#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1y3n s GLU 2 N 0.00 1.14 0.46 -0.14 0.41 -1.26 -5.01 118.70 114.30 1y3n s GLU 2 Ca 0.00 -1.05 0.31 0.00 -0.41 0.00 0.00 54.97 53.83 1y3n s GLU 2 Cb 0.00 -1.32 1.57 0.00 -1.78 0.00 0.00 34.13 32.60 1y3n s GLU 2 CO 0.00 0.32 1.95 0.00 -0.49 0.00 0.00 175.26 177.04 1y3n h ALA 3 N 4.38 1.00 -0.01 5.21 0.00 -2.00 -0.80 119.26 127.04 1y3n h ALA 3 Ca -0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.47 1y3n h ALA 3 Cb 1.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1y3n h ALA 3 CO 0.41 0.00 -0.16 0.25 0.00 0.00 0.00 179.25 179.75 1y3n n THR 4 N -2.67 0.00 -1.74 0.00 -2.24 -1.26 -4.93 114.28 101.44 1y3n n THR 4 Ca -0.01 -0.18 -0.42 0.00 -2.27 0.00 0.00 64.05 61.18 1y3n n THR 4 Cb 0.13 0.45 -0.02 0.00 -2.10 0.00 0.00 70.33 68.80 1y3n n THR 4 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1y3n n TRP 5 N -0.33 2.88 0.97 4.78 7.02 -0.31 -4.33 117.44 128.13 1y3n n TRP 5 Ca 0.15 0.20 0.11 0.00 -1.02 0.00 0.00 57.50 56.94 1y3n n TRP 5 Cb 0.35 -2.62 0.08 0.00 -2.42 0.00 0.00 31.31 26.70 1y3n n TRP 5 CO 0.00 0.00 0.00 1.33 -2.02 0.00 0.00 177.69 177.00 1y3n n VAL 6 N 2.53 0.00 -3.63 -0.99 0.24 -0.59 -4.91 118.33 110.97 1y3n n VAL 6 Ca 0.10 -0.45 -0.13 0.00 -2.04 0.00 0.00 64.34 61.82 1y3n n VAL 6 Cb 0.37 1.44 -0.07 0.00 -1.47 0.00 0.00 33.84 34.10 1y3n n VAL 6 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1y3n s THR 7 N -2.05 -0.00 0.07 3.34 -1.32 -1.26 -4.85 115.64 109.58 1y3n s THR 7 Ca 0.25 0.00 -0.16 0.00 -1.21 0.00 0.00 61.69 60.57 1y3n s THR 7 Cb 0.19 -1.00 -0.13 0.00 -1.51 0.00 0.00 72.50 70.05 1y3n s THR 7 CO 0.35 0.00 1.33 -0.08 -2.21 0.00 0.00 174.62 174.00 1y3n h GLU 8 N 5.21 0.63 -5.97 7.08 4.57 -1.94 -3.43 114.58 120.73 1y3n h GLU 8 Ca -0.29 -0.42 -0.57 0.00 -1.18 0.00 0.00 59.36 56.90 1y3n h GLU 8 Cb 1.17 0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 29.75 1y3n h GLU 8 CO 0.06 1.04 0.13 0.21 -1.18 0.00 0.00 179.01 179.27 1y3n s LYS 9 N -4.00 4.39 0.23 1.92 2.20 -1.26 -5.01 119.74 118.20 1y3n s LYS 9 Ca -0.12 0.85 -0.32 0.00 -0.36 0.00 0.00 55.97 56.03 1y3n s LYS 9 Cb 0.07 -3.48 -0.14 0.00 -1.51 0.00 0.00 37.83 32.77 1y3n s LYS 9 CO 0.83 -0.03 1.37 -2.30 -0.36 0.00 0.00 175.35 174.86 1y3n n PRO 10 N 4.14 1.88 -4.87 4.03 -0.02 -1.26 -4.99 135.00 133.91 1y3n n PRO 10 Ca -0.01 0.67 -0.27 0.00 -2.02 0.00 0.00 63.50 61.88 1y3n n PRO 10 Cb 0.51 -2.30 -0.16 0.00 -0.02 0.00 0.00 33.50 31.53 1y3n n PRO 10 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1y3n s LEU 11 N 0.21 1.92 -0.10 2.45 2.96 -0.72 -5.05 118.68 120.35 1y3n s LEU 11 Ca 0.69 -0.37 0.03 0.00 -0.22 0.00 0.00 54.13 54.26 1y3n s LEU 11 Cb -0.69 -1.01 -0.01 0.00 0.50 0.00 0.00 46.19 44.98 1y3n s LEU 11 CO 0.50 0.15 -0.20 -0.89 -1.32 0.00 0.00 176.35 174.59 1y3n s THR 12 