 3f84 s GLU 179 Cb -0.11 -3.84 -0.14 0.00 2.00 0.00 0.00 34.13 32.04 3f84 s GLU 179 CO 0.04 -0.95 1.39 0.43 -0.56 0.00 0.00 175.26 175.61 3f84 n SER 180 N 7.23 2.47 -4.73 -1.70 7.64 -1.26 -3.96 113.62 119.30 3f84 n SER 180 Ca 0.15 1.13 -0.41 0.00 1.01 0.00 0.00 58.87 60.74 3f84 n SER 180 Cb 0.46 -1.37 -0.04 0.00 -1.01 0.00 0.00 64.21 62.25 3f84 n SER 180 CO 0.00 0.00 0.00 -0.47 -3.01 0.00 0.00 175.04 171.56 3f84 s TYR 181 N 0.16 3.50 -0.09 1.43 5.04 0.48 -4.94 117.35 122.93 3f84 s TYR 181 Ca 0.73 1.47 -0.02 0.00 -2.44 0.00 0.00 57.07 56.81 3f84 s TYR 181 Cb -0.72 -3.36 0.03 0.00 0.35 0.00 0.00 41.96 38.27 3f84 s TYR 181 CO 0.47 -0.96 0.03 1.03 -1.34 0.00 0.00 175.55 174.78 3f84 s ARG 182 N 0.03 0.42 -0.03 4.97 0.52 -1.26 -1.15 118.95 122.45 3f84 s ARG 182 Ca 0.53 0.09 0.04 0.00 -0.52 0.00 0.00 55.73 55.87 3f84 s ARG 182 Cb -0.30 -1.07 -0.00 0.00 0.52 0.00 0.00 34.95 34.09 3f84 s ARG 182 CO 0.34 -0.38 -0.14 0.54 0.02 0.00 0.00 175.30 175.68 3f84 s VAL 183 N 2.02 1.19 0.08 3.52 0.11 -0.29 -5.00 120.40 122.02 3f84 s VAL 183 Ca 0.04 -0.60 -0.26 0.00 -2.93 0.00 0.00 61.98 58.24 3f84 s VAL 183 Cb -0.13 -1.02 -0.06 0.00 -1.53 0.00 0.00 36.38 33.63 3f84 s VAL 183 CO -0.05 0.35 0.81 -0.04 -3.33 0.00 0.00 175.10 172.83 3f84 s MET 184 N 0.01 4.55 0.09 1.54 -1.94 -1.26 -0.29 119.30 122.00 3f84 s MET 184 Ca -0.02 1.16 0.02 0.00 -1.71 0.00 0.00 55.69 55.15 3f84 s MET 184 Cb -0.10 -3.34 -0.04 0.00 2.01 0.00 0.00 34.83 33.36 3f84 s MET 184 CO 0.01 0.33 -0.07 0.95 -0.01 0.00 0.00 175.02 176.23 3f84 s THR 185 N -0.27 0.73 -0.01 2.05 -4.23 0.12 -1.28 115.64 112.75 3f84 s THR 185 Ca 0.40 -1.75 0.01 0.00 -1.18 0.00 0.00 61.69 59.17 3f84 s THR 185 Cb -0.22 -1.45 0.00 0.00 1.34 0.00 0.00 72.50 72.18 3f84 s THR 185 CO 0.25 -0.73 -0.02 -1.10 -0.54 0.00 0.00 174.62 172.47 3f84 s GLN 186 N -3.28 0.26 -0.14 3.99 -0.21 0.45 0.64 119.66 121.37 3f84 s GLN 186 Ca 0.07 -0.07 -0.24 0.00 0.02 0.00 0.00 55.36 55.14 3f84 s GLN 186 Cb 0.01 -0.29 -0.02 0.00 1.00 0.00 0.00 33.01 33.71 3f84 s GLN 186 CO -0.03 0.02 0.77 0.54 -2.12 0.00 0.00 175.29 174.48 3f84 s VAL 187 N 0.15 4.95 -0.36 1.09 0.11 -1.26 -1.67 120.40 123.41 3f84 s VAL 187 Ca -0.01 1.54 -0.13 0.00 -2.93 0.00 0.00 61.98 60.44 3f84 s VAL 187 Cb -0.04 -4.09 -0.01 0.00 -1.53 0.00 0.00 36.38 30.72 3f84 s VAL 187 CO -0.00 0.11 0.25 -1.00 -3.33 0.00 0.00 175.10 171.13 3f84 s HIS 188 N 1.69 3.23 -0.03 1.54 3.76 -0.55 -1.35 115.29 123.58 3f84 s HIS 188 Ca 0.37 -0.34 0.01 0.00 -0.15 0.00 0.00 55.06 54.95 3f84 s HIS 188 Cb -0.17 -2.50 0.02 0.00 1.11 0.00 0.00 32.58 31.04 3f84 s HIS 188 CO 0.14 -0.43 -0.02 -0.08 -0.85 0.00 0.00 174.74 173.50 3f84 s THR 189 N 1.70 0.31 0.40 1.30 -1.32 0.19 -0.90 115.64 117.33 3f84 s THR 189 Ca 0.06 -0.03 0.18 0.00 -1.21 0.00 0.00 61.69 60.68 3f84 s THR 189 Cb -0.18 -0.35 0.39 0.00 -1.51 0.00 0.00 72.50 70.85 3f84 s THR 189 CO 0.10 0.15 1.79 0.78 -2.21 0.00 0.00 174.62 175.23 3f84 h ASN 190 N 6.94 0.44 -2.74 8.08 4.21 -1.65 -3.41 115.58 127.45 3f84 h ASN 190 Ca -0.38 0.07 -0.61 0.00 1.21 0.00 0.00 56.30 56.59 3f84 h ASN 190 Cb 1.15 0.00 -0.42 0.00 -1.12 0.00 0.00 38.32 37.94 3f84 h ASN 190 CO 0.48 0.11 -0.63 -0.67 -1.29 0.00 0.00 177.43 175.43 3f84 n ASP 191 N -4.60 2.82 -0.03 5.81 -0.08 -1.26 -1.79 116.55 117.42 3f84 n ASP 191 Ca 0.24 -3.18 0.13 0.00 -1.51 0.00 0.00 54.79 50.47 3f84 n ASP 191 Cb 0.84 -0.71 0.78 0.00 2.34 0.00 0.00 41.12 44.37 3f84 n ASP 191 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3f84 n ALA 192 N 1.71 2.65 0.66 -1.67 0.00 -1.26 -2.22 120.51 120.38 3f84 n ALA 192 Ca 0.24 -0.18 0.10 0.00 0.00 0.00 0.00 53.44 53.60 3f84 n ALA 192 Cb 0.38 -1.42 -0.11 0.00 0.00 0.00 0.00 19.45 18.30 3f84 n ALA 192 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 3f84 n THR 193 N -0.86 0.02 -2.97 0.00 -2.24 -1.26 -4.83 114.28 102.14 3f84 n THR 193 Ca 0.20 -0.17 -0.38 0.00 -2.27 0.00 0.00 64.05 61.43 3f84 n THR 193 Cb 0.11 0.61 -0.06 0.00 -2.10 0.00 0.00 70.33 68.88 3f84 n THR 193 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3f84 s LYS 194 N -3.17 4.48 0.33 -0.78 -0.14 -0.94 -4.65 119.74 114.86 3f84 s LYS 194 Ca 0.03 1.11 -0.25 0.00 -1.36 0.00 0.00 55.97 55.50 3f84 s LYS 194 Cb 0.15 -3.03 -0.14 0.00 -1.68 0.00 0.00 37.83 33.13 3f84 s LYS 194 CO 0.87 0.44 0.61 1.63 -0.76 0.00 0.00 175.35 178.14 3f84 n LYS 195 N 1.06 0.55 -3.73 1.68 5.02 -1.26 -4.28 118.16 117.21 3f84 n LYS 195 Ca -0.03 0.20 -0.37 0.00 -2.02 0.00 0.00 58.31 56.09 3f84 n LYS 195 Cb 0.50 -1.40 -0.12 0.00 -0.02 0.00 0.00 35.03 33.98 3f84 n LYS 195 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 3f84 s VAL 196 N -1.26 4.31 -0.29 -0.18 1.01 -0.04 -0.92 120.40 123.04 3f84 s VAL 196 Ca 0.62 -0.36 -0.12 0.00 0.00 0.00 0.00 61.98 62.12 3f84 s VAL 196 Cb -0.72 -3.11 -0.04 0.00 0.00 0.00 0.00 36.38 32.50 3f84 s VAL 196 CO 0.58 0.20 0.23 -0.63 0.00 0.00 0.00 175.10 175.49 3f84 s ILE 197 N 1.59 5.28 -0.16 2.22 1.01 -0.17 0.63 121.20 131.60 3f84 s ILE 197 Ca 0.05 0.16 0.02 0.00 0.00 0.00 0.00 60.65 60.87 3f84 s ILE 197 Cb -0.16 -3.59 0.01 0.00 0.01 0.00 0.00 42.46 38.73 3f84 s ILE 197 CO 0.04 0.18 -0.20 -0.69 0.00 0.00 0.00 174.94 174.27 3f84 s VAL 198 N 1.81 2.16 0.38 2.92 1.01 -0.44 -0.20 120.40 128.04 3f84 s VAL 198 Ca 0.08 -0.93 0.04 0.00 0.00 0.00 0.00 61.98 61.17 3f84 s VAL 198 Cb -0.16 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.30 3f84 s VAL 198 CO 0.11 0.54 0.15 -1.59 0.00 0.00 0.00 175.10 174.31 3f84 s LYS 199 N 1.00 1.84 -0.16 2.72 -2.85 -0.75 -2.21 119.74 119.34 3f84 s LYS 199 Ca -0.02 -2.10 -0.06 0.00 -1.00 0.00 0.00 55.97 52.79 3f84 s LYS 199 Cb -0.15 -0.43 -0.04 0.00 -2.06 0.00 0.00 37.83 35.16 3f84 s LYS 199 CO -0.06 -0.48 0.02 -0.51 0.10 0.00 0.00 175.35 174.43 3f84 s LEU 200 N -3.54 3.62 0.46 2.77 1.43 0.46 -1.82 118.68 122.06 3f84 s LEU 200 Ca 0.28 0.03 0.22 0.00 -1.03 0.00 0.00 54.13 53.63 3f84 s LEU 200 Cb 0.03 -1.89 1.11 0.00 0.03 0.00 0.00 46.19 45.47 3f84 s LEU 200 CO 0.17 0.20 1.94 0.00 0.23 0.00 0.00 176.35 178.89 3f84 h ALA 201 N 6.48 1.25 -2.68 4.21 0.00 -1.71 -3.34 119.26 123.47 3f84 h ALA 201 Ca -0.37 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.28 3f84 h ALA 201 Cb 1.18 -0.04 -0.14 0.00 0.00 0.00 0.00 17.79 18.79 3f84 h ALA 201 CO 0.66 0.27 -0.10 -0.51 0.00 0.00 0.00 179.25 179.58 3f84 s ASP 202 N -6.39 -0.23 -0.28 0.00 1.01 -1.26 -5.03 116.67 104.49 3f84 s ASP 202 Ca -0.02 -0.25 -0.29 0.00 0.71 0.00 0.00 52.55 52.70 3f84 s ASP 202 Cb 0.13 0.45 -0.01 0.00 1.01 0.00 0.00 42.92 44.50 3f84 s ASP 202 CO 0.64 -0.80 1.44 -0.89 0.21 0.00 0.00 175.17 175.77 3f84 s THR 203 N -3.46 3.94 0.39 -1.27 2.01 -1.26 -4.75 115.64 111.25 3f84 s THR 203 Ca 0.01 1.05 -0.21 0.00 0.31 0.00 0.00 61.69 62.85 3f84 s THR 203 Cb 0.01 -3.98 -0.10 0.00 0.01 0.00 0.00 72.50 68.44 3f84 s THR 203 CO -0.09 -0.42 0.92 -2.16 -0.69 0.00 0.00 174.62 172.17 3f84 s PRO 204 N 4.44 4.28 -0.06 4.92 0.04 -1.26 -5.02 135.00 142.34 3f84 s PRO 204 Ca 0.63 1.11 -0.05 0.00 0.04 0.00 0.00 61.00 62.73 3f84 s PRO 204 Cb -0.20 -2.36 0.02 0.00 0.04 0.00 0.00 34.50 32.00 3f84 s PRO 204 CO 0.26 0.07 0.15 -0.65 0.04 0.00 0.00 177.00 176.87 3f84 s GLN 205 N -2.88 0.16 -0.13 4.56 -1.52 -1.26 -2.02 119.66 116.56 3f84 s GLN 205 Ca 0.58 0.24 -0.24 0.00 -1.95 0.00 0.00 55.36 53.99 3f84 s GLN 205 Cb -0.11 0.03 -0.02 0.00 -0.22 0.00 0.00 33.01 32.68 3f84 s GLN 205 CO 0.16 -0.05 0.75 -0.51 -0.25 0.00 0.00 175.29 175.40 3f84 s LEU 206 N 0.29 4.23 -0.12 2.90 1.43 0.12 -4.04 118.68 123.49 3f84 s LEU 206 Ca -0.02 1.14 0.01 0.00 -1.03 0.00 0.00 54.13 54.23 3f84 s LEU 206 Cb -0.03 -3.13 -0.02 0.00 0.03 0.00 0.00 46.19 43.04 3f84 s LEU 206 CO -0.01 -0.27 -0.14 -0.89 0.23 0.00 0.00 176.35 175.27 3f84 s THR 207 N 1.58 2.98 -0.28 5.49 2.01 0.67 0.07 115.64 128.16 3f84 s THR 207 Ca 0.37 -0.70 -0.34 0.00 0.31 0.00 0.00 61.69 61.33 3f84 s THR 207 Cb -0.17 -2.23 -0.11 0.00 0.01 0.00 0.00 72.50 70.00 3f84 s THR 207 CO 0.15 0.54 2.11 -0.67 -0.69 0.00 0.00 174.62 176.05 3f84 n ASP 208 N 3.35 2.54 0.16 3.53 -0.08 -0.01 -0.88 116.55 125.17 3f84 n ASP 208 Ca -0.18 0.53 0.12 0.00 -1.51 0.00 0.00 54.79 53.75 3f84 n ASP 208 Cb 0.53 -1.31 0.59 0.00 2.34 0.00 0.00 41.12 43.26 3f84 n ASP 208 CO 0.00 0.00 0.00 0.58 0.12 0.00 0.00 177.20 177.90 3f84 h VAL 209 N 6.67 0.00 0.00 5.18 2.07 -1.77 -2.02 116.25 126.39 3f84 h VAL 209 Ca -0.34 -0.09 0.00 0.00 0.82 0.00 0.00 66.70 67.08 3f84 h VAL 209 Cb 1.30 0.69 0.00 0.00 -1.52 