#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y4j n SER 29 N 0.00 1.25 -4.23 1.09 3.41 -1.26 -5.00 113.62 108.88 1y4j n SER 29 Ca 0.00 -1.08 -0.13 0.00 -0.26 0.00 0.00 58.87 57.40 1y4j n SER 29 Cb 0.00 0.15 -0.10 0.00 -0.26 0.00 0.00 64.21 64.00 1y4j n SER 29 CO 0.00 0.00 0.00 -0.04 -0.16 0.00 0.00 175.04 174.84 1y4j s MET 30 N -2.41 1.07 -0.10 4.33 1.00 -1.26 -1.07 119.30 120.85 1y4j s MET 30 Ca 0.26 -1.51 0.03 0.00 0.00 0.00 0.00 55.69 54.47 1y4j s MET 30 Cb 0.19 -0.24 0.00 0.00 0.00 0.00 0.00 34.83 34.78 1y4j s MET 30 CO 0.49 -0.12 -0.21 0.08 0.00 0.00 0.00 175.02 175.26 1y4j s VAL 31 N -3.66 1.89 -0.05 -6.03 1.01 -0.19 -4.85 120.40 108.51 1y4j s VAL 31 Ca 0.22 -0.91 -0.27 0.00 0.00 0.00 0.00 61.98 61.02 1y4j s VAL 31 Cb 0.06 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 1y4j s VAL 31 CO 0.03 0.52 0.88 -1.10 0.00 0.00 0.00 175.10 175.43 1y4j s GLN 32 N 0.52 4.47 0.01 2.72 -1.52 -1.26 -1.47 119.66 123.13 1y4j s GLN 32 Ca -0.15 1.21 0.08 0.00 -1.95 0.00 0.00 55.36 54.55 1y4j s GLN 32 Cb -0.17 -3.48 -0.03 0.00 -0.22 0.00 0.00 33.01 29.11 1y4j s GLN 32 CO 0.06 -0.09 -0.25 -0.51 -0.25 0.00 0.00 175.29 174.25 1y4j s LEU 33 N 1.23 2.18 0.22 2.90 1.43 0.13 -4.98 118.68 121.78 1y4j s LEU 33 Ca 0.46 -0.51 0.10 0.00 -1.03 0.00 0.00 54.13 53.15 1y4j s LEU 33 Cb -0.19 -1.34 0.13 0.00 0.03 0.00 0.00 46.19 44.82 1y4j s LEU 33 CO 0.22 0.29 1.47 1.56 0.23 0.00 0.00 176.35 180.12 1y4j h GLN 34 N 5.08 0.00 0.00 1.70 1.08 -1.93 -1.36 115.11 119.68 1y4j h GLN 34 Ca -0.45 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.75 1y4j h GLN 34 Cb 1.13 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.56 1y4j h GLN 34 CO 0.46 0.75 0.00 0.41 -0.95 0.00 0.00 178.83 179.49 1y4j n GLY 35 N 0.77 0.33 0.00 3.46 0.00 -1.26 -3.09 105.19 105.41 1y4j n GLY 35 Ca -0.00 -0.94 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1y4j n GLY 35 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y4j n GLY 36 N 0.00 0.12 3.87 -0.02 0.00 0.10 -4.96 105.19 104.31 1y4j n GLY 36 Ca 0.00 -2.01 -0.35 0.00 0.00 0.00 0.00 46.02 43.65 1y4j n GLY 36 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1y4j s ARG 37 N 0.00 3.70 0.10 1.61 0.52 -1.26 -0.89 118.95 122.74 1y4j s ARG 37 Ca 0.00 0.11 -0.18 0.00 -0.52 0.00 0.00 55.73 55.14 1y4j s ARG 37 Cb 0.00 -3.08 0.04 0.00 0.52 0.00 0.00 34.95 32.43 1y4j s ARG 37 CO 0.00 0.63 0.44 -0.59 0.02 0.00 0.00 175.30 175.80 1y4j s PHE 38 N -1.28 -0.28 -0.45 -0.53 -0.12 -0.25 -4.98 117.98 110.09 1y4j s PHE 38 Ca 0.28 0.08 -0.25 0.00 -0.05 0.00 0.00 56.93 56.99 1y4j s PHE 38 Cb -0.14 0.29 0.02 0.00 -0.63 0.00 0.00 43.02 42.57 1y4j s PHE 38 CO 0.15 -0.68 0.90 -0.51 -0.05 0.00 0.00 175.22 175.03 1y4j s LEU 39 N -2.52 4.04 0.06 -1.99 1.43 -1.26 -0.82 118.68 117.62 1y4j s LEU 39 Ca -0.00 0.15 -0.06 0.00 -1.03 0.00 0.00 54.13 53.19 1y4j s LEU 39 Cb 0.01 -3.17 -0.05 0.00 0.03 0.00 0.00 46.19 43.01 1y4j s LEU 39 CO -0.09 -1.00 0.32 -0.32 0.23 0.00 0.00 176.35 175.49 1y4j s MET 40 N 3.65 3.61 0.72 1.70 1.75 0.12 -4.63 119.30 126.22 1y4j s MET 40 Ca 0.36 -0.06 0.00 0.00 -1.25 0.00 0.00 55.69 54.74 1y4j s MET 40 Cb -0.11 -3.00 0.00 0.00 2.84 0.00 0.00 34.83 34.56 1y4j s MET 40 CO 0.25 0.58 0.00 0.41 -0.65 0.00 0.00 175.02 175.61 1y4j n GLY 41 N 0.73 -2.04 3.21 2.11 0.00 -1.26 -1.22 105.19 106.72 1y4j n GLY 41 Ca -0.08 -1.59 -0.13 0.00 0.00 0.00 0.00 46.02 44.23 1y4j n GLY 41 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1y4j s THR 42 N -0.05 0.05 -2.12 2.61 -1.32 -0.35 -4.72 115.64 109.74 1y4j s THR 42 Ca 0.00 -0.42 0.21 0.00 -1.21 0.00 0.00 61.69 60.27 1y4j s THR 42 Cb 0.00 -0.55 0.55 0.00 -1.51 0.00 0.00 72.50 70.99 1y4j s THR 42 CO 0.00 -0.23 1.48 0.59 -2.21 0.00 0.00 174.62 174.24 1y4j n ASN 43 N 1.61 3.47 -4.63 8.08 3.02 -1.26 -3.70 115.26 121.84 1y4j n ASN 43 Ca -0.20 -1.99 -0.48 0.00 -0.03 0.00 0.00 54.58 51.88 1y4j n ASN 43 Cb 0.56 -0.39 -0.05 0.00 -0.61 0.00 0.00 39.78 39.30 1y4j n ASN 43 CO 0.00 0.00 0.00 -0.24 -2.62 0.00 0.00 177.26 174.40 1y4j n SER 44 N 1.42 2.40 0.22 6.41 2.88 -1.26 -4.84 113.62 120.85 1y4j n SER 44 Ca 0.21 1.10 0.15 0.00 -1.33 0.00 0.00 58.87 59.01 1y4j n SER 44 Cb 0.56 -1.32 0.72 0.00 -0.75 0.00 0.00 64.21 63.42 1y4j n SER 44 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 1y4j h PRO 45 N 5.13 0.00 -0.69 -1.46 0.13 -2.06 -0.97 132.00 132.08 1y4j h PRO 45 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1y4j h PRO 45 Cb 1.29 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.42 1y4j h PRO 45 CO 0.83 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 178.20 1y4j n ASP 46 N -2.65 3.20 -4.76 1.44 5.68 -1.26 -4.95 116.55 113.24 1y4j n ASP 46 Ca -0.00 -2.38 -0.40 0.00 -0.50 0.00 0.00 54.79 51.50 1y4j n ASP 46 Cb 0.17 -0.53 -0.03 0.00 -1.14 0.00 0.00 41.12 39.60 1y4j n ASP 46 CO 0.00 0.00 0.00 -0.94 -1.33 0.00 0.00 177.20 174.93 1y4j s SER 47 N -0.54 7.01 0.07 -1.12 1.04 -0.37 -5.03 113.70 114.77 1y4j s SER 47 Ca 0.28 2.48 0.02 0.00 0.48 0.00 0.00 55.95 59.21 1y4j s SER 47 Cb 0.20 -2.64 -0.03 0.00 0.10 0.00 0.00 66.02 63.65 1y4j s SER 47 CO 0.10 -0.35 -0.07 0.00 0.98 0.00 0.00 173.24 173.91 1y4j s ARG 48 N -1.60 0.70 -1.45 4.02 1.04 -1.26 -4.86 118.95 115.54 1y4j s ARG 48 Ca 0.47 -1.10 -0.08 0.00 -1.04 0.00 0.00 55.73 53.98 1y4j s ARG 48 Cb -0.36 -0.23 0.05 0.00 -2.04 0.00 0.00 34.95 32.37 1y4j s ARG 48 CO 0.47 0.01 0.83 -3.47 -0.04 0.00 0.00 175.30 173.10 1y4j n ASP 49 N 0.57 -3.09 0.00 -2.89 -0.08 -1.26 -2.25 116.55 107.55 1y4j n ASP 49 Ca -0.17 -0.82 0.00 0.00 -1.51 0.00 0.00 54.79 52.30 1y4j n ASP 49 Cb 0.58 -3.86 0.00 0.00 2.34 0.00 0.00 41.12 40.18 1y4j n ASP 49 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1y4j n GLY 50 N -1.66 0.73 0.35 0.27 0.00 -1.26 -4.77 105.19 98.85 1y4j n GLY 50 Ca -0.11 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.00 1y4j n GLY 50 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1y4j h GLU 51 N 2.66 0.60 -5.94 1.61 5.08 -1.74 -3.43 114.58 113.41 1y4j h GLU 51 Ca 0.00 -0.04 -0.57 0.00 -1.00 0.00 0.00 59.36 57.76 1y4j h GLU 51 Cb 0.00 -0.13 -0.09 0.00 0.50 0.00 0.00 28.75 29.03 1y4j h GLU 51 CO 0.00 0.39 -0.52 0.20 -1.00 0.00 0.00 179.01 178.08 1y4j s GLY 52 N -3.67 2.25 0.62 -3.84 0.00 -1.24 -1.21 107.32 100.23 1y4j s GLY 52 Ca -0.09 -2.05 -0.06 0.00 0.00 0.00 0.00 44.72 42.51 1y4j s GLY 52 CO 0.76 -1.89 0.85 -1.55 0.00 0.00 0.00 173.10 171.27 1y4j n PRO 53 N -1.18 -0.45 -2.19 2.90 -0.04 -1.26 -4.96 135.00 127.82 1y4j n PRO 53 Ca -0.02 -1.71 -0.42 0.00 -0.04 0.00 0.00 63.50 61.31 1y4j n PRO 53 Cb 0.64 -0.75 -0.03 0.00 -0.04 0.00 0.00 33.50 33.32 1y4j n PRO 53 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1y4j s VAL 54 N -2.65 3.47 -0.03 0.52 1.01 -1.26 -4.28 120.40 117.17 1y4j s VAL 54 Ca 0.51 0.99 -0.08 0.00 0.00 0.00 0.00 61.98 63.40 1y4j s VAL 54 Cb -0.02 -3.63 0.01 0.00 0.00 0.00 0.00 36.38 32.74 1y4j s VAL 54 CO 0.35 0.04 0.18 0.00 0.00 0.00 0.00 175.10 175.67 1y4j s ARG 55 N 1.65 0.38 -0.02 2.72 3.03 -0.35 -4.97 118.95 121.38 1y4j s ARG 55 Ca 0.65 -0.07 -0.30 0.00 2.03 0.00 0.00 55.73 58.04 1y4j s ARG 55 Cb -0.35 0.17 -0.03 0.00 -1.03 0.00 0.00 34.95 33.71 1y4j s ARG 55 CO 0.29 -0.08 1.10 -2.00 -1.13 0.00 0.00 175.30 173.49 1y4j s GLU 56 N -0.68 4.44 0.27 3.89 2.12 -1.26 -0.70 118.70 126.78 1y4j s GLU 56 Ca -0.08 1.57 0.12 0.00 0.36 0.00 0.00 54.97 56.94 1y4j s GLU 56 Cb -0.04 -3.48 -0.05 0.00 0.26 0.00 0.00 34.13 30.82 1y4j s GLU 56 CO 0.01 -0.27 -0.17 0.00 -0.54 0.00 0.00 175.26 174.28 1y4j s ALA 57 N 1.59 2.79 -0.08 6.30 0.00 0.00 -4.93 121.76 127.43 1y4j s ALA 57 Ca 0.54 -1.82 0.04 0.00 0.00 0.00 0.00 51.96 50.73 1y4j s ALA 57 Cb -0.24 -0.35 -0.01 0.00 0.00 0.00 0.00 23.12 22.53 1y4j s ALA 57 CO 0.24 0.30 -0.23 0.99 0.00 0.00 0.00 175.76 177.06 1y4j s THR 58 N -2.39 2.19 -0.02 0.00 2.01 -1.26 -1.09 115.64 115.07 1y4j s THR 58 Ca 0.29 -1.00 0.04 0.00 0.31 0.00 0.00 61.69 61.34 1y4j s THR 58 Cb -0.06 -1.82 -0.01 0.00 0.01 0.00 0.00 72.50 70.62 1y4j s THR 58 CO 0.15 0.56 -0.15 0.68 -0.69 0.00 0.00 174.62 175.17 1y4j s VAL 59 N 0.10 1.23 0.73 3.82 -7.23 -0.07 -4.97 120.40 114.00 1y4j s VAL 59 Ca -0.11 -0.63 -0.11 0.00 -1.81 0.00 0.00 61.98 59.32 1y4j s VAL 59 Cb -0.16 -1.04 0.03 0.00 0.56 0.00 0.00 36.38 35.77 1y4j s VAL 59 CO 0.06 0.35 1.07 -0.54 -0.31 0.00 0.00 175.10 175.74 1y4j s LYS 60 N -0.14 2.63 0.33 4.82 1.02 -1.26 0.02 119.74 127.15 1y4j s LYS 60 Ca 0.01 1.06 -0.27 0.00 0.02 0.00 0.00 55.97 56.79 1y4j s LYS 60 Cb -0.08 -1.95 -0.13 0.00 -0.52 0.00 0.00 37.83 35.15 1y4j s LYS 60 CO 0.00 -1.34 1.09 -2.30 -0.92 0.00 0.00 175.35 171.88 1y4j n PRO 61 N -3.28 1.59 -3.78 -1.68 -0.02 -1.18 -4.59 135.00 122.07 1y4j n PRO 61 Ca 0.08 0.56 -0.09 0.00 -2.02 0.00 0.00 63.50 62.04 1y4j n PRO 61 Cb 0.53 -2.02 -0.03 0.00 -0.02 0.00 0.00 33.50 31.96 1y4j n PRO 61 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 1y4j s PHE 62 N -1.11 -0.18 0.08 6.00 -0.12 -0.51 -3.33 117.98 118.81 1y4j s PHE 62 Ca 0.58 -0.20 0.06 0.00 -0.05 0.00 