N 0.08 2.43 0.13 3.68 2.01 -1.26 -0.19 115.64 122.52 1y3n s THR 12 Ca -0.05 -0.90 0.07 0.00 0.31 0.00 0.00 61.69 61.12 1y3n s THR 12 Cb -0.12 -1.95 -0.04 0.00 0.01 0.00 0.00 72.50 70.40 1y3n s THR 12 CO 0.03 0.55 -0.18 -0.76 -0.69 0.00 0.00 174.62 173.58 1y3n s LEU 13 N 0.15 2.38 -0.16 4.42 1.43 0.64 -4.95 118.68 122.59 1y3n s LEU 13 Ca -0.11 -0.78 -0.11 0.00 -1.03 0.00 0.00 54.13 52.10 1y3n s LEU 13 Cb -0.16 -0.74 -0.05 0.00 0.03 0.00 0.00 46.19 45.27 1y3n s LEU 13 CO 0.06 -0.04 0.19 -0.54 0.23 0.00 0.00 176.35 176.25 1y3n s LYS 14 N -2.43 4.02 -0.05 1.70 1.02 -1.26 -0.49 119.74 122.26 1y3n s LYS 14 Ca 0.10 -0.08 0.04 0.00 0.02 0.00 0.00 55.97 56.05 1y3n s LYS 14 Cb -0.07 -3.36 -0.00 0.00 -0.52 0.00 0.00 37.83 33.88 1y3n s LYS 14 CO 0.05 0.42 -0.18 -1.50 -0.92 0.00 0.00 175.35 173.21 1y3n s ILE 15 N -0.01 1.49 -0.37 2.17 2.07 0.02 -0.85 121.20 125.72 1y3n s ILE 15 Ca 0.13 -0.75 -0.10 0.00 -1.41 0.00 0.00 60.65 58.52 1y3n s ILE 15 Cb -0.12 -1.28 0.03 0.00 0.13 0.00 0.00 42.46 41.22 1y3n s ILE 15 CO 0.02 0.43 0.20 -2.28 -1.91 0.00 0.00 174.94 171.39 1y3n s HIS 16 N 0.06 3.25 -0.22 3.50 5.65 0.09 -1.61 115.29 126.01 1y3n s HIS 16 Ca -0.05 -1.06 -0.04 0.00 0.25 0.00 0.00 55.06 54.16 1y3n s HIS 16 Cb -0.12 -2.45 0.08 0.00 -1.18 0.00 0.00 32.58 28.91 1y3n s HIS 16 CO 0.03 -0.68 0.13 1.41 -0.65 0.00 0.00 174.74 174.98 1y3n s MET 17 N 1.53 0.13 -0.16 2.88 0.00 -1.26 -1.52 119.30 120.91 1y3n s MET 17 Ca 0.01 -0.18 0.02 0.00 0.00 0.00 0.00 55.69 55.54 1y3n s MET 17 Cb -0.19 -1.48 0.02 0.00 0.00 0.00 0.00 34.83 33.18 1y3n s MET 17 CO 0.06 -0.79 -0.20 -1.58 0.00 0.00 0.00 175.02 172.51 1y3n s HIS 18 N 2.17 2.62 0.07 4.11 2.46 -1.25 -1.97 115.29 123.50 1y3n s HIS 18 Ca 0.05 -1.44 0.02 0.00 0.47 0.00 0.00 55.06 54.16 1y3n s HIS 18 Cb -0.16 -1.81 -0.03 0.00 -0.13 0.00 0.00 32.58 30.44 1y3n s HIS 18 CO -0.19 -0.70 -0.07 -0.59 -2.47 0.00 0.00 174.74 170.71 1y3n s PHE 19 N 1.11 0.82 -1.13 3.88 -0.12 0.69 -4.60 117.98 118.63 1y3n s PHE 19 Ca -0.00 -0.72 -0.03 0.00 -0.05 0.00 0.00 56.93 56.13 1y3n s PHE 19 Cb -0.14 -0.48 0.02 0.00 -0.63 0.00 0.00 43.02 41.79 1y3n s PHE 19 CO -0.08 -0.11 0.18 0.54 -0.05 0.00 0.00 175.22 175.70 1y3n n ARG 20 N 0.63 -2.74 -1.21 1.99 1.74 -1.26 -1.50 116.66 114.30 1y3n n ARG 20 Ca -0.17 0.57 -0.10 0.00 -0.77 0.00 0.00 57.85 57.38 1y3n n ARG 20 Cb 0.58 -5.22 -0.04 0.00 -1.02 0.00 0.00 32.46 26.76 1y3n n ARG 20 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1y3n n ASP 21 N -1.98 -4.24 0.00 0.55 8.00 -1.26 -4.62 116.55 112.99 1y3n n ASP 21 Ca -0.10 0.25 0.00 0.00 0.71 0.00 0.00 54.79 55.65 1y3n n ASP 21 Cb 0.59 -3.40 0.00 0.00 -0.02 0.00 0.00 41.12 38.29 1y3n n ASP 21 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1y3n n LYS 22 N -1.06 2.98 -4.43 -1.24 5.02 -0.85 -4.37 118.16 114.20 1y3n n