0.00 0.00 31.29 31.76 3f84 h VAL 209 CO 0.99 0.00 -0.72 0.18 0.02 0.00 0.00 177.57 178.04 3f84 n LEU 210 N -2.31 0.67 -3.49 2.57 4.77 -1.26 -4.89 117.00 113.06 3f84 n LEU 210 Ca -0.00 -0.48 -0.25 0.00 -0.03 0.00 0.00 56.01 55.24 3f84 n LEU 210 Cb 0.11 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.07 3f84 n LEU 210 CO 0.14 0.17 -0.28 0.21 -1.33 0.00 0.00 177.39 176.30 3f84 s ASN 211 N -2.43 2.86 0.62 -1.43 3.84 -0.76 -5.03 114.94 112.63 3f84 s ASN 211 Ca 0.05 -1.22 0.33 0.00 0.21 0.00 0.00 52.86 52.23 3f84 s ASN 211 Cb 0.11 -0.07 1.84 0.00 -0.55 0.00 0.00 41.25 42.58 3f84 s ASN 211 CO 0.60 -0.41 2.13 0.77 -2.79 0.00 0.00 177.10 177.41 3f84 h SER 212 N 8.20 0.00 1.11 -4.21 4.64 -1.91 -0.50 113.55 120.88 3f84 h SER 212 Ca -0.15 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.17 3f84 h SER 212 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 3f84 h SER 212 CO 0.39 0.00 -0.71 0.71 -0.87 0.00 0.00 176.83 176.35 3f84 h THR 213 N 0.00 0.00 -2.26 2.95 1.35 -1.96 -3.42 112.91 109.56 3f84 h THR 213 Ca 0.05 -0.81 -0.65 0.00 -0.55 0.00 0.00 66.41 64.44 3f84 h THR 213 Cb 0.40 1.42 -0.15 0.00 -1.73 0.00 0.00 68.15 68.09 3f84 h THR 213 CO -0.00 0.00 0.87 -0.69 -0.25 0.00 0.00 175.52 175.45 3f84 s VAL 214 N -3.27 4.43 0.10 6.82 1.01 -0.20 -5.01 120.40 124.29 3f84 s VAL 214 Ca 0.03 -1.00 0.03 0.00 0.00 0.00 0.00 61.98 61.04 3f84 s VAL 214 Cb 0.10 -4.80 -0.04 0.00 0.00 0.00 0.00 36.38 31.64 3f84 s VAL 214 CO 0.74 -1.58 0.13 -1.10 0.00 0.00 0.00 175.10 173.30 3f84 s GLN 215 N 3.60 3.02 -0.02 2.72 -0.21 -1.26 -0.83 119.66 126.68 3f84 s GLN 215 Ca 0.32 -0.69 0.01 0.00 0.02 0.00 0.00 55.36 55.02 3f84 s GLN 215 Cb -0.08 -2.78 0.01 0.00 1.00 0.00 0.00 33.01 31.17 3f84 s GLN 215 CO -0.03 0.55 -0.05 0.00 -2.12 0.00 0.00 175.29 173.65 3f84 s MET 216 N -2.66 0.59 0.43 2.91 0.23 0.11 -4.84 119.30 116.06 3f84 s MET 216 Ca 0.31 -0.13 -0.26 0.00 -1.03 0.00 0.00 55.69 54.58 3f84 s MET 216 Cb -0.12 -0.61 -0.09 0.00 -1.53 0.00 0.00 34.83 32.49 3f84 s MET 216 CO 0.24 0.01 1.39 -2.14 -2.03 0.00 0.00 175.02 172.49 3f84 s PRO 217 N 0.42 3.81 -0.10 3.16 0.02 -1.19 0.10 135.00 141.23 3f84 s PRO 217 Ca -0.05 2.34 -0.09 0.00 0.02 0.00 0.00 61.00 63.22 3f84 s PRO 217 Cb -0.09 -2.71 -0.04 0.00 0.02 0.00 0.00 34.50 31.68 3f84 s PRO 217 CO -0.00 -0.68 0.21 0.42 -0.33 0.00 0.00 177.00 176.61 3f84 s ILE 218 N -1.22 5.39 -0.09 2.83 1.01 -0.86 -2.62 121.20 125.64 3f84 s ILE 218 Ca 0.59 0.37 0.00 0.00 0.00 0.00 0.00 60.65 61.61 3f84 s ILE 218 Cb -0.42 -3.48 -0.03 0.00 0.01 0.00 0.00 42.46 38.54 3f84 s ILE 218 CO 0.54 0.59 -0.09 -0.94 0.00 0.00 0.00 174.94 175.05 3f84 s SER 219 N -0.93 4.44 -0.13 3.58 1.04 0.04 -4.65 113.70 117.09 3f84 s SER 219 Ca 0.17 -0.13 0.02 0.00 0.48 0.00 0.00 55.95 56.49 3f84 s SER 219 Cb -0.13 -1.29 0.01 0.00 0.10 0.00 0.00 66.02 64.71 3f84 s SER 219 CO 0.06 0.29 -0.17 -0.69 0.98 0.00 0.00 173.24 173.71 3f84 s VAL 220 N -0.39 1.70 0.01 5.02 1.01 -1.26 -1.08 120.40 125.42 3f84 s VAL 220 Ca 0.05 -0.76 0.08 0.00 0.00 0.00 0.00 61.98 61.36 3f84 s VAL 220 Cb -0.12 -1.54 -0.02 0.00 0.00 0.00 0.00 36.38 34.69 3f84 s VAL 220 CO 0.02 0.48 -0.25 -0.94 0.00 0.00 0.00 175.10 174.41 3f84 s SER 221 N 1.01 3.17 -0.03 3.32 1.04 -0.07 -0.94 113.70 121.20 3f84 s SER 221 Ca -0.05 -0.52 0.02 0.00 0.48 0.00 0.00 55.95 55.89 3f84 s SER 221 Cb -0.15 -0.35 0.01 0.00 0.10 0.00 0.00 66.02 65.64 3f84 s SER 221 CO -0.03 0.29 -0.07 0.86 0.98 0.00 0.00 173.24 175.26 3f84 s TRP 222 N -0.72 0.88 -1.88 5.02 -0.00 -0.43 -0.93 118.94 120.89 3f84 s TRP 222 Ca 0.11 -0.24 0.00 0.00 -0.00 0.00 0.00 56.10 55.97 3f84 s TRP 222 Cb -0.10 -0.67 0.00 0.00 -0.00 0.00 0.00 33.47 32.69 3f84 s TRP 222 CO 0.01 -0.14 0.00 0.41 -0.00 0.00 0.00 176.95 177.23 3f84 n GLY 223 N 3.56 0.34 1.54 5.86 0.00 -1.08 -1.09 105.19 114.31 3f84 n GLY 223 Ca -0.21 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.81 3f84 n GLY 223 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3f84 n GLY 224 N -0.78 1.11 3.50 -0.02 0.00 -1.26 -4.99 105.19 102.75 3f84 n GLY 224 Ca -0.23 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.44 3f84 n GLY 224 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3f84 s GLN 225 N -0.49 3.72 