0.00 56.93 57.32 1y4j s PHE 62 Cb -0.64 0.58 -0.04 0.00 -0.63 0.00 0.00 43.02 42.29 1y4j s PHE 62 CO 0.60 -1.09 -0.09 0.00 -0.05 0.00 0.00 175.22 174.59 1y4j s ALA 63 N -3.89 2.98 0.01 1.99 0.00 0.11 0.19 121.76 123.15 1y4j s ALA 63 Ca 0.10 -1.19 0.00 0.00 0.00 0.00 0.00 51.96 50.87 1y4j s ALA 63 Cb -0.04 -0.96 -0.01 0.00 0.00 0.00 0.00 23.12 22.11 1y4j s ALA 63 CO 0.02 0.64 -0.03 -1.50 0.00 0.00 0.00 175.76 174.89 1y4j s ILE 64 N -1.18 0.16 0.32 0.00 2.07 -0.54 -1.05 121.20 120.97 1y4j s ILE 64 Ca 0.21 -0.57 -0.29 0.00 -1.41 0.00 0.00 60.65 58.59 1y4j s ILE 64 Cb -0.11 -0.23 -0.11 0.00 0.13 0.00 0.00 42.46 42.14 1y4j s ILE 64 CO 0.13 -0.26 1.51 -1.81 -1.91 0.00 0.00 174.94 172.59 1y4j s ASP 65 N -0.87 6.44 0.27 4.50 1.01 -0.48 -1.02 116.67 126.52 1y4j s ASP 65 Ca -0.08 2.92 -0.02 0.00 0.71 0.00 0.00 52.55 56.08 1y4j s ASP 65 Cb -0.06 -2.65 0.37 0.00 1.01 0.00 0.00 42.92 41.59 1y4j s ASP 65 CO -0.00 -0.83 1.80 0.40 0.21 0.00 0.00 175.17 176.75 1y4j h ILE 66 N 3.23 1.23 -3.24 0.77 2.04 -1.43 -3.45 117.51 116.65 1y4j h ILE 66 Ca -0.48 -0.87 -0.54 0.00 1.00 0.00 0.00 64.86 63.96 1y4j h ILE 66 Cb 1.23 0.71 -0.18 0.00 -0.74 0.00 0.00 36.82 37.84 1y4j h ILE 66 CO 0.72 0.32 -0.79 -0.36 0.00 0.00 0.00 178.15 178.05 1y4j s PHE 67 N -5.16 1.90 0.76 1.37 0.08 -1.26 -1.31 117.98 114.35 1y4j s PHE 67 Ca -0.10 -0.45 -0.15 0.00 0.12 0.00 0.00 56.93 56.35 1y4j s PHE 67 Cb 0.15 -0.94 0.02 0.00 -0.57 0.00 0.00 43.02 41.68 1y4j s PHE 67 CO 0.81 0.37 0.93 -2.30 -0.10 0.00 0.00 175.22 174.93 1y4j n PRO 68 N 0.25 0.36 -1.95 0.24 -0.02 -1.26 -4.76 135.00 127.87 1y4j n PRO 68 Ca -0.13 0.18 -0.42 0.00 -2.02 0.00 0.00 63.50 61.11 1y4j n PRO 68 Cb 0.57 -2.20 -0.03 0.00 -0.02 0.00 0.00 33.50 31.82 1y4j n PRO 68 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1y4j s VAL 69 N -1.93 2.92 0.56 -1.45 1.01 -0.03 -4.88 120.40 116.60 1y4j s VAL 69 Ca 0.71 0.51 0.02 0.00 0.00 0.00 0.00 61.98 63.22 1y4j s VAL 69 Cb -0.32 -3.33 0.05 0.00 0.00 0.00 0.00 36.38 32.77 1y4j s VAL 69 CO 0.52 0.01 0.79 0.42 0.00 0.00 0.00 175.10 176.84 1y4j s THR 70 N 2.05 2.60 0.17 3.92 -4.23 -1.26 -0.98 115.64 117.91 1y4j s THR 70 Ca 0.72 -0.70 -0.14 0.00 -1.18 0.00 0.00 61.69 60.38 1y4j s THR 70 Cb -0.41 -2.90 0.05 0.00 1.34 0.00 0.00 72.50 70.59 1y4j s THR 70 CO 0.32 0.00 1.82 0.78 -0.54 0.00 0.00 174.62 177.00 1y4j h ASN 71 N 0.05 0.53 -0.36 3.99 2.35 -1.25 -0.23 115.58 120.66 1y4j h ASN 71 Ca -0.40 -0.01 0.06 0.00 -0.55 0.00 0.00 56.30 55.40 1y4j h ASN 71 Cb 1.29 -0.12 -0.06 0.00 0.05 0.00 0.00 38.32 39.48 1y4j h ASN 71 CO 0.49 0.38 -0.00 0.50 -1.65 0.00 0.00 177.43 177.15 1y4j h LYS 72 N 0.63 0.09 -0.06 0.81 3.64 -1.64 0.23 116.57 120.27 1y4j h LYS 72 Ca 0.19 -0.01 0.03 0.00 -1.27 0.00 0.00 60.65 59.59 1y4j h LYS 72 Cb -0.04 -0.02 -0.03 0.00 -0.41 0.00 0.00 32.23 31.73 1y4j h LYS 72 CO -0.06 0.06 -0.10 -0.44 -2.27 0.00 0.00 179.45 176.64 1y4j h ASP 73 N 0.09 -0.31 -0.07 4.20 3.32 -1.75 -2.60 116.42 119.30 1y4j h ASP 73 Ca 0.18 0.06 -0.10 0.00 0.02 0.00 0.00 57.03 57.19 1y4j h ASP 73 Cb 0.24 0.15 -0.01 0.00 0.22 0.00 0.00 39.33 39.93 1y4j h ASP 73 CO -0.30 -0.14 -0.24 0.15 -1.72 0.00 0.00 179.24 176.99 1y4j h PHE 74 N -0.15 0.56 -0.17 4.55 3.57 -0.66 -2.58 116.94 122.06 1y4j h PHE 74 Ca 0.06 -0.12 0.03 0.00 3.53 0.00 0.00 57.97 61.47 1y4j h PHE 74 Cb 0.23 -0.14 -0.03 0.00 2.79 0.00 0.00 35.95 38.81 1y4j h PHE 74 CO -0.20 0.70 -0.01 -0.09 -2.23 0.00 0.00 178.31 176.48 1y4j h ARG 75 N 0.44 0.03 -0.84 1.11 2.43 -0.85 0.01 114.38 116.71 1y4j h ARG 75 Ca 0.07 -0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.32 1y4j h ARG 75 Cb 0.66 -0.01 -0.07 0.00 -0.42 0.00 0.00 29.97 30.13 1y4j h ARG 75 CO 0.05 0.02 0.49 -0.44 -1.51 0.00 0.00 179.97 178.58 1y4j h ASP 76 N 0.04 0.72 -0.40 -3.80 3.32 -1.19 0.63 116.42 115.73 1y4j h ASP 76 Ca 0.08 0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.15 1y4j h ASP 76 Cb 0.11 -0.10 -0.02 0.00 0.22 0.00 0.00 39.33 39.54 1y4j h ASP 76 CO -0.15 0.42 0.16 0.15 -1.72 0.00 0.00 179.24 178.10 1y4j h PHE 77 N 0.84 0.61 -0.50 4.55 3.57 -1.05 -1.95 116.94 123.01 1y4j h PHE 77 Ca 0.40 -0.05 -0.06 0.00 3.53 0.00 0.00 57.97 61.78 1y4j h PHE 77 Cb 0.32 -0.18 -0.02 0.00 2.79 0.00 0.00 35.95 38.86 1y4j h PHE 77 CO -0.05 0.54 0.06 0.28 -2.23 0.00 0.00 178.31 176.91 1y4j h VAL 78 N 0.50 1.25 0.27 1.41 2.07 -0.33 0.14 116.25 121.57 1y4j h VAL 78 Ca 0.13 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.69 1y4j h VAL 78 Cb 0.19 0.90 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1y4j h VAL 78 CO -0.01 0.34 -0.33 0.03 0.02 0.00 0.00 177.57 177.62 1y4j h ARG 79 N 0.72 -0.63 -0.27 1.57 3.08 -0.81 0.26 114.38 118.29 1y4j h ARG 79 Ca 0.15 0.04 -0.07 0.00 0.07 0.00 0.00 59.98 60.17 1y4j h ARG 79 Cb 0.42 0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.61 1y4j h ARG 79 CO 0.01 -0.42 -0.10 1.49 -1.07 0.00 0.00 179.97 179.88 1y4j h GLU 80 N -0.65 0.56 -0.10 0.04 4.81 -1.24 -3.29 114.58 114.71 1y4j h GLU 80 Ca -0.01 -0.23 0.00 0.00 -0.13 0.00 0.00 59.36 58.99 1y4j h GLU 80 Cb 0.62 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 29.97 1y4j h GLU 80 CO -0.10 0.79 0.00 1.63 -0.73 0.00 0.00 179.01 180.60 1y4j n LYS 81 N -4.47 2.20 -3.93 1.92 4.76 0.49 -4.96 118.16 114.16 1y4j n LYS 81 Ca -0.03 -1.76 -0.25 0.00 -2.87 0.00 0.00 58.31 53.40 1y4j n LYS 81 Cb 0.34 -1.47 -0.02 0.00 -1.84 0.00 0.00 35.03 32.04 1y4j n LYS 81 CO 0.00 0.00 0.00 1.63 -1.37 0.00 0.00 177.40 177.66 1y4j n LYS 82 N 1.09 -3.40 -3.22 1.97 5.02 0.90 -4.89 118.16 115.63 1y4j n LYS 82 Ca 0.16 0.42 -0.39 0.00 -2.02 0.00 0.00 58.31 56.49 1y4j n LYS 82 Cb 0.54 -4.57 -0.06 0.00 -0.02 0.00 0.00 35.03 30.92 1y4j n LYS 82 CO 0.00 0.00 0.00 -0.47 -0.52 0.00 0.00 177.40 176.41 1y4j s TYR 83 N -3.94 3.53 -0.25 2.13 5.04 -1.18 -5.04 117.35 117.64 1y4j s TYR 83 Ca 0.00 1.01 -0.07 0.00 -2.44 0.00 0.00 57.07 55.57 1y4j s TYR 83 Cb -0.00 -2.64 -0.03 0.00 0.35 0.00 0.00 41.96 39.64 1y4j s TYR 83 CO 0.88 0.13 0.08 0.50 -1.34 0.00 0.00 175.55 175.80 1y4j s ARG 84 N 0.71 3.67 0.82 4.97 3.52 -1.26 -4.85 118.95 126.52 1y4j s ARG 84 Ca 0.30 -0.47 -0.11 0.00 -0.13 0.00 0.00 55.73 55.32 1y4j s ARG 84 Cb -0.16 -3.34 0.08 0.00 -1.56 0.00 0.00 34.95 29.97 1y4j s ARG 84 CO 0.13 -0.18 1.09 0.95 -0.81 0.00 0.00 175.30 176.48 1y4j s THR 85 N 1.61 3.07 0.32 4.11 -4.23 -1.26 -4.91 115.64 114.35 1y4j s THR 85 Ca 0.06 0.35 0.01 0.00 -1.18 0.00 0.00 61.69 60.93 1y4j s THR 85 Cb -0.15 -2.97 0.20 0.00 1.34 0.00 0.00 72.50 70.92 1y4j s THR 85 CO 0.04 -0.45 1.91 -0.33 -0.54 0.00 0.00 174.62 175.24 1y4j h GLU 86 N -1.21 0.78 -0.68 3.99 5.08 -1.95 -1.79 114.58 118.79 1y4j h GLU 86 Ca -0.47 -0.11 0.03 0.00 -1.00 0.00 0.00 59.36 57.81 1y4j h GLU 86 Cb 1.26 -0.14 -0.04 0.00 0.50 0.00 0.00 28.75 30.33 1y4j h GLU 86 CO 0.56 0.64 0.45 0.00 -1.00 0.00 0.00 179.01 179.66 1y4j h ALA 87 N 1.47 1.62 -0.12 3.43 0.00 -1.83 0.32 119.26 124.14 1y4j h ALA 87 Ca 0.19 -0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.92 1y4j h ALA 87 Cb 0.14 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 1y4j h ALA 87 CO -0.02 0.31 -0.53 0.93 0.00 0.00 0.00 179.25 179.94 1y4j h GLU 88 N 0.82 0.35 0.02 0.00 5.08 -1.65 0.25 114.58 119.45 1y4j h GLU 88 Ca 0.27 -0.21 -0.17 0.00 -1.00 0.00 0.00 59.36 58.25 1y4j h GLU 88 Cb 0.07 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.36 1y4j h GLU 88 CO -0.08 0.80 -0.66 0.52 -1.00 0.00 0.00 179.01 178.59 1y4j h MET 89 N 0.27 0.41 0.00 2.33 2.86 -0.93 -3.01 114.93 116.86 1y4j h MET 89 Ca 0.01 -0.47 -0.05 0.00 -2.06 0.00 0.00 59.70 57.13 1y4j h MET 89 Cb 1.03 0.14 -0.01 0.00 0.06 0.00 0.00 31.60 32.82 1y4j h MET 89 CO 0.09 1.13 -0.23 0.74 1.06 0.00 0.00 176.91 179.71 1y4j h PHE 90 N -0.11 0.00 0.00 -0.22 0.04 -0.42 -3.47 116.94 112.77 1y4j h PHE 90 Ca -0.09 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.68 1y4j h PHE 90 Cb 1.38 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.53 1y4j h PHE 90 CO 0.15 0.23 0.00 0.41 -0.60 0.00 0.00 178.31 178.50 1y4j n GLY 91 N -0.86 0.54 3.49 -1.45 0.00 0.83 -5.03 105.19 102.72 1y4j n GLY 91 Ca -0.02 -0.04 -0.10 0.00 0.00 0.00 0.00 46.02 45.86 1y4j n GLY 91 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1y4j s TRP 92 N -2.00 -0.23 0.25 1.61 1.48 -1.00 -1.52 118.94 117.53 1y4j s TRP 92 Ca 0.00 -0.09 -0.18 0.00 -1.06 0.00 0.00 56.10 54.77 1y4j s TRP 92 Cb 0.00 0.43 0.02 0.00 -1.16 0.00 0.00 33.47 32.76 1y4j s TRP 92 CO 0.00 -0.89 0.60 0.45 -4.06 0.00 0.00 176.95 173.04 1y4j s SER 93 N -2.84 -0.22 -0.16 -2.66 0.15 -0.86 -4.69 113.70 102.43 1y4j s SER 93 Ca 0.07 -0.66 -0.25 0.00 0.70 0.00 0.00 55.95 55.80 1y4j s SER 93 Cb -0.01 0.65 -0.02 0.00 -1.71 0.00 0.00 66.02 64.93 1y4j s SER 93 CO -0.06 -1.21 0.81 -0.36 1.20 0.00 0.00 173.24 173.62 1y4j s PHE 94 N -3.94 3.44 -0.05 3.44 0.08 -1.23 -0.44 117.98 119.28 1y4j s PHE 94 Ca 0.14 1.24 0.05 0.00 0.12 0.00 0.00 56.93 58.48 1y4j s PHE 94 Cb -0.03 -2.98 -0.01 0.00 -0.57 0.00 0.00 43.02 39.44 1y4j s PHE 94 CO 0.05 -0.20 -0.21 0.08 -0.10 0.00 0.00 175.22 174.84 1y4j s VAL 95 N 1.97 1.76 0.14 -0.44 1.01 -0.66 -2.29 120.40 121.88 1y4j s VAL 95 Ca 0.38 -0.90 -0.35 0.00 0.00 0.00 0.00 61.98 61.11 1y4j s VAL 95 Cb -0.17 -1.50 -0.15 0.00 0.00 0.00 0.00 36.38 34.57 1y4j s VAL 95 CO 0.13 0.49 1.51 0.33 0.00 0.00 0.00 175.10 177.57 1y4j n PHE 96 N 3.08 2.06 -0.18 5.22 7.35 -1.26 -0.99 117.46 132.75 1y4j n PHE 96 Ca -0.18 0.37 -0.01 0.00 -0.76 0.00 0.00 57.45 56.87 1y4j n PHE 96 Cb 0.52 -2.48 0.08 0.00 0.35 0.00 0.00 39.48 37.96 1y4j n PHE 96 CO 0.00 0.00 0.00 1.49 -0.76 0.00 0.00 176.76 177.49 1y4j h GLU 97 N 5.52 0.28 0.00 -4.13 4.81 -1.37 0.64 114.58 120.33 1y4j h GLU 97 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1y4j h GLU 97 Cb 1.28 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.59 1y4j h GLU 97 CO 0.86 0.19 0.00 -0.44 -0.73 0.00 0.00 179.01 178.88 1y4j h ASP 98 N 0.29 0.00 0.25 1.04 5.19 -1.88 -2.31 116.42 119.00 1y4j h ASP 98 Ca 0.28 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.69 1y4j h ASP 98 Cb 0.37 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.88 1y4j h ASP 98 CO -0.33 0.00 -0.29 0.49 -3.12 0.00 0.00 179.24 175.99 1y4j n PHE 99 N -2.85 0.00 -2.70 4.55 3.72 0.21 -4.81 117.46 115.59 1y4j n PHE 99 Ca -0.02 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.96 1y4j n PHE 99 Cb 0.10 -0.13 -0.02 0.00 -0.94 0.00 0.00 39.48 38.49 1y4j n PHE 99 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1y4j s VAL 100 N -2.55 4.74 0.77 -4.37 1.01 -0.87 -4.90 120.40 114.23 1y4j s VAL 100 Ca 0.23 1.98 -0.11 0.00 0.00 0.00 0.00 61.98 64.08 1y4j s VAL 100 Cb 0.19 -4.29 0.05 0.00 0.00 0.00 0.00 36.38 32.34 1y4j s VAL 100 CO 0.54 -0.09 1.09 -0.94 0.00 0.00 0.00 175.10 175.69 1y4j s SER 101 N 1.17 4.60 0.10 3.32 1.04 -1.26 -4.87 113.70 117.79 1y4j s SER 101 Ca 0.45 1.75 -0.19 0.00 0.48 0.00 0.00 55.95 58.43 1y4j s SER 101 Cb -0.16 -2.48 -0.07 0.00 0.10 0.00 0.00 66.02 63.41 1y4j s SER 101 CO 0.11 -1.96 1.65 0.44 0.98 0.00 0.00 173.24 174.46 1y4j h ASP 102 N -1.08 0.31 -1.00 7.02 3.32 -1.96 -1.90 116.42 121.13 1y4j h ASP 102 Ca -0.44 -0.15 0.12 0.00 0.02 0.00 0.00 57.03 56.58 1y4j h ASP 102 Cb 1.23 -0.08 -0.08 0.00 0.22 0.00 0.00 39.33 40.62 1y4j h ASP 102 CO 0.53 0.38 0.63 -0.08 -1.72 0.00 0.00 179.24 178.97 1y4j h GLU 103 N 0.23 0.95 -0.18 3.56 4.81 -1.97 0.90 114.58 122.87 1y4j h GLU 103 Ca 0.08 -0.06 -0.04 0.00 -0.13 0.00 0.00 59.36 59.21 1y4j h GLU 103 Cb 0.16 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.32 1y4j h GLU 103 CO -0.01 0.63 -0.03 1.25 -0.73 0.00 0.00 179.01 180.12 1y4j h LEU 104 N 0.98 0.34 -0.85 1.64 5.85 -1.84 -2.07 115.31 119.36 1y4j h LEU 104 Ca 0.49 -0.35 0.00 0.00 0.84 0.00 0.00 57.88 58.87 1y4j h LEU 104 Cb 0.50 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.44 1y4j h LEU 104 CO -0.26 0.61 0.00 0.03 -0.34 0.00 0.00 178.44 178.48 1y4j h ARG 105 N 0.06 0.00 0.00 1.25 3.08 -0.75 -2.84 114.38 115.19 1y4j h ARG 105 Ca 0.05 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.10 1y4j h ARG 105 Cb 0.45 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.50 1y4j h ARG 105 CO 0.01 0.00 0.00 -0.91 -1.07 0.00 0.00 179.97 178.00 1y4j h ASN 106 N 0.00 0.00 -2.39 7.04 4.21 0.15 -3.27 115.58 121.32 1y4j h ASN 106 Ca 0.00 0.00 -0.61 0.00 1.21 0.00 0.00 56.30 56.90 1y4j h ASN 106 Cb 0.49 0.00 -0.42 0.00 -1.12 0.00 0.00 38.32 37.27 1y4j h ASN 106 CO 0.00 0.00 -0.56 2.29 -1.29 0.00 0.00 177.43 177.87 1y4j n LYS 107 N -3.08 2.43 -3.47 0.81 2.85 -1.03 -5.06 118.16 111.61 1y4j n LYS 107 Ca 0.01 -4.64 -0.14 0.00 -1.05 0.00 0.00 58.31 52.49 1y4j n LYS 107 Cb 0.32 -2.27 -0.04 0.00 -0.65 0.00 0.00 35.03 32.39 1y4j n LYS 107 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 1y4j s ALA 108 N -2.29 -1.70 0.00 0.58 0.00 -1.24 -4.96 121.76 112.15 1y4j s ALA 108 Ca 0.37 0.92 0.00 0.00 0.00 0.00 0.00 51.96 53.24 1y4j s ALA 108 Cb 0.11 0.42 0.00 0.00 0.00 0.00 0.00 23.12 23.65 1y4j s ALA 108 CO -0.04 -0.58 0.00 1.04 0.00 0.00 0.00 175.76 176.18 1y4j n GLN 110 N 0.21 0.00 -1.30 0.00 6.02 -1.26 -5.04 117.38 116.01 1y4j n GLN 110 Ca -0.17 0.00 -0.35 0.00 -0.01 0.00 0.00 57.00 56.47 1y4j n GLN 110 Cb 0.61 0.00 0.11 0.00 1.02 0.00 0.00 30.24 31.98 1y4j n GLN 110 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1y4j n PRO 111 N 0.00 0.48 -4.26 -1.09 -0.04 -1.26 -5.01 135.00 123.81 1y4j n PRO 111 Ca 0.00 0.23 -0.35 0.00 -0.04 0.00 0.00 63.50 63.35 1y4j n PRO 111 Cb 0.00 -2.46 -0.10 0.00 -0.04 0.00 0.00 33.50 30.90 1y4j n PRO 111 CO 0.00 0.00 0.00 -1.64 -0.04 0.00 0.00 175.50 173.82 1y4j s MET 112 N -3.86 3.46 -0.25 0.54 -1.94 -1.26 -5.08 119.30 110.92 1y4j s MET 112 Ca 0.76 -0.41 -0.11 0.00 -1.71 0.00 0.00 55.69 54.22 1y4j s MET 112 Cb -0.32 -2.96 -0.05 0.00 2.01 0.00 0.00 34.83 33.51 1y4j s MET 112 CO 0.48 0.47 0.20 0.21 -0.01 0.00 0.00 175.02 176.36 1y4j s LYS 113 N -0.22 4.04 0.50 2.03 2.20 -1.26 -5.07 119.74 121.96 1y4j s LYS 113 Ca 0.06 -0.24 -0.19 0.00 -0.36 0.00 0.00 55.97 55.24 1y4j s LYS 113 Cb -0.12 -3.58 -0.08 0.00 -1.51 0.00 0.00 37.83 32.54 1y4j s LYS 113 CO 0.02 -0.03 1.02 -1.54 -0.36 0.00 0.00 175.35 174.45 1y4j s SER 114 N 1.29 6.41 -0.35 1.43 1.04 -1.26 -4.40 113.70 117.86 1y4j s SER 114 Ca 0.09 1.81 -0.03 0.00 0.48 0.00 0.00 55.95 58.30 1y4j s SER 114 Cb -0.14 -2.54 0.07 0.00 0.10 0.00 0.00 66.02 63.50 1y4j s SER 114 CO 0.07 -0.73 0.10 -0.69 0.98 0.00 0.00 173.24 172.97 1y4j s VAL 115 N -2.18 3.26 0.00 5.02 1.01 0.11 -4.98 120.40 122.63 1y4j s VAL 115 Ca 0.64 -1.61 0.00 0.00 0.00 0.00 0.00 61.98 61.02 1y4j s VAL 115 Cb -0.14 -3.02 0.00 0.00 0.00 0.00 0.00 36.38 33.23 1y4j s VAL 115 CO 0.23 -0.36 0.00 0.18 0.00 0.00 0.00 175.10 175.15 1y4j n LEU 116 N 4.65 0.00 -0.38 3.92 4.77 -1.26 -1.56 117.00 127.14 1y4j n LEU 116 Ca -0.09 0.00 0.14 0.00 -0.03 0.00 0.00 56.01 56.03 1y4j n LEU 116 Cb 0.43 0.00 0.55 0.00 -2.33 0.00 0.00 43.42 42.07 1y4j n LEU 116 CO 0.30 0.00 0.86 0.79 -1.33 0.00 0.00 177.39 178.01 1y4j n TRP 117 N 11.55 0.00 -4.32 -1.77 7.02 -1.26 -4.89 117.44 123.78 1y4j n TRP 117 Ca 0.00 0.00 -0.28 0.00 -1.02 0.00 0.00 57.50 56.20 1y4j n TRP 117 Cb 0.00 -0.03 -0.11 0.00 -2.42 0.00 0.00 31.31 28.75 1y4j n TRP 117 CO 0.00 0.00 0.00 -1.58 -2.02 0.00 0.00 177.69 174.09 1y4j s TRP 118 N -2.10 2.52 -0.11 -5.99 0.51 -0.60 -0.96 118.94 112.21 1y4j s TRP 118 Ca 0.36 -0.27 -0.06 0.00 -2.12 0.00 0.00 56.10 54.02 1y4j s TRP 118 Cb 0.21 -1.30 -0.04 0.00 -0.81 0.00 0.00 33.47 31.53 1y4j s TRP 118 CO 0.37 0.43 0.10 -0.51 -0.51 0.00 0.00 176.95 176.84 1y4j s LEU 119 N -2.37 4.18 -0.42 2.99 1.43 -0.16 0.04 118.68 124.35 1y4j s LEU 119 Ca 0.20 0.38 -0.29 0.00 -1.03 0.00 0.00 54.13 53.39 1y4j s LEU 119 Cb -0.10 -2.02 0.02 0.00 0.03 0.00 0.00 46.19 44.12 1y4j s LEU 119 CO 0.11 0.40 1.26 -2.16 0.23 0.00 0.00 176.35 176.19 1y4j s PRO 120 N -1.02 3.71 -0.20 1.29 0.04 -1.26 -1.66 135.00 135.90 1y4j s PRO 120 Ca 0.15 0.83 -0.04 0.00 0.04 0.00 0.00 61.00 61.98 1y4j s PRO 120 Cb -0.12 -3.94 -0.02 0.00 0.04 0.00 0.00 34.50 30.47 1y4j s PRO 120 CO 0.04 -1.39 -0.03 0.08 0.04 0.00 0.00 177.00 175.74 1y4j s VAL 121 N 4.78 3.65 0.22 -0.36 1.01 0.42 -4.90 120.40 125.21 1y4j s VAL 121 Ca 0.54 -0.41 -0.31 0.00 0.00 0.00 0.00 61.98 61.80 1y4j s VAL 121 Cb -0.11 -2.65 -0.11 0.00 0.00 0.00 0.00 36.38 33.51 1y4j s VAL 121 CO 0.30 0.43 1.59 -1.61 0.00 0.00 0.00 175.10 175.81 1y4j s GLU 122 N 1.17 4.18 -1.46 2.72 2.02 -1.26 -2.03 118.70 124.04 1y4j s GLU 122 Ca 0.02 2.47 0.00 0.00 0.02 0.00 0.00 54.97 57.48 1y4j s GLU 122 Cb -0.14 -3.09 0.00 0.00 0.10 0.00 0.00 34.13 30.99 1y4j s GLU 122 CO 0.00 -0.62 0.00 1.63 0.02 0.00 0.00 175.26 176.29 1y4j n LYS 123 N 3.25 -1.15 -2.95 1.61 5.02 -0.57 -4.51 118.16 118.85 1y4j n LYS 123 Ca 0.12 0.88 -0.41 0.00 -2.02 0.00 0.00 58.31 56.88 1y4j n LYS 123 Cb 0.38 -5.14 -0.04 0.00 -0.02 0.00 0.00 35.03 30.20 1y4j n LYS 123 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y4j s ALA 124 N -2.68 3.51 0.18 7.82 0.00 -1.08 -3.93 121.76 125.58 1y4j s ALA 124 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 51.96 51.89 1y4j s ALA 124 Cb 0.00 -3.16 0.02 0.00 0.00 0.00 0.00 23.12 19.98 1y4j s ALA 124 CO 0.00 -0.60 0.31 1.97 0.00 0.00 0.00 175.76 177.45 1y4j n PHE 125 N 5.11 -1.35 -0.35 0.00 -1.74 -1.05 -3.61 117.46 114.48 1y4j n PHE 125 Ca 0.03 -0.98 0.05 0.00 -0.56 0.00 0.00 57.45 55.99 1y4j n PHE 125 Cb 0.49 0.36 0.22 0.00 1.52 0.00 0.00 39.48 42.07 1y4j n PHE 125 CO 0.00 0.00 0.00 0.11 -0.56 0.00 0.00 176.76 176.31 1y4j h TRP 126 N 1.47 1.14 0.00 2.97 5.08 -1.80 -0.06 115.95 124.76 1y4j h TRP 126 Ca -0.15 0.03 -0.03 0.00 1.08 0.00 0.00 58.89 59.82 1y4j h TRP 126 Cb 0.57 -0.37 -0.00 0.00 -3.00 0.00 0.00 29.16 26.36 1y4j h TRP 126 CO 0.00 0.55 -0.16 -0.09 -1.28 0.00 0.00 178.44 177.45 1y4j h ARG 127 N 1.08 0.00 -2.16 0.12 2.43 -1.96 -3.33 114.38 110.55 1y4j h ARG 127 Ca 0.44 0.00 -0.58 0.00 -0.81 0.00 0.00 59.98 59.03 1y4j h ARG 127 Cb 0.29 0.00 -0.41 0.00 -0.42 0.00 0.00 29.97 29.43 1y4j h ARG 127 CO -0.19 0.16 -0.81 1.04 -1.51 0.00 0.00 179.97 178.66 1y4j n GLN 128 N -3.17 1.69 0.01 0.20 6.02 -0.08 -3.62 117.38 118.43 1y4j n GLN 128 Ca 0.02 -4.03 0.07 0.00 -0.01 0.00 0.00 57.00 53.06 1y4j n GLN 128 Cb 0.54 -1.82 0.32 0.00 1.02 0.00 0.00 30.24 30.30 1y4j n GLN 128 CO 0.00 0.00 0.00 -0.35 -1.01 0.00 0.00 177.06 175.70 1y4j n PRO 129 N 1.20 0.02 -0.26 -1.09 -0.04 -0.95 -0.93 135.00 132.95 1y4j n PRO 129 Ca 0.26 0.28 0.09 0.00 -0.04 0.00 0.00 63.50 64.08 1y4j n PRO 129 Cb 0.46 -1.54 0.19 0.00 -0.04 0.00 0.00 33.50 32.56 1y4j n PRO 129 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1y4j n ALA 130 N -1.53 2.68 0.00 0.55 0.00 -1.26 -4.82 120.51 116.13 1y4j n ALA 130 Ca 0.03 -2.59 0.00 0.00 0.00 0.00 0.00 53.44 50.88 1y4j n ALA 130 Cb 0.17 -0.50 0.00 0.00 0.00 0.00 0.00 19.45 19.12 1y4j n ALA 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1y4j n GLY 131 N -1.11 -3.07 3.56 0.00 0.00 -0.10 -4.65 105.19 99.82 1y4j n GLY 131 Ca 0.19 -1.86 -0.49 0.00 0.00 0.00 0.00 46.02 43.86 1y4j n GLY 131 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1y4j n PRO 132 N -0.30 1.01 -0.21 1.61 -0.02 -1.25 -1.49 135.00 134.35 1y4j n PRO 132 Ca 0.00 0.36 0.00 0.00 -2.02 0.00 0.00 63.50 61.84 1y4j n PRO 132 Cb 0.00 -1.79 0.00 0.00 -0.02 0.00 0.00 33.50 31.69 1y4j n PRO 132 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y4j n GLY 133 N 1.87 0.84 3.71 -1.23 0.00 -1.26 -4.84 105.19 104.28 1y4j n GLY 133 Ca 0.15 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.94 1y4j n GLY 133 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1y4j s SER 134 N -2.88 4.87 0.29 1.61 1.04 -0.56 -5.09 113.70 112.98 1y4j s SER 134 Ca 0.00 -0.53 -0.09 0.00 0.48 0.00 0.00 55.95 55.82 1y4j s SER 134 Cb 0.00 -1.02 0.04 0.00 0.10 0.00 0.00 66.02 65.14 1y4j s SER 134 CO 0.00 -0.03 0.54 0.61 0.98 0.00 0.00 173.24 175.35 1y4j n GLY 135 N -1.00 1.49 0.07 7.32 0.00 -1.26 -4.38 105.19 107.43 1y4j n GLY 135 Ca -0.07 -1.28 0.03 0.00 0.00 0.00 0.00 46.02 44.70 1y4j n GLY 135 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 1y4j n ILE 136 N -0.41 0.00 -0.10 -0.61 -5.35 -1.24 -4.70 119.36 106.95 1y4j n ILE 136 Ca -0.05 -0.41 0.15 0.00 -0.27 0.00 0.00 62.75 62.17 1y4j n ILE 136 Cb 0.45 1.04 0.54 0.00 -1.74 0.00 0.00 39.64 39.92 1y4j n ILE 136 CO 0.00 0.00 0.00 0.03 -1.76 0.00 0.00 176.55 174.82 1y4j h ARG 137 N 0.35 0.33 -0.19 6.28 3.08 -1.98 1.06 114.38 123.30 1y4j h ARG 137 Ca 0.00 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.03 1y4j h ARG 137 Cb 0.17 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.14 1y4j h ARG 137 CO 0.00 0.22 0.00 -0.85 -1.07 0.00 0.00 179.97 178.27 1y4j n GLU 138 N -4.46 1.74 -1.30 0.04 0.00 -1.26 -4.32 120.64 111.08 1y4j n GLU 138 Ca 0.12 -1.12 0.04 0.00 0.00 0.00 0.00 57.16 56.20 1y4j n GLU 138 Cb 0.48 -1.38 0.06 0.00 0.00 0.00 0.00 31.44 30.60 1y4j n GLU 138 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1y4j n ARG 139 N 0.35 0.39 0.26 3.44 1.74 0.36 -4.89 116.66 118.32 1y4j n ARG 139 Ca 0.16 -2.32 0.12 0.00 -0.77 0.00 0.00 57.85 55.03 1y4j n ARG 139 Cb 0.32 -0.39 0.72 0.00 -1.02 0.00 0.00 32.46 32.10 1y4j n ARG 139 CO 0.00 0.00 0.00 -0.07 -1.52 0.00 0.00 177.63 176.04 1y4j h LEU 140 N 1.01 0.00 -0.56 0.55 3.38 -1.65 -1.06 115.31 116.98 1y4j h LEU 140 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 1y4j h LEU 140 Cb 1.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.44 1y4j h LEU 140 CO 0.08 0.10 -0.32 -0.62 0.09 0.00 0.00 178.44 177.77 1y4j n GLU 141 N -3.86 0.86 -2.18 1.13 1.02 -1.26 -1.77 120.64 114.57 1y4j n GLU 141 Ca -0.02 -0.56 -0.35 0.00 -0.02 0.00 0.00 57.16 56.20 1y4j n GLU 141 Cb 0.20 -1.49 0.01 0.00 -0.02 0.00 0.00 31.44 30.14 1y4j n GLU 141 CO 0.00 0.00 0.00 -1.01 1.18 0.00 0.00 177.13 177.30 1y4j s HIS 142 N -2.52 2.58 0.57 -0.32 3.76 -0.40 -1.00 115.29 117.96 1y4j s HIS 142 Ca 0.23 1.53 -0.21 0.00 -0.15 0.00 0.00 55.06 56.46 1y4j s HIS 142 Cb 0.19 -3.35 -0.04 0.00 1.11 0.00 0.00 32.58 30.49 1y4j s HIS 142 CO 0.54 -1.77 1.32 -0.35 -0.85 0.00 0.00 174.74 173.63 1y4j n PRO 143 N -1.39 1.51 -2.18 8.40 -0.04 -1.26 -1.62 135.00 138.42 1y4j n PRO 143 Ca 0.12 0.56 -0.41 0.00 -0.04 0.00 0.00 63.50 63.74 1y4j n PRO 143 Cb 0.51 -2.54 -0.03 0.00 -0.04 0.00 0.00 33.50 31.40 1y4j n PRO 143 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1y4j s VAL 144 N -1.32 2.94 0.41 0.52 0.11 -0.15 -4.55 120.40 118.36 1y4j s VAL 144 Ca 0.74 0.88 0.07 0.00 -2.93 0.00 0.00 61.98 60.75 1y4j s VAL 144 Cb -0.41 -3.56 -0.06 0.00 -1.53 0.00 0.00 36.38 30.81 1y4j s VAL 144 CO 0.47 0.18 0.11 -0.76 -3.33 0.00 0.00 175.10 171.77 1y4j s LEU 145 N -1.20 3.01 -1.58 2.54 1.43 -1.26 -4.30 118.68 117.32 1y4j s LEU 145 Ca 0.51 -1.21 -0.04 0.00 -1.03 0.00 0.00 54.13 52.36 1y4j s LEU 145 Cb -0.38 -1.20 0.01 0.00 0.03 0.00 0.00 46.19 44.64 1y4j s LEU 145 CO 0.47 -0.51 0.48 1.41 0.23 0.00 0.00 176.35 178.43 1y4j n HIS 146 N -1.13 -1.78 -4.62 0.29 8.25 -0.47 -3.83 115.22 111.93 1y4j n HIS 146 Ca -0.03 0.41 -0.33 0.00 -0.26 0.00 0.00 57.72 57.51 1y4j n HIS 146 Cb 0.66 -4.29 -0.13 0.00 1.12 0.00 0.00 29.99 27.35 1y4j n HIS 146 CO 0.00 0.00 0.00 0.14 0.64 0.00 0.00 176.34 177.12 1y4j s VAL 147 N -3.13 3.49 0.75 1.59 -7.23 -1.26 -4.52 120.40 110.09 1y4j s VAL 147 Ca 0.25 -0.52 -0.04 0.00 -1.81 0.00 0.00 61.98 59.86 1y4j s VAL 147 Cb -0.11 -2.47 0.13 0.00 0.56 0.00 0.00 36.38 34.48 1y4j s VAL 147 CO 0.31 0.54 1.04 -0.94 -0.31 0.00 0.00 175.10 175.73 1y4j s SER 148 N -0.01 4.22 0.23 4.85 1.04 -1.25 -4.65 113.70 118.14 1y4j s SER 148 Ca -0.01 -0.16 -0.07 0.00 0.48 0.00 0.00 55.95 56.18 1y4j s SER 148 Cb -0.14 -0.21 0.30 0.00 0.10 0.00 0.00 66.02 66.08 1y4j s SER 148 CO 0.03 -1.95 1.84 -0.25 0.98 0.00 0.00 173.24 173.89 1y4j h TRP 149 N -0.69 0.89 -0.26 5.02 7.01 -1.27 0.29 115.95 126.93 1y4j h TRP 149 Ca -0.39 0.03 -0.16 0.00 2.11 0.00 0.00 58.89 60.48 1y4j h TRP 149 Cb 1.27 -0.29 0.00 0.00 -2.10 0.00 0.00 29.16 28.04 1y4j h TRP 149 CO -0.29 0.45 -0.48 -0.91 -2.79 0.00 0.00 178.44 174.43 1y4j h ASN 150 N 0.89 0.88 -0.88 2.65 2.35 -1.94 -0.82 115.58 118.71 1y4j h ASN 150 Ca 0.35 -0.53 0.03 0.00 -0.55 0.00 0.00 56.30 55.59 1y4j h ASN 150 Cb 0.17 -0.25 -0.05 0.00 0.05 0.00 0.00 38.32 38.24 1y4j h ASN 150 CO -0.17 1.24 0.57 0.44 -1.65 0.00 0.00 177.43 177.86 1y4j h ASP 151 N 0.54 0.96 -0.31 5.81 3.32 -1.82 -1.13 116.42 123.79 1y4j h ASP 151 Ca 0.02 -0.01 -0.11 0.00 0.02 0.00 0.00 57.03 56.94 1y4j h ASP 151 Cb 1.08 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 40.40 1y4j h ASP 151 CO 0.11 0.67 -0.24 0.00 -1.72 0.00 0.00 179.24 178.06 1y4j h ALA 152 N 1.35 0.45 -0.66 3.45 0.00 -0.66 -1.67 119.26 121.53 1y4j h ALA 152 Ca 0.34 -0.38 -0.06 0.00 0.00 0.00 0.00 54.91 54.82 1y4j h ALA 152 Cb -0.04 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 1y4j h ALA 152 CO -0.10 0.43 0.20 0.00 0.00 0.00 0.00 179.25 179.78 1y4j h ARG 153 N 0.48 1.04 -0.14 0.00 3.08 -0.95 -1.26 114.38 116.62 1y4j h ARG 153 Ca 0.06 -0.23 0.02 0.00 0.07 0.00 0.00 59.98 59.90 1y4j h ARG 153 Cb 0.80 -0.15 -0.02 0.00 0.08 0.00 0.00 29.97 30.68 1y4j h ARG 153 CO 0.06 0.91 0.01 0.00 -1.07 0.00 0.00 179.97 179.88 1y4j h ALA 154 N 1.08 0.13 0.10 0.04 0.00 -1.11 0.20 119.26 119.70 1y4j h ALA 154 Ca 0.21 0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1y4j h ALA 154 Cb 0.31 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1y4j h ALA 154 CO -0.00 -0.44 -0.10 -0.92 0.00 0.00 0.00 179.25 177.79 1y4j h TYR 155 N 0.06 -0.25 -0.58 0.00 3.20 -1.03 -2.03 116.97 116.34 1y4j h TYR 155 Ca 0.06 0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.93 1y4j h TYR 155 Cb 0.07 0.10 -0.03 0.00 1.54 0.00 0.00 36.73 38.41 1y4j h TYR 155 CO -0.14 -0.15 0.35 0.00 -1.64 0.00 0.00 178.16 176.58 1y4j h ALA 157 N 1.18 1.56 -0.21 0.00 0.00 -0.83 0.24 119.26 121.20 1y4j h ALA 157 Ca 0.21 0.04 -0.09 0.00 0.00 0.00 0.00 54.91 55.07 1y4j h ALA 157 Cb -0.02 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 17.59 1y4j h ALA 157 CO -0.04 0.14 -0.24 2.35 0.00 0.00 0.00 179.25 181.45 1y4j h TRP 158 N 0.92 0.43 -0.00 0.00 7.01 -0.60 -1.98 115.95 121.73 1y4j h TRP 158 Ca 0.52 -0.09 0.00 0.00 2.11 0.00 0.00 58.89 61.44 1y4j h TRP 158 Cb 0.62 -0.11 0.00 0.00 -2.10 0.00 0.00 29.16 27.57 1y4j h TRP 158 CO -0.00 0.61 0.00 0.54 -2.79 0.00 0.00 178.44 176.80 1y4j n ARG 159 N -4.14 1.07 -1.68 2.65 5.12 -0.51 -4.89 116.66 114.28 1y4j n ARG 159 Ca -0.00 -0.10 -0.09 0.00 -1.93 0.00 0.00 57.85 55.73 1y4j n ARG 159 Cb 0.38 -1.47 -0.02 0.00 -1.16 0.00 0.00 32.46 30.20 1y4j n ARG 159 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 1y4j n GLY 160 N 0.99 0.56 0.00 -0.13 0.00 -0.75 -5.02 105.19 100.84 1y4j n GLY 160 Ca 0.22 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.65 1y4j n GLY 160 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1y4j n LYS 161 N -2.31 3.22 -3.89 1.61 5.02 0.73 -4.99 118.16 117.56 1y4j n LYS 161 Ca -0.09 0.00 -0.10 0.00 -2.02 0.00 0.00 58.31 56.10 1y4j n LYS 161 Cb 0.42 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.43 