LYS 22 Ca -0.10 0.00 -0.22 0.00 -2.02 0.00 0.00 58.31 55.96 1y3n n LYS 22 Cb 0.46 -0.43 -0.10 0.00 -0.02 0.00 0.00 35.03 34.94 1y3n n LYS 22 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1y3n s TRP 23 N -0.43 2.11 0.11 2.13 0.51 -0.56 -4.99 118.94 117.82 1y3n s TRP 23 Ca 0.00 -0.40 0.02 0.00 -2.12 0.00 0.00 56.10 53.60 1y3n s TRP 23 Cb 0.00 -0.94 -0.04 0.00 -0.81 0.00 0.00 33.47 31.68 1y3n s TRP 23 CO 0.00 0.60 -0.07 0.14 -0.51 0.00 0.00 176.95 177.10 1y3n s VAL 24 N -2.61 0.79 0.32 4.03 -7.23 -1.26 -0.23 120.40 114.22 1y3n s VAL 24 Ca 0.27 -1.94 -0.29 0.00 -1.81 0.00 0.00 61.98 58.21 1y3n s VAL 24 Cb -0.04 -1.69 -0.11 0.00 0.56 0.00 0.00 36.38 35.10 1y3n s VAL 24 CO 0.12 -0.83 1.54 0.86 -0.31 0.00 0.00 175.10 176.48 1y3n s TRP 25 N -3.51 2.72 -0.24 2.82 -0.11 -0.83 -4.99 118.94 114.80 1y3n s TRP 25 Ca 0.12 0.94 0.01 0.00 1.22 0.00 0.00 56.10 58.39 1y3n s TRP 25 Cb 0.04 -4.03 0.06 0.00 -1.50 0.00 0.00 33.47 28.04 1y3n s TRP 25 CO -0.04 -3.30 -0.06 0.34 -4.62 0.00 0.00 176.95 169.27 1y3n s ASP 26 N 0.26 3.99 0.47 5.86 -1.08 -1.26 -4.50 116.67 120.40 1y3n s ASP 26 Ca 0.59 -1.23 0.32 0.00 -0.52 0.00 0.00 52.55 51.70 1y3n s ASP 26 Cb -0.47 -1.26 1.69 0.00 -1.46 0.00 0.00 42.92 41.42 1y3n s ASP 26 CO 0.53 -0.23 1.97 1.05 0.52 0.00 0.00 175.17 179.00 1y3n h GLU 27 N 7.91 0.00 -0.00 4.34 9.09 -1.95 0.01 114.58 133.99 1y3n h GLU 27 Ca -0.18 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.23 1y3n h GLU 27 Cb 1.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.16 1y3n h GLU 27 CO 0.42 0.00 -0.26 0.09 0.05 0.00 0.00 179.01 179.31 1y3n n ASN 28 N -2.62 0.29 -4.71 3.06 5.03 -1.26 -4.31 115.26 110.74 1y3n n ASN 28 Ca -0.02 0.04 -0.42 0.00 0.87 0.00 0.00 54.58 55.04 1y3n n ASN 28 Cb 0.07 -0.09 -0.01 0.00 -1.02 0.00 0.00 39.78 38.73 1y3n n ASN 28 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1y3n n TRP 29 N -1.45 2.47 -0.28 3.10 8.01 -0.01 -4.83 117.44 124.45 1y3n n TRP 29 Ca 0.07 0.48 0.00 0.00 -1.31 0.00 0.00 57.50 56.74 1y3n n TRP 29 Cb 0.33 -2.47 0.13 0.00 -2.01 0.00 0.00 31.31 27.29 1y3n n TRP 29 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.69 175.33 1y3n h PRO 30 N 3.17 0.83 -0.40 -0.99 0.11 -1.89 -0.45 132.00 132.38 1y3n h PRO 30 Ca -0.47 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.56 1y3n h PRO 30 Cb 1.27 -0.19 -0.02 0.00 0.11 0.00 0.00 31.00 32.17 1y3n h PRO 30 CO 0.67 0.55 0.12 0.28 -0.21 0.00 0.00 178.00 179.41 1y3n h VAL 31 N 0.86 1.22 -0.76 3.15 2.07 -1.72 -1.11 116.25 119.96 1y3n h VAL 31 Ca 0.35 -0.72 0.00 0.00 0.82 0.00 0.00 66.70 67.15 1y3n h VAL 31 Cb 0.20 0.92 -0.04 0.00 -1.52 0.00 0.00 31.29 30.85 1y3n h VAL 31 CO -0.18 0.25 0.49 0.00 0.02 0.00 0.00 177.57 178.15 1y3n h ALA 32 N 0.97 0.97 -0.58 1.67 0.00 -1.63 -0.72 119.26 119.94 1y3n h ALA 32 Ca 0.13 -0.07 -0.08 