0.11 1.61 -1.52 -0.25 -5.08 119.66 117.76 3f84 s GLN 225 Ca 0.00 -0.47 -0.31 0.00 -1.95 0.00 0.00 55.36 52.63 3f84 s GLN 225 Cb 0.00 -3.15 -0.10 0.00 -0.22 0.00 0.00 33.01 29.53 3f84 s GLN 225 CO 0.00 0.05 1.87 0.28 -0.25 0.00 0.00 175.29 177.24 3f84 n VAL 226 N 4.15 0.43 -3.60 1.09 0.31 -1.26 -1.31 118.33 118.14 3f84 n VAL 226 Ca -0.17 -0.08 -0.22 0.00 -0.01 0.00 0.00 64.34 63.87 3f84 n VAL 226 Cb 0.52 -2.18 -0.01 0.00 -0.91 0.00 0.00 33.84 31.26 3f84 n VAL 226 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 3f84 s LEU 227 N 3.02 4.10 0.00 7.52 1.43 -0.12 -4.95 118.68 129.68 3f84 s LEU 227 Ca 0.83 0.18 -0.04 0.00 -1.03 0.00 0.00 54.13 54.06 3f84 s LEU 227 Cb -0.46 -3.02 0.02 0.00 0.03 0.00 0.00 46.19 42.75 3f84 s LEU 227 CO 0.38 -0.26 0.24 -1.54 0.23 0.00 0.00 176.35 175.39 3f84 n SER 228 N -1.64 -0.68 0.23 2.29 3.41 -1.26 -4.64 113.62 111.33 3f84 n SER 228 Ca -0.05 -1.47 0.10 0.00 -0.26 0.00 0.00 58.87 57.19 3f84 n SER 228 Cb 0.57 1.14 0.53 0.00 -0.26 0.00 0.00 64.21 66.19 3f84 n SER 228 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 175.04 175.59 3f84 h THR 229 N 1.29 0.60 -3.15 6.66 1.35 -1.90 0.13 112.91 117.89 3f84 h THR 229 Ca -0.10 -0.98 -0.57 0.00 -0.55 0.00 0.00 66.41 64.22 3f84 h THR 229 Cb 0.37 1.65 -0.04 0.00 -1.73 0.00 0.00 68.15 68.39 3f84 h THR 229 CO 0.13 0.21 0.68 -0.89 -0.25 0.00 0.00 175.52 175.40 3f84 s THR 230 N -3.83 4.65 0.26 6.82 2.01 -1.26 -4.63 115.64 119.67 3f84 s THR 230 Ca -0.01 1.95 -0.31 0.00 0.31 0.00 0.00 61.69 63.64 3f84 s THR 230 Cb 0.11 -4.26 -0.11 0.00 0.01 0.00 0.00 72.50 68.25 3f84 s THR 230 CO 0.63 -0.07 1.61 0.00 -0.69 0.00 0.00 174.62 176.10 3f84 s ALA 231 N 2.54 3.79 -0.13 7.40 0.00 -1.26 -4.82 121.76 129.28 3f84 s ALA 231 Ca 0.48 1.54 -0.01 0.00 0.00 0.00 0.00 51.96 53.97 3f84 s ALA 231 Cb -0.18 -3.65 -0.02 0.00 0.00 0.00 0.00 23.12 19.27 3f84 s ALA 231 CO 0.14 -0.93 -0.10 0.15 0.00 0.00 0.00 175.76 175.02 3f84 s LYS 232 N 0.03 3.36 0.13 0.00 1.02 -0.94 -4.96 119.74 118.39 3f84 s LYS 232 Ca 0.66 -0.62 -0.19 0.00 0.02 0.00 0.00 55.97 55.84 3f84 s LYS 232 Cb -0.47 -2.70 -0.07 0.00 -0.52 0.00 0.00 37.83 34.06 3f84 s LYS 232 CO 0.42 0.29 0.63 -1.21 -0.92 0.00 0.00 175.35 174.57 3f84 s GLU 233 N 0.17 4.23 -0.24 1.68 2.02 -1.26 -1.33 118.70 123.97 3f84 s GLU 233 Ca -0.05 0.79 0.02 0.00 0.02 0.00 0.00 54.97 55.74 3f84 s GLU 233 Cb -0.15 -3.12 0.05 0.00 0.10 0.00 0.00 34.13 31.01 3f84 s GLU 233 CO 0.04 0.55 -0.13 -0.06 0.02 0.00 0.00 175.26 175.69 3f84 s PHE 234 N -1.26 3.13 0.15 1.61 0.40 0.20 -4.98 117.98 117.23 3f84 s PHE 234 Ca 0.34 -2.09 -0.34 0.00 -0.60 0.00 0.00 56.93 54.24 3f84 s PHE 234 Cb -0.19 -1.94 -0.14 0.00 0.51 0.00 0.00 43.02 41.26 3f84 s PHE 234 CO 0.21 -0.85 1.53 0.39 0.70 0.00 0.00 175.22 177.19 3f84 n GLU 235 N 4.50 1.96 -0.33 0.44 -0.58 -1.26 -0.86 120.64 124.51 3f84 n GLU 235 Ca -0.16 0.71 0.17 0.00 -0.42 0.00 0.00 57.16 57.46 3f84 n GLU 235 Cb 0.44 -2.45 0.37 0.00 -0.57 0.00 0.00 31.44 29.24 3f84 n GLU 235 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 3f84 h ALA 236 N 5.63 1.68 -0.91 0.62 0.00 -1.83 -1.50 119.26 122.95 3f84 h ALA 236 Ca -0.45 0.15 0.01 0.00 0.00 0.00 0.00 54.91 54.62 3f84 h ALA 236 Cb 1.27 0.09 -0.05 0.00 0.00 0.00 0.00 17.79 19.10 3f84 h ALA 236 CO 0.86 -0.34 0.60 0.00 0.00 0.00 0.00 179.25 180.37 3f84 h ALA 237 N 1.74 1.36 -0.45 0.00 0.00 -1.90 -2.46 119.26 117.55 3f84 h ALA 237 Ca 0.63 -0.06 -0.29 0.00 0.00 0.00 0.00 54.91 55.19 3f84 h ALA 237 Cb 1.24 -0.36 -0.13 0.00 0.00 0.00 0.00 17.79 18.53 3f84 h ALA 237 CO -0.52 0.59 0.37 0.00 0.00 0.00 0.00 179.25 179.69 3f84 n ALA 238 N -2.40 4.72 0.00 0.00 0.00 -0.57 -3.69 120.51 118.58 3f84 n ALA 238 Ca 0.11 -1.50 0.00 0.00 0.00 0.00 0.00 53.44 52.05 3f84 n ALA 238 Cb 0.03 -1.31 0.00 0.00 0.00 0.00 0.00 19.45 18.17 3f84 n ALA 238 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 3f84 n LEU 239 N 0.21 0.00 -1.12 0.00 4.77 -0.93 -4.85 117.00 115.07 3f84 n LEU 239 Ca 0.28 -0.01 -0.02 0.00 -0.03 0.00 0.00 56.01 56.24 3f84 n LEU 239 Cb 0.71 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.81 3f84 n LEU 239 CO 0.34 0.00 0.02 0.61 -1.33 0.00 0.00 177.39 177.02 3f84 n GLY 240 N 0.33 0.49 3.71 -0.72 0.00 -1.21 -1.35 105.19 106.44 3f84 n GLY 240 Ca 0.00 -0.47 -0.34 0.00 0.00 0.00 0.00 46.02 45.21 3f84 n GLY 240 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3f84 s TYR 241 N -3.04 1.89 0.01 1.61 1.51 -1.26 -2.44 117.35 115.63 3f84 s TYR 241 Ca 0.02 1.64 0.03 0.00 -1.01 0.00 0.00 57.07 57.75 3f84 s TYR 241 Cb -0.01 -3.50 -0.01 0.00 -0.11 0.00 0.00 41.96 38.33 3f84 s TYR 241 CO 0.08 -2.80 -0.10 0.45 -1.11 0.00 0.00 175.55 172.06 3f84 s SER 242 N -2.07 1.14 -0.07 2.29 0.15 -1.26 -5.00 113.70 108.88 3f84 s SER 242 Ca 0.74 -0.28 0.05 0.00 0.70 0.00 0.00 55.95 57.16 3f84 s SER 242 Cb -0.30 -0.09 0.26 0.00 -1.71 0.00 0.00 66.02 64.19 3f84 s SER 242 CO 0.48 0.05 0.94 0.00 1.20 0.00 0.00 173.24 175.91 3f84 n ALA 243 N 2.46 2.91 -1.78 5.45 0.00 -1.26 -3.87 120.51 124.41 3f84 n ALA 243 Ca -0.16 -0.60 0.00 0.00 0.00 0.00 0.00 53.44 52.68 3f84 n ALA 243 Cb 0.56 -1.04 0.00 0.00 0.00 0.00 0.00 19.45 18.98 3f84 n ALA 243 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 3f84 n SER 244 N 0.20 0.00 0.00 0.00 7.64 -1.26 -5.08 113.62 115.12 3f84 n SER 244 Ca 0.09 -1.00 0.00 0.00 1.01 0.00 0.00 58.87 58.97 3f84 n SER 244 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 3f84 n SER 244 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 3f84 n GLY 245 N 0.00 1.62 3.48 0.23 0.00 -1.25 -5.02 105.19 104.25 3f84 n GLY 245 Ca 0.00 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.59 3f84 n GLY 245 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f84 s VAL 246 N 3.59 4.57 0.01 1.61 1.01 -1.26 -4.98 120.40 124.95 3f84 s VAL 246 Ca 0.00 -1.54 -0.30 0.00 0.00 0.00 0.00 61.98 60.14 3f84 s VAL 246 Cb 0.00 -4.87 -0.06 0.00 0.00 0.00 0.00 36.38 31.45 3f84 s VAL 246 CO 0.00 -1.63 1.42 0.21 0.00 0.00 0.00 175.10 175.10 3f84 s ASN 247 N 3.85 6.83 0.00 3.32 3.84 -1.26 -2.43 114.94 129.10 3f84 s ASN 247 Ca 0.37 2.16 0.00 0.00 0.21 0.00 0.00 52.86 55.60 3f84 s ASN 247 Cb -0.03 -2.56 0.00 0.00 -0.55 0.00 0.00 41.25 38.11 3f84 s ASN 247 CO -0.08 -0.73 0.00 0.61 -2.79 0.00 0.00 177.10 174.12 3f84 n GLY 248 N 3.66 0.49 3.15 1.21 0.00 -1.26 -4.90 105.19 107.53 3f84 n GLY 248 Ca 0.13 -0.56 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 3f84 n GLY 248 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3f84 s VAL 249 N -2.00 1.80 0.94 1.61 1.01 -1.02 -0.64 120.40 122.11 3f84 s VAL 249 Ca 0.00 -0.86 -0.11 0.00 0.00 0.00 0.00 61.98 61.01 3f84 s VAL 249 Cb 0.00 -1.59 0.16 0.00 0.00 0.00 0.00 36.38 34.95 3f84 s VAL 249 CO 0.00 0.50 1.09 -0.94 0.00 0.00 0.00 175.10 175.75 3f84 s SER 250 N 0.58 2.99 1.01 3.32 1.04 -0.46 -4.42 113.70 117.76 3f84 s SER 250 Ca -0.14 1.61 -0.11 0.00 0.48 0.00 0.00 55.95 57.78 3f84 s SER 250 Cb -0.17 -2.26 0.20 0.00 0.10 0.00 0.00 66.02 63.89 3f84 s SER 250 CO 0.05 -2.96 1.09 -0.94 0.98 0.00 0.00 173.24 171.46 3f84 s SER 251 N -3.15 2.22 0.09 7.02 1.04 -0.46 -4.71 113.70 115.75 3f84 s SER 251 Ca 0.65 1.86 -0.32 0.00 0.48 0.00 0.00 55.95 58.62 3f84 s SER 251 Cb -0.20 -2.43 -0.11 0.00 0.10 0.00 0.00 66.02 63.38 3f84 s SER 251 CO 0.58 -3.48 1.83 -1.20 0.98 0.00 0.00 173.24 171.96 3f84 n SER 252 N -4.46 3.88 -4.33 7.02 7.64 -1.26 -4.66 113.62 117.45 3f84 n SER 252 Ca 0.08 0.98 -0.34 0.00 1.01 0.00 0.00 58.87 60.61 3f84 n SER 252 Cb 0.53 -1.51 -0.14 0.00 -1.01 0.00 0.00 64.21 62.08 3f84 n SER 252 CO 0.00 0.00 0.00 -1.10 -3.01 0.00 0.00 175.04 170.93 3f84 s GLN 253 N 2.93 3.37 -0.27 1.43 -1.52 0.21 -4.90 119.66 120.90 3f84 s GLN 253 Ca 0.84 -0.66 -0.29 0.00 -1.95 0.00 0.00 55.36 53.30 3f84 s GLN 253 Cb -0.53 -2.79 -0.02 0.00 -0.22 0.00 0.00 33.01 29.46 3f84 s GLN 253 CO 0.40 0.02 1.57 -2.00 -0.25 0.00 0.00 175.29 175.03 3f84 s GLU 254 N 0.86 3.72 -0.12 2.91 2.12 -1.26 0.16 118.70 127.09 3f84 s GLU 254 Ca -0.03 1.46 -0.28 0.00 0.36 0.00 0.00 54.97 56.48 3f84 s GLU 254 Cb -0.15 -4.03 -0.01 0.00 0.26 0.00 0.00 34.13 30.19 3f84 s GLU 254 CO 0.00 -1.39 0.95 -1.17 -0.54 0.00 0.00 175.26 173.12 3f84 s LEU 255 N 5.35 4.24 -0.17 2.70 2.96 0.60 -2.63 118.68 131.73 3f84 s LEU 255 Ca 0.69 1.43 0.01 0.00 -0.22 0.00 0.00 54.13 56.04 3f84 s LEU 255 Cb -0.22 -3.46 0.03 0.00 0.50 0.00 0.00 46.19 43.04 3f84 s LEU 255 CO 0.29 -0.42 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.08 