1y4j n LYS 161 CO 0.00 0.00 0.00 -0.98 -0.52 0.00 0.00 177.40 175.90 1y4j s ARG 162 N 0.00 2.06 0.41 1.97 1.70 0.28 -3.52 118.95 121.85 1y4j s ARG 162 Ca 0.00 -1.44 -0.23 0.00 -0.47 0.00 0.00 55.73 53.60 1y4j s ARG 162 Cb 0.00 0.57 -0.10 0.00 -0.57 0.00 0.00 34.95 34.86 1y4j s ARG 162 CO 0.00 -0.93 0.99 -0.51 -1.08 0.00 0.00 175.30 173.77 1y4j s LEU 163 N -3.08 4.05 0.55 -1.89 1.43 -1.26 0.49 118.68 118.96 1y4j s LEU 163 Ca 0.19 1.86 -0.17 0.00 -1.03 0.00 0.00 54.13 54.97 1y4j s LEU 163 Cb -0.04 -4.35 -0.05 0.00 0.03 0.00 0.00 46.19 41.77 1y4j s LEU 163 CO 0.13 -0.43 1.05 -2.16 0.23 0.00 0.00 176.35 175.17 1y4j s PRO 164 N -2.80 3.50 0.85 1.29 0.04 -1.26 -4.59 135.00 132.03 1y4j s PRO 164 Ca 0.60 1.27 -0.11 0.00 0.04 0.00 0.00 61.00 62.79 1y4j s PRO 164 Cb -0.16 -2.06 0.10 0.00 0.04 0.00 0.00 34.50 32.43 1y4j s PRO 164 CO 0.20 -0.67 1.09 0.95 0.04 0.00 0.00 177.00 178.62 1y4j s THR 165 N -2.27 2.92 0.32 1.26 -4.23 -1.26 0.02 115.64 112.41 1y4j s THR 165 Ca 0.65 0.30 0.17 0.00 -1.18 0.00 0.00 61.69 61.63 1y4j s THR 165 Cb -0.16 -2.84 0.13 0.00 1.34 0.00 0.00 72.50 70.96 1y4j s THR 165 CO 0.30 -0.39 1.84 1.05 -0.54 0.00 0.00 174.62 176.88 1y4j h GLU 166 N -1.35 0.00 -0.17 3.99 4.11 -1.93 -0.39 114.58 118.84 1y4j h GLU 166 Ca -0.48 0.00 -0.03 0.00 0.07 0.00 0.00 59.36 58.93 1y4j h GLU 166 Cb 1.27 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.51 1y4j h GLU 166 CO 0.55 0.34 0.00 0.93 0.07 0.00 0.00 179.01 180.90 1y4j h GLU 167 N 0.00 0.30 -0.42 1.06 3.07 -1.99 -1.03 114.58 115.58 1y4j h GLU 167 Ca -0.00 -0.09 0.05 0.00 -0.50 0.00 0.00 59.36 58.81 1y4j h GLU 167 Cb 0.68 -0.03 -0.04 0.00 -0.84 0.00 0.00 28.75 28.52 1y4j h GLU 167 CO 0.04 0.51 0.16 0.93 -1.40 0.00 0.00 179.01 179.25 1y4j h GLU 168 N 0.06 0.32 -0.11 2.33 5.08 -1.88 -0.45 114.58 119.92 1y4j h GLU 168 Ca 0.05 -0.02 0.03 0.00 -1.00 0.00 0.00 59.36 58.42 1y4j h GLU 168 Cb 0.37 -0.07 -0.04 0.00 0.50 0.00 0.00 28.75 29.51 1y4j h GLU 168 CO 0.01 0.21 -0.10 2.35 -1.00 0.00 0.00 179.01 180.48 1y4j h TRP 169 N 0.33 -0.24 -0.45 4.33 7.01 -0.96 -0.03 115.95 125.94 1y4j h TRP 169 Ca 0.19 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 61.08 1y4j h TRP 169 Cb 0.17 0.12 -0.01 0.00 -2.10 0.00 0.00 29.16 27.34 1y4j h TRP 169 CO -0.14 -0.15 -0.20 1.49 -2.79 0.00 0.00 178.44 176.65 1y4j h GLU 170 N -0.11 0.94 -0.60 2.65 4.81 -1.07 -0.20 114.58 120.99 1y4j h GLU 170 Ca 0.08 -0.40 0.10 0.00 -0.13 0.00 0.00 59.36 59.00 1y4j h GLU 170 Cb 0.22 -0.03 -0.07 0.00 0.63 0.00 0.00 28.75 29.50 1y4j h GLU 170 CO -0.18 1.06 0.21 0.35 -0.73 0.00 0.00 179.01 179.72 1y4j h PHE 171 N 0.78 0.37 -0.24 0.92 3.57 -0.89 -0.90 116.94 120.55 1y4j h PHE 171 Ca 0.10 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.60 1y4j h PHE 171 Cb 0.77 -0.07 -0.01 0.00 2.79 0.00 0.00 35.95 39.43 1y4j h PHE 171 CO 0.05 0.08 0.03 0.00 -2.23 0.00 0.00 178.31 176.24 1y4j h ALA 172 N 1.42 0.32 -0.46 2.41 0.00 -0.63 -2.95 119.26 119.37 1y4j h ALA 172 Ca 0.31 -0.19 0.01 0.00 0.00 0.00 0.00 54.91 55.04 1y4j h ALA 172 Cb 0.39 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1y4j h ALA 172 CO -0.32 0.01 0.31 0.00 0.00 0.00 0.00 179.25 179.25 1y4j h ALA 173 N 0.84 1.70 0.00 0.00 0.00 -0.58 -2.63 119.26 118.59 1y4j h ALA 173 Ca 0.07 -0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1y4j h ALA 173 Cb 0.34 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 1y4j h ALA 173 CO 0.01 0.27 -0.12 0.00 0.00 0.00 0.00 179.25 179.40 1y4j h ARG 174 N 0.60 0.00 -2.64 0.00 3.08 -1.00 -3.38 114.38 111.04 1y4j h ARG 174 Ca 0.17 0.00 -0.35 0.00 0.07 0.00 0.00 59.98 59.87 1y4j h ARG 174 Cb -0.03 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.01 1y4j h ARG 174 CO -0.04 0.12 -0.46 0.41 -1.07 0.00 0.00 179.97 178.94 1y4j n GLY 175 N 0.28 -0.35 2.07 0.04 0.00 -0.99 -2.08 105.19 104.16 1y4j n GLY 175 Ca 0.01 -0.13 0.00 0.00 0.00 0.00 0.00 46.02 45.89 1y4j n GLY 175 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1y4j n GLY 176 N -1.06 1.62 3.83 -0.02 0.00 -1.26 -4.10 105.19 104.21 1y4j n GLY 176 Ca -0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.50 1y4j n GLY 176 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y4j s LEU 177 N 0.00 3.98 -0.25 0.99 1.43 -0.88 -5.05 118.68 118.91 1y4j s LEU 177 Ca 0.00 1.52 -0.07 0.00 -1.03 0.00 0.00 54.13 54.55 1y4j s LEU 177 Cb 0.00 -4.36 -0.03 0.00 0.03 0.00 0.00 46.19 41.83 1y4j s LEU 177 CO 0.00 -0.31 0.07 -0.54 0.23 0.00 0.00 176.35 175.80 1y4j s LYS 178 N -3.13 3.66 -1.77 1.70 1.02 -1.26 -4.65 119.74 115.31 1y4j s LYS 178 Ca 0.59 -0.47 0.00 0.00 0.02 0.00 0.00 55.97 56.10 1y4j s LYS 178 Cb -0.09 -3.31 0.00 0.00 -0.52 0.00 0.00 37.83 33.90 1y4j s LYS 178 CO 0.15 -0.17 0.00 0.41 -0.92 0.00 0.00 175.35 174.82 1y4j n GLY 179 N 4.86 -0.20 3.92 -3.33 0.00 -1.26 -4.98 105.19 104.20 1y4j n GLY 179 Ca -0.16 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.60 1y4j n GLY 179 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1y4j s GLN 180 N -4.88 2.84 0.02 1.61 -1.52 -1.26 -5.01 119.66 111.46 1y4j s GLN 180 Ca 0.00 -0.07 -0.01 0.00 -1.95 0.00 0.00 55.36 53.32 1y4j s GLN 180 Cb 0.00 -2.28 -0.27 0.00 -0.22 0.00 0.00 33.01 30.24 1y4j s GLN 180 CO 0.00 -0.74 0.91 0.28 -0.25 0.00 0.00 175.29 175.50 1y4j h VAL 181 N -0.19 1.22 -2.75 1.09 2.07 -1.83 -3.46 116.25 112.40 1y4j h VAL 181 Ca -0.45 -2.87 -0.54 0.00 0.82 0.00 0.00 66.70 63.66 1y4j h VAL 181 Cb 1.26 2.77 -0.15 0.00 -1.52 0.00 0.00 31.29 33.65 1y4j h VAL 181 CO 0.60 0.82 -0.76 -0.31 0.02 0.00 0.00 177.57 177.94 1y4j s TYR 182 N -2.63 1.99 0.54 1.57 1.51 -0.04 -0.18 117.35 120.10 1y4j s TYR 182 Ca -0.07 -0.45 0.29 0.00 -1.01 0.00 0.00 57.07 55.83 1y4j s TYR 182 Cb 0.07 -0.91 1.45 0.00 -0.11 0.00 0.00 41.96 42.46 1y4j s TYR 182 CO 0.85 0.49 1.93 -1.35 -1.11 0.00 0.00 175.55 176.37 1y4j h PRO 183 N 2.65 0.00 -0.01 -1.71 0.11 -1.81 -2.45 132.00 128.76 1y4j h PRO 183 Ca -0.40 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1y4j h PRO 183 Cb 1.23 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.34 1y4j h PRO 183 CO 0.58 0.00 -0.44 -2.67 -0.21 0.00 0.00 178.00 175.26 1y4j n TRP 184 N -4.26 0.00 -1.03 0.65 2.14 -1.14 -4.53 117.44 109.26 1y4j n TRP 184 Ca 0.14 0.00 0.00 0.00 2.07 0.00 0.00 57.50 59.71 1y4j n TRP 184 Cb 0.81 0.00 0.00 0.00 -0.81 0.00 0.00 31.31 31.31 1y4j n TRP 184 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 1y4j n GLY 185 N 1.35 0.28 0.09 -1.67 0.00 -0.92 -4.95 105.19 99.36 1y4j n GLY 185 Ca 0.09 -1.72 0.12 0.00 0.00 0.00 0.00 46.02 44.51 1y4j n GLY 185 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1y4j h ASN 186 N 0.00 0.00 -3.79 1.61 2.35 -1.94 -0.07 115.58 113.74 1y4j h ASN 186 Ca 0.00 -0.13 -0.68 0.00 -0.55 0.00 0.00 56.30 54.94 1y4j h ASN 186 Cb 0.00 0.00 -0.25 0.00 0.05 0.00 0.00 38.32 38.12 1y4j h ASN 186 CO 0.00 0.06 -0.77 0.26 -1.65 0.00 0.00 177.43 175.33 1y4j s TRP 187 N -3.16 2.74 0.43 1.19 0.52 -1.26 -4.67 118.94 114.73 1y4j s TRP 187 Ca 0.07 -0.32 -0.25 0.00 0.02 0.00 0.00 56.10 55.62 1y4j s TRP 187 Cb 0.12 -1.70 -0.08 0.00 -1.15 0.00 0.00 33.47 30.67 1y4j s TRP 187 CO 0.68 0.05 1.25 0.12 0.02 0.00 0.00 176.95 179.07 1y4j s PHE 188 N -0.37 2.82 -0.02 -1.98 5.36 -1.26 -4.98 117.98 117.56 1y4j s PHE 188 Ca 0.04 1.47 0.02 0.00 -0.96 0.00 0.00 56.93 57.50 1y4j s PHE 188 Cb -0.12 -3.55 0.00 0.00 -0.34 0.00 0.00 43.02 39.01 1y4j s PHE 188 CO 0.02 -1.87 -0.07 -0.65 -1.46 0.00 0.00 175.22 171.19 1y4j s GLN 189 N -2.44 0.73 0.60 10.12 -0.21 -1.26 -5.13 119.66 122.06 1y4j s GLN 189 Ca 0.60 -0.22 -0.17 0.00 0.02 0.00 0.00 55.36 55.59 1y4j s GLN 189 Cb -0.34 -0.71 -0.03 0.00 1.00 0.00 0.00 33.01 32.92 1y4j s GLN 189 CO 0.43 0.08 1.09 -1.25 -2.12 0.00 0.00 175.29 173.52 1y4j s PRO 190 N 0.22 3.16 -1.04 2.91 0.04 -1.26 -3.88 135.00 135.15 1y4j s PRO 190 Ca -0.03 1.38 -0.01 0.00 0.04 0.00 0.00 61.00 62.38 1y4j s PRO 190 Cb -0.07 -2.00 0.00 0.00 0.04 0.00 0.00 34.50 32.47 1y4j s PRO 190 CO 0.00 -0.96 0.19 0.09 0.04 0.00 0.00 177.00 176.36 1y4j n ASN 191 N -1.93 -4.24 -0.00 6.66 3.02 -1.26 -4.89 115.26 112.61 1y4j n ASN 191 Ca 0.10 -0.10 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 1y4j n ASN 191 Cb 0.52 -3.27 -0.04 0.00 -0.61 0.00 0.00 39.78 36.37 1y4j n ASN 191 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 1y4j n ARG 192 N -2.53 1.58 -3.71 3.52 5.12 -1.25 -4.70 116.66 114.69 1y4j n ARG 192 Ca -0.11 -0.04 -0.14 0.00 -1.93 0.00 0.00 57.85 55.63 1y4j n ARG 192 Cb 0.60 -1.04 -0.09 0.00 -1.16 0.00 0.00 32.46 30.77 1y4j n ARG 192 CO 0.00 0.00 0.00 -0.08 -1.93 0.00 0.00 177.63 175.62 1y4j s THR 193 N -2.18 0.03 -0.68 0.55 -1.32 -1.26 -4.80 115.64 105.98 1y4j s THR 193 Ca -0.01 -0.23 -0.23 0.00 -1.21 0.00 0.00 61.69 60.01 1y4j s THR 193 Cb 0.04 -0.66 0.06 0.00 -1.51 0.00 0.00 72.50 70.43 1y4j s THR 193 CO 0.25 -0.12 1.03 0.21 -2.21 0.00 0.00 174.62 173.78 1y4j s ASN 194 N -0.72 6.18 0.00 8.08 2.47 -1.26 -4.90 114.94 124.79 1y4j s ASN 194 Ca -0.08 -0.89 0.00 0.00 0.42 0.00 0.00 52.86 52.30 1y4j s ASN 194 Cb -0.04 -2.45 0.00 0.00 -1.45 0.00 0.00 41.25 37.32 1y4j s ASN 194 CO 0.04 -1.52 0.00 0.18 -3.72 0.00 0.00 177.10 172.08 1y4j n LEU 195 N 8.05 0.00 -4.62 3.21 4.77 -1.26 0.04 117.00 127.18 1y4j n LEU 195 Ca -0.02 0.00 -0.34 0.00 -0.03 0.00 0.00 56.01 55.62 1y4j n LEU 195 Cb 0.46 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.45 1y4j n LEU 195 CO 0.65 0.00 -0.33 0.86 -1.33 0.00 0.00 177.39 177.25 1y4j s TRP 196 N -0.34 3.10 -0.11 -1.77 -0.11 0.68 -4.73 118.94 115.65 1y4j s TRP 196 Ca 0.00 0.04 0.02 0.00 1.22 0.00 0.00 56.10 57.39 1y4j s TRP 196 Cb 0.00 -1.83 0.01 0.00 -1.50 0.00 0.00 33.47 30.15 1y4j s TRP 196 CO 0.00 0.31 -0.18 -0.65 -4.62 0.00 0.00 176.95 171.81 1y4j s GLN 197 N -0.50 2.52 0.00 5.86 1.11 -1.26 -4.60 119.66 122.79 1y4j s GLN 197 Ca 0.08 -0.68 0.00 0.00 0.01 0.00 0.00 55.36 54.78 1y4j s GLN 197 Cb -0.12 -2.07 0.00 0.00 -1.01 0.00 0.00 33.01 29.81 1y4j s GLN 197 CO 0.02 -0.01 0.00 0.41 0.01 0.00 0.00 175.29 175.72 1y4j n GLY 198 N 4.05 -1.08 3.77 3.09 0.00 -1.26 0.69 105.19 114.45 1y4j n GLY 198 Ca -0.20 -2.17 -0.41 0.00 0.00 0.00 0.00 46.02 43.24 1y4j n GLY 198 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y4j s LYS 199 N -0.17 4.21 -0.01 1.61 -0.14 -1.19 -4.80 119.74 119.25 1y4j s LYS 199 Ca 0.00 2.40 0.06 0.00 -1.36 0.00 0.00 55.97 57.07 1y4j s LYS 199 Cb 0.00 -3.01 -0.02 0.00 -1.68 0.00 0.00 37.83 33.12 1y4j s LYS 199 CO 0.00 -0.38 -0.21 0.12 -0.76 0.00 0.00 175.35 174.12 1y4j s PHE 200 N -1.13 2.49 -2.18 3.18 5.36 -1.26 0.62 117.98 125.06 1y4j s PHE 200 Ca 0.51 -0.31 0.20 0.00 -0.96 0.00 0.00 56.93 56.37 1y4j s PHE 200 Cb -0.43 -1.53 0.53 0.00 -0.34 0.00 0.00 43.02 41.25 1y4j s PHE 200 CO 0.58 0.10 1.44 -0.35 -1.46 0.00 0.00 175.22 175.54 1y4j n PRO 201 N 2.18 2.30 0.00 10.12 -0.04 -1.26 -4.88 135.00 143.43 1y4j n PRO 201 Ca -0.16 -2.00 0.05 0.00 -0.04 0.00 0.00 63.50 61.35 1y4j n PRO 201 Cb 0.52 -1.46 -0.04 0.00 -0.04 0.00 0.00 33.50 32.48 1y4j n PRO 201 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1y4j n LYS 202 N 1.15 2.94 -2.04 0.54 4.76 -1.24 -4.76 118.16 119.50 1y4j n LYS 202 Ca 0.19 -0.26 -0.25 0.00 -2.87 0.00 0.00 58.31 55.11 1y4j n LYS 202 Cb 0.50 -1.04 0.02 0.00 -1.84 0.00 0.00 35.03 32.67 1y4j n LYS 202 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1y4j n GLY 203 N 1.12 6.30 3.66 0.72 0.00 0.20 -5.02 105.19 112.18 1y4j n GLY 203 Ca 0.03 -2.66 -0.42 0.00 0.00 0.00 0.00 46.02 42.97 1y4j n GLY 203 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1y4j s ASP 204 N -3.44 6.56 0.18 1.61 2.15 -1.21 -3.15 116.67 119.37 1y4j s ASP 204 Ca 0.51 2.45 0.25 0.00 0.43 0.00 0.00 52.55 56.20 1y4j s ASP 204 Cb 0.42 -2.53 0.66 0.00 -0.30 0.00 0.00 42.92 41.16 1y4j s ASP 204 CO -0.00 -0.98 1.62 0.29 -0.17 0.00 0.00 175.17 175.93 1y4j n LYS 205 N 7.25 0.27 -3.47 4.34 5.02 0.22 -4.96 118.16 126.82 1y4j n LYS 205 Ca 0.18 0.17 -0.25 0.00 -2.02 0.00 0.00 58.31 56.39 1y4j n LYS 205 Cb 0.42 -1.76 0.04 0.00 -0.02 0.00 0.00 35.03 33.71 1y4j n LYS 205 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y4j n ALA 206 N -1.79 -1.16 0.21 7.82 0.00 -1.26 -4.86 120.51 119.47 1y4j n ALA 206 Ca 0.05 0.26 0.05 0.00 0.00 0.00 0.00 53.44 53.81 1y4j n ALA 206 Cb 0.43 -4.31 0.47 0.00 0.00 0.00 0.00 19.45 16.04 1y4j n ALA 206 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1y4j h GLU 207 N -1.86 0.00 -0.03 0.00 5.08 -1.90 -1.50 114.58 114.38 1y4j h GLU 207 Ca -0.54 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.82 1y4j h GLU 207 Cb 1.36 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.61 1y4j h GLU 207 CO 0.59 0.27 0.00 -0.40 -1.00 0.00 0.00 179.01 178.47 1y4j n ASP 208 N -4.03 0.35 0.00 1.42 5.68 -1.26 -4.84 116.55 113.87 1y4j n ASP 208 Ca -0.02 -1.39 0.00 0.00 -0.50 0.00 0.00 54.79 52.88 1y4j n ASP 208 Cb 0.34 -0.02 0.00 0.00 -1.14 0.00 0.00 41.12 40.30 1y4j n ASP 208 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1y4j n GLY 209 N 0.91 1.60 2.92 6.12 0.00 -0.56 -4.90 105.19 111.27 1y4j n GLY 209 Ca 0.16 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 1y4j n GLY 209 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1y4j s PHE 210 N -2.34 0.81 -0.32 1.61 0.40 -1.26 -5.05 117.98 111.84 1y4j s PHE 210 Ca 0.00 -0.23 -0.06 0.00 -0.60 0.00 0.00 56.93 56.04 1y4j s PHE 210 Cb 0.00 -0.68 0.03 0.00 0.51 0.00 0.00 43.02 42.88 1y4j s PHE 210 CO 0.00 -0.18 0.08 -1.58 0.70 0.00 0.00 175.22 174.24 1y4j s HIS 211 N 0.74 3.22 0.00 0.36 5.65 -1.26 -4.66 115.29 119.34 1y4j s HIS 211 Ca -0.11 -1.36 0.00 0.00 0.25 0.00 0.00 55.06 53.84 1y4j s HIS 211 Cb -0.13 -2.24 0.00 0.00 -1.18 0.00 0.00 32.58 29.03 1y4j s HIS 211 CO 0.01 -0.70 0.00 0.41 -0.65 0.00 0.00 174.74 173.81 1y4j n GLY 212 N 4.80 -1.69 3.77 1.59 0.00 -1.26 -5.01 105.19 107.38 1y4j n GLY 212 Ca -0.13 -2.04 -0.37 0.00 0.00 0.00 0.00 46.02 43.47 1y4j n GLY 212 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y4j s VAL 213 N 0.00 2.98 0.26 1.61 1.01 -1.26 -4.90 120.40 120.10 1y4j s VAL 213 Ca 0.00 0.75 0.12 0.00 0.00 0.00 0.00 61.98 62.85 1y4j s VAL 213 Cb 0.00 -3.39 -0.05 0.00 0.00 0.00 0.00 36.38 32.94 1y4j s VAL 213 CO 0.00 0.01 -0.19 -0.94 0.00 0.00 0.00 175.10 173.98 1y4j s SER 214 N -1.25 3.64 0.45 3.32 1.04 -1.26 -5.06 113.70 114.57 1y4j s SER 214 Ca 0.63 -0.97 -0.24 0.00 0.48 0.00 0.00 55.95 55.85 1y4j s SER 214 Cb -0.31 -0.34 -0.09 0.00 0.10 0.00 0.00 66.02 65.39 1y4j s SER 214 CO 0.37 0.05 1.15 -2.65 0.98 0.00 0.00 173.24 173.15 1y4j n PRO 215 N -0.49 1.59 0.23 4.02 -0.02 -1.26 -4.22 135.00 134.85 1y4j n PRO 215 Ca -0.06 0.57 0.15 0.00 -2.02 0.00 0.00 63.50 62.14 1y4j n PRO 215 Cb 0.59 -2.25 0.82 0.00 -0.02 0.00 0.00 33.50 32.64 1y4j n PRO 215 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 1y4j h VAL 216 N 1.67 0.60 -0.46 -1.45 -1.51 -1.39 -1.62 116.25 112.09 1y4j h VAL 216 Ca -0.47 0.00 -0.01 0.00 -1.23 0.00 0.00 66.70 65.00 1y4j h VAL 216 Cb 1.32 0.91 -0.00 0.00 -2.13 0.00 0.00 31.29 31.39 1y4j h VAL 216 CO 0.58 0.00 0.01 -0.46 -1.23 0.00 0.00 177.57 176.46 1y4j n ASN 217 N -3.98 5.02 -0.05 4.19 6.94 -1.26 -4.52 115.26 121.59 1y4j n ASN 217 Ca -0.00 -2.98 -0.04 0.00 -0.02 0.00 0.00 54.58 51.54 1y4j n ASN 217 Cb 0.23 -0.64 0.18 0.00 -2.36 0.00 0.00 39.78 37.19 1y4j n ASN 217 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1y4j h ALA 218 N 3.13 1.10 -2.08 -2.53 0.00 -1.65 -3.44 119.26 113.79 1y4j h ALA 218 Ca 0.01 -0.30 -0.52 0.00 0.00 0.00 0.00 54.91 54.10 1y4j h ALA 218 Cb 1.80 -0.16 -0.06 0.00 0.00 0.00 0.00 17.79 19.36 1y4j h ALA 218 CO 0.40 0.56 -0.54 -0.06 0.00 0.00 0.00 179.25 179.61 1y4j s PHE 219 N -4.78 2.91 1.00 0.00 0.08 -1.26 -5.08 117.98 110.85 1y4j s PHE 219 Ca -0.08 -0.22 -0.11 0.00 0.12 0.00 0.00 56.93 56.64 1y4j s PHE 219 Cb 0.14 -1.47 0.19 0.00 -0.57 0.00 0.00 43.02 41.32 1y4j s PHE 219 CO 0.80 0.45 1.10 -2.30 -0.10 0.00 0.00 175.22 175.17 1y4j n PRO 220 N -1.15 -1.09 -1.53 0.24 -0.02 -1.26 -4.91 135.00 125.28 1y4j n PRO 220 Ca -0.06 -0.26 -0.48 0.00 -2.02 0.00 0.00 63.50 60.68 1y4j n PRO 220 Cb 0.59 -2.31 -0.03 0.00 -0.02 0.00 0.00 33.50 31.73 1y4j n PRO 220 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1y4j n ALA 221 N -4.49 -1.34 0.67 3.55 0.00 -1.26 -4.75 120.51 112.90 1y4j n ALA 221 Ca 0.09 0.44 0.12 0.00 0.00 0.00 0.00 53.44 54.10 1y4j n ALA 221 Cb 0.53 -1.90 0.26 0.00 0.00 0.00 0.00 19.45 18.34 1y4j n ALA 221 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1y4j n GLN 222 N 1.22 0.23 -3.85 0.00 6.02 0.21 -4.97 117.38 116.24 1y4j n GLN 222 Ca 0.14 0.10 -0.10 0.00 -0.01 0.00 0.00 57.00 57.13 1y4j n GLN 222 Cb 0.26 -1.67 0.02 0.00 1.02 0.00 0.00 30.24 29.86 1y4j n GLN 222 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 1y4j s ASN 223 N -4.04 0.18 0.11 1.08 2.20 -1.25 -2.87 114.94 110.35 1y4j s ASN 223 Ca 0.08 -1.24 0.22 0.00 -0.94 0.00 0.00 52.86 50.98 1y4j s ASN 223 Cb 0.14 0.83 0.88 0.00 -2.00 0.00 0.00 41.25 41.11 1y4j s ASN 223 CO 0.68 -1.66 1.68 0.59 -2.94 0.00 0.00 177.10 175.45 1y4j n ASN 224 N -1.49 0.33 -0.06 3.54 3.02 -1.26 -1.79 115.26 117.55 1y4j n ASN 224 Ca -0.07 0.56 0.15 0.00 -0.03 0.00 0.00 54.58 55.19 1y4j n ASN 224 Cb 0.60 -0.64 0.71 0.00 -0.61 0.00 0.00 39.78 39.84 1y4j n ASN 224 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 1y4j n TYR 225 N -1.85 0.00 -2.12 3.10 4.01 -1.26 -4.93 117.16 114.11 1y4j n TYR 225 Ca 0.04 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.72 1y4j n TYR 225 Cb 0.27 -0.19 -0.00 0.00 -0.31 0.00 0.00 39.34 39.10 1y4j n TYR 225 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1y4j n GLY 226 N 1.24 0.11 3.89 2.72 0.00 -0.74 -4.98 105.19 107.43 1y4j n GLY 226 Ca 0.16 -0.62 -0.33 0.00 0.00 0.00 0.00 46.02 45.23 1y4j n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1y4j s LEU 227 N -1.84 4.32 0.05 0.99 1.43 -1.26 -4.92 118.68 117.45 1y4j s LEU 227 Ca 0.00 0.59 0.09 0.00 -1.03 0.00 0.00 54.13 53.78 1y4j s LEU 227 Cb 0.00 -3.05 -0.03 0.00 0.03 0.00 0.00 46.19 43.14 1y4j s LEU 227 CO 0.00 0.14 -0.24 -0.31 0.23 0.00 0.00 176.35 176.17 1y4j s TYR 228 N -1.50 2.39 -1.27 0.29 2.02 -0.43 -0.62 117.35 118.23 1y4j s TYR 228 Ca 0.35 -0.36 0.00 0.00 -0.37 0.00 0.00 57.07 56.69 1y4j s TYR 228 Cb -0.13 -1.40 0.00 0.00 -0.40 0.00 0.00 41.96 40.03 1y4j s TYR 228 CO 0.21 0.18 0.00 -3.47 -1.57 0.00 0.00 175.55 170.90 1y4j n ASP 229 N 1.65 -4.42 0.20 2.29 4.64 -1.26 -4.54 116.55 115.11 1y4j n ASP 229 Ca -0.17 0.28 -0.12 0.00 -1.38 0.00 0.00 54.79 53.39 1y4j n ASP 229 Cb 0.52 -3.04 -0.07 0.00 -1.04 0.00 0.00 41.12 37.49 1y4j n ASP 229 CO 0.00 0.00 0.00 -0.07 -0.82 0.00 0.00 177.20 176.31 1y4j h LEU 230 N 0.00 -0.47 -9.43 -2.67 3.38 -1.92 -3.42 115.31 100.77 1y4j h LEU 230 Ca -0.25 -0.11 -0.54 0.00 0.09 0.00 0.00 57.88 57.07 1y4j h LEU 230 Cb 0.83 0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.70 1y4j h LEU 230 CO 0.36 -0.07 0.56 -0.22 0.09 0.00 0.00 178.44 179.17 1y4j s LEU 231 N -9.37 4.35 0.00 1.67 2.96 -1.26 -4.40 118.68 112.62 1y4j s LEU 231 Ca -0.13 1.91 0.00 0.00 -0.22 0.00 0.00 54.13 55.70 1y4j s LEU 231 Cb 0.01 -3.57 0.00 0.00 0.50 0.00 0.00 46.19 43.13 1y4j s LEU 231 CO 0.44 -0.46 0.00 0.61 -1.32 0.00 0.00 176.35 175.62 1y4j n GLY 232 N 3.20 -2.03 5.61 7.98 0.00 0.51 -4.40 105.19 116.06 1y4j n GLY 232 Ca 0.09 -1.40 0.00 0.00 0.00 0.00 0.00 46.02 44.71 1y4j n GLY 232 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1y4j n ASN 233 N -0.58 0.00 -4.30 1.61 5.15 0.11 -4.60 115.26 112.65 1y4j n ASN 233 Ca 0.00 0.00 -0.27 0.00 -0.60 0.00 0.00 54.58 53.71 1y4j n ASN 233 Cb 0.06 0.00 -0.14 0.00 -0.53 0.00 0.00 39.78 39.17 1y4j n ASN 233 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 1y4j s VAL 234 N 0.00 1.87 0.77 3.44 -7.23 -1.26 -0.63 120.40 117.36 1y4j s VAL 234 Ca 0.00 -1.35 -0.15 0.00 -1.81 0.00 0.00 61.98 58.67 1y4j s VAL 234 Cb 0.00 -1.63 0.02 0.00 0.56 0.00 0.00 36.38 35.33 1y4j s VAL 234 CO 0.00 0.21 0.88 0.79 -0.31 0.00 0.00 175.10 176.67 1y4j n TRP 235 N 1.65 0.31 -4.18 2.82 7.02 -0.37 -4.61 117.44 120.07 1y4j n TRP 235 Ca -0.17 0.37 -0.25 0.00 -1.02 0.00 0.00 57.50 56.43 1y4j n TRP 235 Cb 0.53 -2.02 -0.17 0.00 -2.42 0.00 0.00 31.31 27.23 1y4j n TRP 235 CO 0.00 0.00 0.00 -1.21 -2.02 0.00 0.00 177.69 174.46 1y4j s GLU 236 N -3.44 1.51 0.31 -0.99 2.02 0.66 -0.13 118.70 118.65 1y4j s GLU 236 Ca 0.70 -0.29 -0.30 0.00 0.02 0.00 0.00 54.97 55.10 1y4j s GLU 236 Cb -0.32 -1.44 -0.12 0.00 0.10 0.00 0.00 34.13 32.35 1y4j s GLU 236 CO 0.54 -0.14 1.55 0.91 0.02 0.00 0.00 175.26 178.14 1y4j n TRP 237 N 4.44 2.83 -4.33 1.61 7.02 -0.67 -1.28 117.44 127.06 1y4j n TRP 237 Ca -0.17 0.32 -0.27 0.00 -1.02 0.00 0.00 57.50 56.36 1y4j n TRP 237 Cb 0.51 -2.57 -0.08 0.00 -2.42 0.00 0.00 31.31 26.75 1y4j n TRP 237 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 1y4j s THR 238 N -0.31 2.05 -0.53 -0.99 -4.23 -0.44 -4.65 115.64 106.54 1y4j s THR 238 Ca 0.61 -1.81 0.26 0.00 -1.18 0.00 0.00 61.69 59.57 1y4j s THR 238 Cb -0.50 -2.86 0.30 0.00 1.34 0.00 0.00 72.50 70.79 1y4j s THR 238 CO 0.53 0.00 1.75 0.00 -0.54 0.00 0.00 174.62 176.36 1y4j h ALA 239 N 1.48 1.00 -2.61 3.99 0.00 -0.66 -3.40 119.26 119.06 1y4j h ALA 239 Ca -0.43 0.00 -0.49 0.00 0.00 0.00 0.00 54.91 54.00 1y4j h ALA 239 Cb 1.26 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.05 1y4j h ALA 239 CO 0.73 0.00 0.40 -1.12 0.00 0.00 0.00 179.25 179.26 1y4j s SER 240 N -4.98 7.16 0.38 0.00 0.01 -1.26 -4.92 113.70 110.09 1y4j s SER 240 Ca 0.07 2.04 -0.26 0.00 1.31 0.00 0.00 55.95 59.11 1y4j s SER 240 Cb 0.10 -2.60 -0.09 0.00 0.21 0.00 0.00 66.02 63.64 1y4j s SER 240 CO 0.57 -0.20 1.24 -2.16 0.41 0.00 0.00 173.24 173.09 1y4j s PRO 241 N -1.92 4.11 -0.29 12.44 0.04 -1.26 -1.44 135.00 146.67 1y4j s PRO 241 Ca 0.50 2.02 -0.13 0.00 0.04 0.00 0.00 61.00 63.43 1y4j s PRO 241 Cb -0.24 -2.81 -0.04 0.00 0.04 0.00 0.00 34.50 31.45 1y4j s PRO 241 CO 0.31 -0.33 0.30 -0.47 0.04 0.00 0.00 177.00 176.84 1y4j s TYR 242 N -1.29 3.23 0.00 0.56 5.04 -0.47 -4.62 117.35 119.80 1y4j s TYR 242 Ca 0.55 0.21 0.00 0.00 -2.44 0.00 0.00 57.07 55.38 1y4j s TYR 242 Cb -0.35 -2.51 0.00 0.00 0.35 0.00 0.00 41.96 39.45 1y4j s TYR 242 CO 0.45 -0.24 0.00 1.04 -1.34 0.00 0.00 175.55 175.46 1y4j n GLN 243 N 5.23 0.00 -1.88 4.97 6.02 -1.26 -4.40 117.38 126.05 1y4j n GLN 243 Ca -0.11 0.00 -0.40 0.00 -0.01 0.00 0.00 57.00 56.48 1y4j n GLN 243 Cb 0.51 0.00 -0.00 0.00 1.02 0.00 0.00 30.24 31.77 1y4j n GLN 243 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1y4j s ALA 244 N -1.72 3.44 0.38 -1.58 0.00 -1.26 -4.89 121.76 116.12 1y4j s ALA 244 Ca 0.00 1.45 0.10 0.00 0.00 0.00 0.00 51.96 53.52 1y4j s ALA 244 Cb 0.00 -3.57 0.87 0.00 0.00 0.00 0.00 23.12 20.42 1y4j s ALA 244 CO 0.00 -0.99 1.90 0.00 0.00 0.00 0.00 175.76 176.67 1y4j h ALA 245 N 2.85 1.89 -0.32 0.00 0.00 -1.96 -1.29 119.26 120.43 1y4j h ALA 245 Ca -0.50 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.47 1y4j h ALA 245 Cb 1.24 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.90 1y4j h ALA 245 CO 0.63 -0.09 0.22 0.93 0.00 0.00 0.00 179.25 180.94 1y4j h GLU 246 N 0.62 0.19 0.00 0.00 3.07 -1.95 -0.50 114.58 116.01 1y4j h GLU 246 Ca 0.40 -0.01 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1y4j h GLU 246 Cb 0.66 -0.04 0.00 0.00 -0.84 0.00 0.00 28.75 28.53 1y4j h GLU 246 CO -0.16 0.12 0.00 1.96 -1.40 0.00 0.00 179.01 179.54 1y4j h GLN 247 N 0.19 0.00 -6.40 2.33 4.20 -1.57 -3.47 115.11 110.40 1y4j h GLN 247 Ca 0.14 0.00 -0.47 0.00 0.06 0.00 0.00 58.65 58.38 1y4j h GLN 247 Cb 0.32 0.00 0.06 0.00 0.30 0.00 0.00 27.48 28.16 1y4j h GLN 247 CO -0.02 0.00 -0.96 -3.47 -0.67 0.00 0.00 178.83 173.71 1y4j n ASP 248 N -2.61 -4.87 -4.32 1.46 2.03 -0.20 -5.00 116.55 103.04 1y4j n ASP 248 Ca 0.02 -1.08 -0.20 0.00 0.52 0.00 0.00 54.79 54.04 1y4j n ASP 248 Cb 0.28 -2.97 -0.11 0.00 -0.72 0.00 0.00 41.12 37.61 1y4j n ASP 248 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1y4j s MET 249 N -6.34 1.25 0.24 -0.67 -1.94 -1.26 -4.32 119.30 106.26 1y4j s MET 249 Ca 0.46 -1.45 0.11 0.00 -1.71 0.00 0.00 55.69 53.11 1y4j s MET 249 Cb -0.19 -1.18 -0.05 0.00 2.01 0.00 0.00 34.83 35.42 1y4j s MET 249 CO 0.89 0.22 -0.19 1.03 -0.01 0.00 0.00 175.02 176.96 1y4j s ARG 250 N -3.09 1.69 -0.07 2.03 1.81 0.40 -1.37 118.95 120.36 1y4j s ARG 250 Ca 0.17 -1.63 -0.24 0.00 -1.72 0.00 0.00 55.73 52.31 1y4j s ARG 250 Cb -0.04 -1.85 -0.03 0.00 -0.45 0.00 0.00 34.95 32.58 1y4j s ARG 250 CO 0.06 0.36 0.73 0.08 -0.68 0.00 0.00 175.30 175.86 1y4j s VAL 251 N -2.14 5.02 -0.02 3.52 1.01 -0.52 -1.21 120.40 126.06 1y4j s VAL 251 Ca 0.26 1.51 -0.03 0.00 0.00 0.00 0.00 61.98 63.73 1y4j s VAL 251 Cb -0.06 -4.07 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1y4j s VAL 251 CO 0.13 0.23 0.16 -0.76 0.00 0.00 0.00 175.10 174.87 1y4j s LEU 252 N 0.89 4.28 0.21 3.92 1.43 0.70 -1.33 118.68 128.79 1y4j s LEU 252 Ca 0.39 0.32 0.05 0.00 -1.03 0.00 0.00 54.13 53.85 1y4j s LEU 252 Cb -0.18 -2.51 -0.05 0.00 0.03 0.00 0.00 46.19 43.48 1y4j s LEU 252 CO 0.19 0.27 -0.06 -0.13 0.23 0.00 0.00 176.35 176.85 1y4j s ARG 253 N -1.84 1.30 0.00 1.70 1.81 -0.40 -2.06 118.95 119.46 1y4j s ARG 253 Ca 0.26 -1.62 0.00 0.00 -1.72 0.00 0.00 55.73 52.64 1y4j s ARG 253 Cb -0.12 -0.80 0.00 0.00 -0.45 0.00 0.00 34.95 33.57 1y4j s ARG 253 CO 0.17 0.02 0.00 0.41 -0.68 0.00 0.00 175.30 175.22 1y4j n GLY 254 N -0.39 2.82 0.82 -3.53 0.00 -1.23 -0.24 105.19 103.44 1y4j n GLY 254 Ca -0.07 -0.76 0.11 0.00 0.00 0.00 0.00 46.02 45.30 1y4j n GLY 254 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y4j n ALA 255 N 0.00 -2.13 -4.12 4.61 0.00 -1.26 -0.37 120.51 117.24 1y4j n ALA 255 Ca 0.00 0.33 -0.18 0.00 0.00 0.00 0.00 53.44 53.59 1y4j n ALA 255 Cb 0.00 -0.77 -0.05 0.00 0.00 0.00 0.00 19.45 18.62 1y4j n ALA 255 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1y4j n SER 256 N -3.17 -1.07 0.00 0.00 3.41 -1.26 -2.98 113.62 108.55 1y4j n SER 256 Ca -0.01 -3.01 0.03 0.00 -0.26 0.00 0.00 58.87 55.62 1y4j n SER 256 Cb 0.38 2.14 0.13 0.00 -0.26 0.00 0.00 64.21 66.60 1y4j n SER 256 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1y4j n TRP 257 N -0.60 0.00 1.04 7.33 4.27 0.20 -1.02 117.44 128.66 1y4j n TRP 257 Ca 0.04 0.00 0.11 0.00 -3.89 0.00 0.00 57.50 53.76 1y4j n TRP 257 Cb 0.59 -0.45 0.05 0.00 -1.36 0.00 0.00 31.31 30.15 1y4j n TRP 257 CO 0.00 0.00 0.00 0.44 -2.29 0.00 0.00 177.69 175.84 1y4j n ILE 258 N -1.45 0.00 -2.65 -1.67 -5.35 -1.26 -2.99 119.36 103.99 1y4j n ILE 258 Ca 0.02 -0.24 -0.22 0.00 -0.27 0.00 0.00 62.75 62.04 1y4j n ILE 258 Cb 0.06 1.12 0.03 0.00 -1.74 0.00 0.00 39.64 39.12 1y4j n ILE 258 CO 0.00 0.00 0.00 -1.81 -1.76 0.00 0.00 176.55 172.98 1y4j s ASP 259 N -2.49 5.35 -0.02 7.28 1.01 -0.19 -4.61 116.67 123.01 1y4j s ASP 259 Ca 0.19 0.14 0.02 0.00 0.71 0.00 0.00 52.55 53.61 1y4j s ASP 259 Cb 0.18 -1.08 0.01 0.00 1.01 0.00 0.00 42.92 43.04 1y4j s ASP 259 CO 0.57 -1.10 -0.06 0.42 0.21 0.00 0.00 175.17 175.21 1y4j s THR 260 N -2.79 0.56 0.37 -1.27 -4.23 -0.79 -0.23 115.64 107.27 1y4j s THR 260 Ca 0.56 -0.23 0.05 