3f84 s VAL 256 N 1.96 1.66 -0.14 1.68 1.01 -0.11 -1.14 120.40 125.32 3f84 s VAL 256 Ca 0.46 -0.77 0.01 0.00 0.00 0.00 0.00 61.98 61.68 3f84 s VAL 256 Cb -0.18 -1.59 -0.00 0.00 0.00 0.00 0.00 36.38 34.61 3f84 s VAL 256 CO 0.17 0.40 -0.17 -0.63 0.00 0.00 0.00 175.10 174.86 3f84 s ILE 257 N 1.44 2.54 0.21 2.22 1.01 -0.30 -0.89 121.20 127.43 3f84 s ILE 257 Ca 0.03 -0.82 -0.01 0.00 0.00 0.00 0.00 60.65 59.85 3f84 s ILE 257 Cb -0.14 -2.05 -0.04 0.00 0.01 0.00 0.00 42.46 40.24 3f84 s ILE 257 CO -0.10 0.53 0.13 -0.94 0.00 0.00 0.00 174.94 174.56 3f84 s SER 258 N 0.64 0.25 -0.02 3.58 1.04 -0.24 -0.39 113.70 118.55 3f84 s SER 258 Ca -0.09 -1.40 -0.12 0.00 0.48 0.00 0.00 55.95 54.82 3f84 s SER 258 Cb -0.16 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.35 3f84 s SER 258 CO 0.03 -0.84 0.26 0.00 0.98 0.00 0.00 173.24 173.66 3f84 s ALA 259 N -4.12 -0.64 0.11 5.32 0.00 -1.26 -0.78 121.76 120.39 3f84 s ALA 259 Ca 0.39 0.25 -0.20 0.00 0.00 0.00 0.00 51.96 52.40 3f84 s ALA 259 Cb 0.07 0.02 0.05 0.00 0.00 0.00 0.00 23.12 23.26 3f84 s ALA 259 CO 0.12 -0.23 0.48 0.00 0.00 0.00 0.00 175.76 176.14 3f84 s ALA 260 N -1.17 -1.21 0.71 0.00 0.00 -1.08 -4.23 121.76 114.78 3f84 s ALA 260 Ca -0.12 0.26 -0.16 0.00 0.00 0.00 0.00 51.96 51.94 3f84 s ALA 260 Cb -0.06 0.66 0.03 0.00 0.00 0.00 0.00 23.12 23.75 3f84 s ALA 260 CO 0.03 -0.64 1.25 -2.14 0.00 0.00 0.00 175.76 174.26 3f84 s PRO 261 N -3.42 2.19 0.25 0.00 0.02 -1.26 -3.17 135.00 129.61 3f84 s PRO 261 Ca 0.00 1.91 -0.05 0.00 0.02 0.00 0.00 61.00 62.88 3f84 s PRO 261 Cb 0.00 -1.82 0.49 0.00 0.02 0.00 0.00 34.50 33.19 3f84 s PRO 261 CO -0.10 -1.83 1.66 -0.22 -0.33 0.00 0.00 177.00 176.19 3f84 h LYS 262 N -0.06 0.19 -5.43 5.54 3.64 -1.93 -3.40 116.57 115.13 3f84 h LYS 262 Ca -0.49 -0.01 -0.65 0.00 -1.27 0.00 0.00 60.65 58.23 3f84 h LYS 262 Cb 1.32 -0.04 -0.21 0.00 -0.41 0.00 0.00 32.23 32.88 3f84 h LYS 262 CO 0.50 0.13 -0.68 0.99 -2.27 0.00 0.00 179.45 178.12 3f84 s THR 263 N -6.05 3.82 0.75 1.00 2.01 -1.26 -5.11 115.64 110.79 3f84 s THR 263 Ca -0.13 -0.39 -0.16 0.00 0.31 0.00 0.00 61.69 61.32 3f84 s THR 263 Cb 0.22 -2.65 -0.00 0.00 0.01 0.00 0.00 72.50 70.08 3f84 s THR 263 CO 0.76 0.51 0.76 0.00 -0.69 0.00 0.00 174.62 175.96 3f84 n ALA 264 N 3.31 -0.94 0.00 7.40 0.00 -1.26 -3.52 120.51 125.51 3f84 n ALA 264 Ca -0.18 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.01 3f84 n ALA 264 Cb 0.53 -1.99 0.00 0.00 0.00 0.00 0.00 19.45 17.98 3f84 n ALA 264 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f84 n GLY 265 N 1.30 2.76 3.77 0.00 0.00 -1.26 -5.01 105.19 106.75 3f84 n GLY 265 Ca 0.11 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3f84 n GLY 265 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 3f84 s THR 266 N -2.14 2.62 -0.48 2.61 2.01 -1.23 -5.01 115.64 114.02 3f84 s THR 266 Ca 0.00 0.62 -0.21 0.00 0.31 0.00 0.00 61.69 62.41 3f84 s THR 266 Cb 0.00 -3.39 0.04 0.00 0.01 0.00 0.00 72.50 69.15 3f84 s THR 266 CO 0.00 0.15 0.70 0.00 -0.69 0.00 0.00 174.62 174.77 3f84 s ALA 267 N -1.10 3.32 0.15 7.40 0.00 -1.26 -4.93 121.76 125.35 3f84 s ALA 267 Ca 0.50 -1.37 -0.31 0.00 0.00 0.00 0.00 51.96 50.77 3f84 s ALA 267 Cb -0.41 -3.40 -0.10 0.00 0.00 0.00 0.00 23.12 19.21 3f84 s ALA 267 CO 0.54 -1.97 1.62 -2.14 0.00 0.00 0.00 175.76 173.81 3f84 s PRO 268 N 2.99 4.19 0.05 0.00 0.02 -1.26 -4.89 135.00 136.09 3f84 s PRO 268 Ca 0.22 2.40 -0.30 0.00 0.02 0.00 0.00 61.00 63.34 3f84 s PRO 268 Cb -0.15 -3.24 -0.08 0.00 0.02 0.00 0.00 34.50 31.04 3f84 s PRO 268 CO 0.17 -0.66 1.68 0.99 -0.33 0.00 0.00 177.00 178.85 3f84 s THR 269 N 1.50 3.11 0.32 0.99 2.01 -1.26 -4.95 115.64 117.36 3f84 s THR 269 Ca 0.72 0.47 -0.29 0.00 0.31 0.00 0.00 61.69 62.91 3f84 s THR 269 Cb -0.44 -3.30 -0.13 0.00 0.01 0.00 0.00 72.50 68.64 3f84 s THR 269 CO 0.32 -0.01 1.28 0.00 -0.69 0.00 0.00 174.62 175.52 3f84 n ALA 270 N 6.01 1.10 0.00 7.40 0.00 -1.26 -4.76 120.51 129.00 3f84 n ALA 270 Ca 0.16 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.98 3f84 n ALA 270 Cb 0.41 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.63 3f84 n ALA 270 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3f84 n GLY 271 N 1.06 3.87 3.87 0.00 0.00 -1.05 -4.99 105.19 107.95 3f84 n GLY 271 Ca 0.06 -1.23 -0.35 0.00 0.00 0.00 0.00 46.02 44.51 3f84 n GLY 271 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 3f84 s ASN 272 N 0.00 6.62 0.08 1.61 -0.87 -1.26 -1.14 114.94 119.98 3f84 s ASN 272 Ca 0.00 0.76 0.05 0.00 -1.57 0.00 0.00 52.86 52.10 3f84 s ASN 272 Cb 0.00 -2.16 -0.03 0.00 -0.02 0.00 0.00 41.25 39.03 3f84 s ASN 272 CO 0.00 0.18 -0.14 -0.31 -2.57 0.00 0.00 177.10 174.26 3f84 s TYR 273 N -1.40 1.25 0.00 2.20 1.51 0.24 -2.11 117.35 119.05 3f84 s TYR 273 Ca 0.33 -0.49 -0.08 0.00 -1.01 0.00 0.00 57.07 55.81 3f84 s TYR 273 Cb -0.14 -0.69 0.00 0.00 -0.11 0.00 0.00 41.96 41.03 3f84 s TYR 273 CO 0.18 0.07 0.15 0.45 -1.11 0.00 0.00 175.55 175.29 3f84 s SER 274 N -1.94 0.02 0.08 2.29 0.15 -0.06 -2.29 113.70 111.95 3f84 s SER 274 Ca 0.01 -0.20 -0.27 0.00 0.70 0.00 0.00 55.95 56.19 3f84 s SER 274 Cb -0.08 0.21 0.09 0.00 -1.71 0.00 0.00 66.02 64.52 3f84 s SER 274 CO 0.02 -0.38 1.07 -0.83 1.20 0.00 0.00 173.24 174.33 3f84 s GLY 275 N -1.40 -0.30 -0.18 9.45 0.00 0.11 -0.24 107.32 114.76 3f84 s GLY 275 Ca -0.15 0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.96 3f84 s GLY 275 CO 0.02 0.07 -0.17 0.14 0.00 0.00 0.00 173.10 173.16 3f84 s VAL 276 N -2.97 2.33 -0.34 1.40 1.01 -1.26 0.18 120.40 120.75 3f84 s VAL 276 Ca 0.12 -0.85 -0.24 0.00 0.00 0.00 0.00 61.98 61.01 3f84 s VAL 276 Cb 0.01 -2.00 0.01 0.00 0.00 0.00 0.00 36.38 34.40 3f84 s VAL 276 CO -0.00 0.52 0.84 -0.69 0.00 0.00 0.00 175.10 175.77 3f84 s VAL 277 N 1.26 4.70 -0.50 2.92 1.01 0.51 -4.64 120.40 125.65 3f84 s VAL 277 Ca 0.04 1.14 -0.15 0.00 0.00 0.00 0.00 61.98 63.00 3f84 s VAL 277 Cb -0.14 -4.23 0.10 0.00 0.00 0.00 0.00 36.38 32.11 3f84 s VAL 277 CO -0.10 -0.40 0.44 -0.44 0.00 0.00 0.00 175.10 174.61 3f84 s SER 278 N 1.76 6.14 -0.25 3.32 0.01 -1.26 0.41 113.70 123.83 3f84 s SER 278 Ca 0.34 -1.59 -0.14 0.00 1.31 0.00 0.00 55.95 55.88 3f84 s SER 278 Cb -0.13 -2.18 -0.04 0.00 0.21 0.00 0.00 66.02 63.87 3f84 s SER 278 CO 0.16 -0.75 0.31 -0.22 0.41 0.00 0.00 173.24 173.14 3f84 s LEU 279 N 1.60 4.08 -0.20 2.44 2.96 0.99 -1.97 118.68 128.58 3f84 s LEU 279 Ca 0.04 0.26 -0.03 0.00 -0.22 0.00 0.00 54.13 54.18 3f84 s LEU 279 Cb -0.27 -2.34 -0.01 0.00 0.50 0.00 0.00 46.19 44.07 3f84 s LEU 279 CO 0.04 -0.09 -0.07 -0.69 -1.32 0.00 0.00 176.35 174.22 3f84 s VAL 280 N 1.64 3.23 -0.21 1.68 1.01 -0.76 -0.82 120.40 126.18 3f84 s VAL 280 Ca 0.13 -0.55 0.02 0.00 0.00 0.00 0.00 61.98 61.57 3f84 s VAL 280 Cb -0.15 -2.44 0.04 0.00 0.00 0.00 0.00 36.38 33.83 3f84 s VAL 280 CO 0.09 0.46 -0.12 -0.32 0.00 0.00 0.00 175.10 175.20 3f84 s MET 281 N 1.19 2.26 -0.10 2.72 1.75 0.33 -1.81 119.30 125.65 3f84 s MET 281 Ca 0.02 -0.99 0.01 0.00 -1.25 0.00 0.00 55.69 53.47 3f84 s MET 281 Cb -0.14 -2.59 -0.02 0.00 2.84 0.00 0.00 34.83 34.91 3f84 s MET 281 CO -0.02 -0.43 -0.11 0.99 -0.65 0.00 0.00 175.02 174.80 3f84 s THR 282 N 1.29 3.34 -0.60 10.11 2.01 0.73 -0.05 115.64 132.46 3f84 s THR 282 Ca -0.02 -0.59 -0.28 0.00 0.31 0.00 0.00 61.69 61.11 3f84 s THR 282 Cb -0.17 -2.37 0.02 0.00 0.01 0.00 0.00 72.50 69.98 3f84 s THR 282 CO -0.08 0.56 1.38 -0.76 -0.69 0.00 0.00 174.62 175.02 3f84 s LEU 283 N -0.24 3.35 0.00 4.42 1.43 0.13 -1.00 118.68 126.78 3f84 s LEU 283 Ca 0.02 0.11 0.00 0.00 -1.03 0.00 0.00 54.13 53.23 3f84 s LEU 283 Cb -0.13 -2.94 0.00 0.00 0.03 0.00 0.00 46.19 43.15 3f84 s LEU 283 CO 0.03 -1.74 0.00 0.61 0.23 0.00 0.00 176.35 175.48 3f84 n GLY 284 N 5.28 0.00 1.26 -3.19 0.00 -0.09 -1.90 105.19 106.55 3f84 n GLY 284 Ca 0.10 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.16 3f84 n GLY 284 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 3f84 n SER 285 N 0.00 1.46 -0.95 1.61 3.41 -1.26 -4.78 113.62 113.11 3f84 n SER 285 Ca 0.00 -2.79 0.12 0.00 -0.26 0.00 0.00 58.87 55.94 3f84 n SER 285 Cb 0.00 -0.40 0.10 0.00 -0.26 0.00 0.00 64.21 63.65 3f84 n SER 285 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3f84 n ASP 286 N -0.22 2.98 -3.74 4.04 10.43 -0.80 -4.98 116.55 124.27 3f84 n ASP 286 Ca 0.12 -1.99 -0.24 0.00 2.57 0.00 0.00 54.79 55.25 3f84 n ASP 286 Cb 0.95 -0.00 0.04 0.00 1.84 0.00 0.00 41.12 43.95 3f84 n ASP 286 CO 0.00 0.00 0.00 0.59 -1.07 0.00 0.00 177.20 