0.00 -1.18 0.00 0.00 61.69 60.88 1y4j s THR 260 Cb -0.10 -0.53 0.27 0.00 1.34 0.00 0.00 72.50 73.48 1y4j s THR 260 CO 0.39 0.19 2.01 0.00 -0.54 0.00 0.00 174.62 176.68 1y4j h ALA 261 N 6.53 1.64 -0.14 3.99 0.00 -1.82 -0.60 119.26 128.86 1y4j h ALA 261 Ca -0.34 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.54 1y4j h ALA 261 Cb 1.17 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1y4j h ALA 261 CO 0.49 0.31 0.00 -0.40 0.00 0.00 0.00 179.25 179.65 1y4j n ASP 262 N -4.46 1.91 0.00 0.00 5.75 -1.26 -4.43 116.55 114.06 1y4j n ASP 262 Ca 0.06 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.14 1y4j n ASP 262 Cb 0.09 -0.08 0.00 0.00 -1.03 0.00 0.00 41.12 40.10 1y4j n ASP 262 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1y4j n GLY 263 N 1.20 0.28 0.25 6.12 0.00 -0.95 -4.87 105.19 107.22 1y4j n GLY 263 Ca 0.17 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.32 1y4j n GLY 263 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1y4j h SER 264 N 0.00 0.00 -4.24 1.61 4.64 -1.91 -3.43 113.55 110.22 1y4j h SER 264 Ca 0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 1y4j h SER 264 Cb 0.44 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 62.28 1y4j h SER 264 CO 0.00 0.13 -0.68 0.00 -0.87 0.00 0.00 176.83 175.40 1y4j s ALA 265 N -3.75 -0.01 0.00 5.18 0.00 -1.26 -4.99 121.76 116.94 1y4j s ALA 265 Ca 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 51.96 51.78 1y4j s ALA 265 Cb 0.10 0.04 0.00 0.00 0.00 0.00 0.00 23.12 23.26 1y4j s ALA 265 CO 0.59 -0.07 0.00 0.09 0.00 0.00 0.00 175.76 176.37 1y4j n ASN 266 N 2.46 0.00 -4.81 0.00 3.02 -1.26 -3.48 115.26 111.19 1y4j n ASN 266 Ca -0.17 0.00 -0.37 0.00 -0.03 0.00 0.00 54.58 54.01 1y4j n ASN 266 Cb 0.58 0.00 -0.06 0.00 -0.61 0.00 0.00 39.78 39.69 1y4j n ASN 266 CO 0.00 0.00 0.00 -1.00 -2.62 0.00 0.00 177.26 173.64 1y4j s HIS 267 N 0.00 3.71 -0.18 3.10 3.76 -1.26 -4.92 115.29 119.49 1y4j s HIS 267 Ca 0.00 1.39 -0.29 0.00 -0.15 0.00 0.00 55.06 56.01 1y4j s HIS 267 Cb 0.00 -2.61 -0.02 0.00 1.11 0.00 0.00 32.58 31.06 1y4j s HIS 267 CO 0.00 0.40 1.40 0.50 -0.85 0.00 0.00 174.74 176.19 1y4j s ARG 268 N -1.74 4.08 -0.29 1.40 3.52 -1.26 -1.89 118.95 122.78 1y4j s ARG 268 Ca 0.40 1.67 -0.17 0.00 -0.13 0.00 0.00 55.73 57.50 1y4j s ARG 268 Cb -0.18 -3.87 -0.02 0.00 -1.56 0.00 0.00 34.95 29.31 1y4j s ARG 268 CO 0.21 -0.92 0.45 0.00 -0.81 0.00 0.00 175.30 174.24 1y4j s ALA 269 N 4.06 3.55 0.32 6.12 0.00 -0.28 -4.75 121.76 130.79 1y4j s ALA 269 Ca 0.61 -0.82 -0.12 0.00 0.00 0.00 0.00 51.96 51.63 1y4j s ALA 269 Cb -0.23 -2.85 0.05 0.00 0.00 0.00 0.00 23.12 20.09 1y4j s ALA 269 CO 0.21 -0.84 0.64 2.89 0.00 0.00 0.00 175.76 178.67 1y4j n ARG 270 N 5.50 0.92 0.29 0.00 1.85 -1.26 -4.55 116.66 119.41 1y4j n ARG 270 Ca -0.06 -1.80 0.16 0.00 -1.00 0.00 0.00 57.85 55.14 1y4j n ARG 270 Cb 0.50 2.25 0.90 0.00 -1.05 0.00 0.00 32.46 35.06 1y4j n ARG 270 CO 0.00 0.00 0.00 -0.24 -0.01 0.00 0.00 177.63 177.38 1y4j h VAL 271 N 1.80 0.44 -0.00 8.89 3.04 -0.90 -2.57 116.25 126.95 1y4j h VAL 271 Ca -0.27 -0.19 0.00 0.00 -1.01 0.00 0.00 66.70 65.23 1y4j h VAL 271 Cb 1.00 1.13 0.00 0.00 -2.01 0.00 0.00 31.29 31.41 1y4j h VAL 271 CO 0.34 0.04 -0.65 0.35 -1.01 0.00 0.00 177.57 176.64 1y4j n THR 272 N -3.63 0.00 -1.69 3.17 -2.24 -1.26 -4.88 114.28 103.75 1y4j n THR 272 Ca -0.02 -0.05 -0.44 0.00 -2.27 0.00 0.00 64.05 61.27 1y4j n THR 272 Cb 0.14 0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 69.00 1y4j n THR 272 CO 0.00 0.00 0.00 0.41 -0.57 0.00 0.00 175.07 174.91 1y4j n THR 273 N -1.21 0.44 -3.79 4.28 -1.04 -0.97 -4.75 114.28 107.24 1y4j n THR 273 Ca 0.06 -0.11 -0.11 0.00 -2.04 0.00 0.00 64.05 61.85 1y4j n THR 273 Cb 0.35 -1.70 -0.08 0.00 -1.82 0.00 0.00 70.33 67.09 1y4j n THR 273 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1y4j s ARG 274 N 0.36 0.77 0.29 -2.82 1.70 -1.26 -3.52 118.95 114.46 1y4j s ARG 274 Ca 0.72 -0.58 -0.11 0.00 -0.47 0.00 0.00 55.73 55.29 1y4j s ARG 274 Cb -0.60 0.33 0.01 0.00 -0.57 0.00 0.00 34.95 34.11 1y4j s ARG 274 CO 0.42 -0.24 0.54 0.00 -1.08 0.00 0.00 175.30 174.94 1y4j s MET 275 N -2.64 1.75 0.16 3.89 0.23 -0.87 -4.83 119.30 116.99 1y4j s MET 275 Ca -0.04 -1.38 0.09 0.00 -1.03 0.00 0.00 55.69 53.32 1y4j s MET 275 Cb -0.01 0.50 -0.04 0.00 -1.53 0.00 0.00 34.83 33.75 1y4j s MET 275 CO -0.04 -0.75 -0.11 0.20 -2.03 0.00 0.00 175.02 172.29 1y4j s GLY 276 N -3.07 1.73 -0.02 3.16 0.00 -1.26 -0.21 107.32 107.65 1y4j s GLY 276 Ca 0.22 -1.42 -0.15 0.00 0.00 0.00 0.00 44.72 43.37 1y4j s GLY 276 CO 0.12 -1.43 0.32 0.21 0.00 0.00 0.00 173.10 172.32 1y4j s ASN 277 N -2.64 -0.21 0.44 1.64 2.47 -0.35 -4.91 114.94 111.38 1y4j s ASN 277 Ca 0.23 0.14 -0.25 0.00 0.42 0.00 0.00 52.86 53.41 1y4j s ASN 277 Cb -0.09 0.35 -0.08 0.00 -1.45 0.00 0.00 41.25 39.97 1y4j s ASN 277 CO 0.14 -0.43 1.29 0.42 -3.72 0.00 0.00 177.10 174.81 1y4j s THR 278 N -1.22 2.58 0.07 -5.21 -4.23 -1.26 -0.45 115.64 105.91 1y4j s THR 278 Ca -0.13 0.49 0.33 0.00 -1.18 0.00 0.00 61.69 61.20 1y4j s THR 278 Cb -0.05 -3.27 0.38 0.00 1.34 0.00 0.00 72.50 70.90 1y4j s THR 278 CO 0.04 0.04 1.98 1.55 -0.54 0.00 0.00 174.62 177.69 1y4j h PRO 279 N 2.32 0.00 -0.21 3.99 0.13 -1.94 -2.02 132.00 134.26 1y4j h PRO 279 Ca -0.50 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1y4j h PRO 279 Cb 1.26 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.39 1y4j h PRO 279 CO 0.61 0.00 0.00 -0.40 -0.23 0.00 0.00 178.00 177.98 1y4j n ASP 280 N -2.97 2.31 -4.74 1.44 5.68 -1.26 -0.99 116.55 116.02 1y4j n ASP 280 Ca 0.00 -1.80 -0.33 0.00 -0.50 0.00 0.00 54.79 52.16 1y4j n ASP 280 Cb 0.28 -0.13 0.08 0.00 -1.14 0.00 0.00 41.12 40.21 1y4j n ASP 280 CO 0.00 0.00 0.00 -0.44 -1.33 0.00 0.00 177.20 175.43 1y4j s SER 281 N -1.62 4.45 -0.11 -1.12 0.01 -0.76 -4.82 113.70 109.72 1y4j s SER 281 Ca 0.34 2.12 -0.30 0.00 1.31 0.00 0.00 55.95 59.43 1y4j s SER 281 Cb 0.20 -2.56 0.09 0.00 0.21 0.00 0.00 66.02 63.95 1y4j s SER 281 CO 0.29 -2.08 0.79 0.00 0.41 0.00 0.00 173.24 172.65 1y4j s ALA 282 N -2.33 -1.83 0.24 1.44 0.00 -1.26 -3.80 121.76 114.23 1y4j s ALA 282 Ca 0.69 1.49 -0.21 0.00 0.00 0.00 0.00 51.96 53.92 1y4j s ALA 282 Cb -0.23 -0.38 0.05 0.00 0.00 0.00 0.00 23.12 22.56 1y4j s ALA 282 CO 0.47 -0.34 0.89 -1.54 0.00 0.00 0.00 175.76 175.23 1y4j s SER 283 N -0.96 -0.12 -0.10 0.00 1.04 -1.26 -3.48 113.70 108.82 1y4j s SER 283 Ca -0.07 -0.68 0.06 0.00 0.48 0.00 0.00 55.95 55.74 1y4j s SER 283 Cb -0.01 0.63 0.34 0.00 0.10 0.00 0.00 66.02 67.08 1y4j s SER 283 CO 0.06 -1.20 1.02 -0.90 0.98 0.00 0.00 173.24 173.20 1y4j n ASP 284 N -0.84 2.98 -1.04 7.02 5.68 -0.97 -1.36 116.55 128.01 1y4j n ASP 284 Ca -0.05 -2.39 0.04 0.00 -0.50 0.00 0.00 54.79 51.89 1y4j n ASP 284 Cb 0.60 -0.58 0.07 0.00 -1.14 0.00 0.00 41.12 40.07 1y4j n ASP 284 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1y4j n ASN 285 N 0.26 1.09 -3.73 -1.12 6.94 -1.26 -4.82 115.26 112.61 1y4j n ASN 285 Ca 0.12 -2.50 -0.17 0.00 -0.02 0.00 0.00 54.58 52.00 1y4j n ASN 285 Cb 0.65 -0.34 -0.17 0.00 -2.36 0.00 0.00 39.78 37.55 1y4j n ASN 285 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1y4j s LEU 286 N -0.92 0.69 0.00 -4.53 2.96 -1.24 -1.24 118.68 114.40 1y4j s LEU 286 Ca 0.29 0.05 0.00 0.00 -0.22 0.00 0.00 54.13 54.25 1y4j s LEU 286 Cb 0.32 -0.13 0.00 0.00 0.50 0.00 0.00 46.19 46.88 1y4j s LEU 286 CO -0.11 -0.18 0.00 0.61 -1.32 0.00 0.00 176.35 175.35 1y4j n GLY 287 N 4.66 5.45 3.59 7.98 0.00 0.82 -3.95 105.19 123.74 1y4j n GLY 287 Ca -0.17 -1.03 -0.06 0.00 0.00 0.00 0.00 46.02 44.76 1y4j n GLY 287 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1y4j s PHE 288 N 1.24 -0.24 0.15 1.61 -0.71 -1.26 -1.68 117.98 117.10 1y4j s PHE 288 Ca 0.00 0.07 0.04 0.00 -1.04 0.00 0.00 56.93 56.00 1y4j s PHE 288 Cb 0.00 0.56 -0.04 0.00 -1.21 0.00 0.00 43.02 42.33 1y4j s PHE 288 CO 0.00 -0.56 -0.08 -0.98 -1.34 0.00 0.00 175.22 172.26 1y4j s ARG 289 N -3.03 1.05 0.38 1.99 1.70 -1.26 -0.85 118.95 118.93 1y4j s ARG 289 Ca 0.08 -1.46 0.07 0.00 -0.47 0.00 0.00 55.73 53.95 1y4j s ARG 289 Cb -0.01 -0.55 0.00 0.00 -0.57 0.00 0.00 34.95 33.83 1y4j s ARG 289 CO -0.05 0.04 0.53 0.00 -1.08 0.00 0.00 175.30 174.74 1y4j n ALA 291 N -1.76 0.31 -3.58 0.00 0.00 0.18 -1.38 120.51 114.27 1y4j n ALA 291 Ca 0.04 -1.81 -0.15 0.00 0.00 0.00 0.00 53.44 51.51 1y4j n ALA 291 Cb 0.58 1.47 -0.06 0.00 0.00 0.00 0.00 19.45 21.44 1y4j n ALA 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y4j s ALA 292 N -3.13 -1.81 0.51 0.00 0.00 -0.22 -0.56 121.76 116.56 1y4j s ALA 292 Ca 0.36 1.69 -0.21 0.00 0.00 0.00 0.00 51.96 53.80 1y4j s ALA 292 Cb 0.01 -0.69 -0.09 0.00 0.00 0.00 0.00 23.12 22.35 1y4j s ALA 292 CO 0.25 -0.34 0.79 -0.25 0.00 0.00 0.00 175.76 176.22 1y4j n ASP 293 N 1.76 0.17 0.00 0.00 9.92 -1.26 0.07 116.55 127.21 1y4j n ASP 293 Ca -0.16 0.87 0.00 0.00 -0.53 0.00 0.00 54.79 54.98 1y4j n ASP 293 Cb 0.56 -1.28 0.00 0.00 -0.64 0.00 0.00 41.12 39.77 1y4j n ASP 293 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33