176.72 3f84 n ASN 287 N 1.33 -3.29 -3.90 -2.24 4.13 -1.26 -4.89 115.26 105.15 3f84 n ASN 287 Ca 0.14 -0.75 -0.19 0.00 1.68 0.00 0.00 54.58 55.46 3f84 n ASN 287 Cb 0.59 -4.24 -0.16 0.00 -1.54 0.00 0.00 39.78 34.43 3f84 n ASN 287 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 3f84 s LYS 288 N -6.20 0.75 0.02 3.52 -0.14 -1.26 -5.06 119.74 111.37 3f84 s LYS 288 Ca 0.32 -0.12 -0.00 0.00 -1.36 0.00 0.00 55.97 54.81 3f84 s LYS 288 Cb -0.16 -0.76 -0.02 0.00 -1.68 0.00 0.00 37.83 35.22 3f84 s LYS 288 CO 0.80 -0.04 -0.02 1.14 -0.76 0.00 0.00 175.35 176.46 3f84 s GLN 289 N 0.73 0.36 -0.08 1.68 -2.07 -1.26 0.23 119.66 119.25 3f84 s GLN 289 Ca -0.10 -0.67 0.03 0.00 -1.82 0.00 0.00 55.36 52.80 3f84 s GLN 289 Cb -0.13 0.13 -0.02 0.00 -1.09 0.00 0.00 33.01 31.90 3f84 s GLN 289 CO 0.00 -0.06 -0.15 0.54 -1.32 0.00 0.00 175.29 174.30 3f84 s VAL 290 N -1.76 2.94 -0.18 3.63 0.11 0.93 -4.96 120.40 121.12 3f84 s VAL 290 Ca -0.13 -0.74 0.01 0.00 -2.93 0.00 0.00 61.98 58.19 3f84 s VAL 290 Cb -0.08 -2.17 0.03 0.00 -1.53 0.00 0.00 36.38 32.63 3f84 s VAL 290 CO -0.02 0.57 -0.16 -1.61 -3.33 0.00 0.00 175.10 170.55 3f84 s GLU 291 N -0.30 2.55 -0.27 1.54 0.41 -1.26 -0.51 118.70 120.85 3f84 s GLU 291 Ca 0.02 -0.80 -0.01 0.00 -0.41 0.00 0.00 54.97 53.77 3f84 s GLU 291 Cb -0.13 -2.43 0.04 0.00 -1.78 0.00 0.00 34.13 29.83 3f84 s GLU 291 CO 0.03 -0.29 -0.04 0.15 -0.49 0.00 0.00 175.26 174.61 3f84 s LYS 292 N 1.35 2.59 -0.25 1.61 -0.14 0.00 -4.96 119.74 119.95 3f84 s LYS 292 Ca 0.03 -1.14 -0.26 0.00 -1.36 0.00 0.00 55.97 53.24 3f84 s LYS 292 Cb -0.14 -3.06 0.00 0.00 -1.68 0.00 0.00 37.83 32.95 3f84 s LYS 292 CO -0.11 -0.51 0.89 -0.80 -0.76 0.00 0.00 175.35 174.06 3f84 s ASN 293 N 1.27 6.89 -0.28 2.83 0.01 -1.26 -0.01 114.94 124.40 3f84 s ASN 293 Ca -0.03 1.10 0.02 0.00 -0.71 0.00 0.00 52.86 53.23 3f84 s ASN 293 Cb -0.18 -2.47 0.06 0.00 0.41 0.00 0.00 41.25 39.07 3f84 s ASN 293 CO -0.03 -0.58 -0.07 -0.63 -1.51 0.00 0.00 177.10 174.28 3f84 s ILE 294 N 2.99 2.38 0.06 0.60 1.01 0.17 -4.64 121.20 123.76 3f84 s ILE 294 Ca 0.38 -1.63 -0.30 0.00 0.00 0.00 0.00 60.65 59.09 3f84 s ILE 294 Cb -0.15 -2.42 -0.09 0.00 0.01 0.00 0.00 42.46 39.81 3f84 s ILE 294 CO 0.08 -0.09 1.80 -0.89 0.00 0.00 0.00 174.94 175.84 3f84 s THR 295 N 1.12 2.95 -0.18 2.92 2.01 0.61 -0.37 115.64 124.71 3f84 s THR 295 Ca -0.07 0.24 -0.02 0.00 0.31 0.00 0.00 61.69 62.16 3f84 s THR 295 Cb -0.20 -3.15 -0.01 0.00 0.01 0.00 0.00 72.50 69.15 3f84 s THR 295 CO -0.04 -0.01 -0.10 -0.69 -0.69 0.00 0.00 174.62 173.09 3f84 s VAL 296 N 3.43 3.06 0.27 3.82 1.01 0.48 0.77 120.40 133.24 3f84 s VAL 296 Ca 0.80 -0.62 0.10 0.00 0.00 0.00 0.00 61.98 62.26 3f84 s VAL 296 Cb -0.42 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.58 3f84 s VAL 296 CO 0.36 0.48 -0.16 0.42 0.00 0.00 0.00 175.10 176.20 3f84 s THR 297 N 1.00 2.19 -0.10 3.92 -4.23 0.66 0.08 115.64 119.15 3f84 s THR 297 Ca -0.01 -2.31 -0.30 0.00 -1.18 0.00 0.00 61.69 57.89 3f84 s THR 297 Cb -0.15 -2.28 0.11 0.00 1.34 0.00 0.00 72.50 71.52 3f84 s THR 297 CO -0.01 -0.43 0.89 0.00 -0.54 0.00 0.00 174.62 174.53 3f84 s ALA 298 N -2.68 -1.87 -0.11 3.99 0.00 -0.97 -0.90 121.76 119.22 3f84 s ALA 298 Ca 0.28 1.42 0.02 0.00 0.00 0.00 0.00 51.96 53.68 3f84 s ALA 298 Cb -0.02 -0.35 0.01 0.00 0.00 0.00 0.00 23.12 22.76 3f84 s ALA 298 CO 0.13 -0.38 -0.18 -1.54 0.00 0.00 0.00 175.76 173.78 3f84 s SER 299 N -1.34 2.67 -0.50 0.00 1.04 -1.26 -0.59 113.70 113.72 3f84 s SER 299 Ca -0.03 -0.49 -0.22 0.00 0.48 0.00 0.00 55.95 55.68 3f84 s SER 299 Cb -0.00 -1.22 0.04 0.00 0.10 0.00 0.00 66.02 64.94 3f84 s SER 299 CO 0.02 0.05 0.80 -0.69 0.98 0.00 0.00 173.24 174.41 3f84 s VAL 300 N 0.83 4.60 -0.25 5.02 1.01 -0.29 -4.50 120.40 126.82 3f84 s VAL 300 Ca -0.09 0.14 -0.10 0.00 0.00 0.00 0.00 61.98 61.93 3f84 s VAL 300 Cb -0.16 -4.40 -0.04 0.00 0.00 0.00 0.00 36.38 31.78 3f84 s VAL 300 CO 0.00 -0.90 0.14 1.51 0.00 0.00 0.00 175.10 175.86 3f84 s ASP 301 N 2.55 5.80 0.00 3.32 -4.77 -1.26 -2.53 116.67 119.78 3f84 s ASP 301 Ca 0.26 -0.02 0.31 0.00 -3.30 0.00 0.00 52.55 49.80 3f84 s ASP 301 Cb -0.14 -2.06 1.69 0.00 -1.09 0.00 0.00 42.92 41.33 3f84 s ASP 301 CO 0.19 0.00 2.11 -2.65 0.70 0.00 0.00 175.17 175.52