0.00 0.00 0.00 0.00 54.91 54.89 1y3n h ALA 32 Cb 0.27 -0.31 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 1y3n h ALA 32 CO -0.00 0.41 0.04 0.00 0.00 0.00 0.00 179.25 179.69 1y3n h ARG 33 N 1.04 0.97 -0.40 0.00 3.08 -0.86 -0.90 114.38 117.30 1y3n h ARG 33 Ca 0.28 -0.27 -0.13 0.00 0.07 0.00 0.00 59.98 59.92 1y3n h ARG 33 Cb -0.08 -0.11 -0.01 0.00 0.08 0.00 0.00 29.97 29.85 1y3n h ARG 33 CO -0.06 0.93 -0.27 1.49 -1.07 0.00 0.00 179.97 181.00 1y3n h GLU 34 N 0.90 0.89 -0.61 0.04 4.57 -0.76 -0.98 114.58 118.63 1y3n h GLU 34 Ca 0.17 -0.42 -0.09 0.00 -1.18 0.00 0.00 59.36 57.84 1y3n h GLU 34 Cb 0.47 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.03 1y3n h GLU 34 CO 0.02 1.07 0.03 0.28 -1.18 0.00 0.00 179.01 179.23 1y3n h VAL 35 N 0.70 1.26 -0.69 0.32 2.07 -0.99 -1.53 116.25 117.39 1y3n h VAL 35 Ca 0.08 -1.09 -0.04 0.00 0.82 0.00 0.00 66.70 66.47 1y3n h VAL 35 Cb 0.85 0.76 -0.03 0.00 -1.52 0.00 0.00 31.29 31.34 1y3n h VAL 35 CO 0.07 0.40 0.29 0.00 0.02 0.00 0.00 177.57 178.36 1y3n h ALA 36 N 1.07 0.90 -0.31 1.67 0.00 -0.99 0.49 119.26 122.09 1y3n h ALA 36 Ca 0.18 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1y3n h ALA 36 Cb 0.50 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 18.01 1y3n h ALA 36 CO 0.02 0.50 0.18 -0.09 0.00 0.00 0.00 179.25 179.86 1y3n h ARG 37 N 0.98 0.42 -0.02 0.00 2.43 -0.84 0.22 114.38 117.56 1y3n h ARG 37 Ca 0.23 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.22 1y3n h ARG 37 Cb 0.18 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 29.63 1y3n h ARG 37 CO -0.02 0.33 -0.64 -0.07 -1.51 0.00 0.00 179.97 178.06 1y3n h LEU 38 N 0.39 0.11 0.00 3.80 3.38 -0.98 -3.34 115.31 118.67 1y3n h LEU 38 Ca 0.11 -0.07 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1y3n h LEU 38 Cb 0.02 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.74 1y3n h LEU 38 CO -0.02 0.72 -1.68 0.35 0.09 0.00 0.00 178.44 177.90 1y3n n THR 39 N -3.81 0.00 -1.08 0.22 -2.24 0.14 -2.50 114.28 105.01 1y3n n THR 39 Ca -0.02 -0.37 -0.03 0.00 -2.27 0.00 0.00 64.05 61.37 1y3n n THR 39 Cb 0.64 0.23 -0.01 0.00 -2.10 0.00 0.00 70.33 69.08 1y3n n THR 39 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1y3n n ASN 40 N -2.03 -3.56 -4.09 3.42 4.05 0.76 -1.54 115.26 112.27 1y3n n ASN 40 Ca -0.02 0.07 -0.31 0.00 0.45 0.00 0.00 54.58 54.76 1y3n n ASN 40 Cb 0.45 -1.30 -0.16 0.00 1.23 0.00 0.00 39.78 40.00 1y3n n ASN 40 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1y3n s VAL 41 N -2.02 1.82 -0.14 3.44 1.01 -1.23 -1.76 120.40 121.52 1y3n s VAL 41 Ca 0.00 -0.81 -0.03 0.00 0.00 0.00 0.00 61.98 61.14 1y3n s VAL 41 Cb 0.00 -1.65 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 1y3n s VAL 41 CO 0.00 0.50 -0.02 -0.75 0.00 0.00 0.00 175.10 174.83 1y3n s LYS 42 N 1.15 3.50 -0.19 2.72 2.20 0.74 -4.13 119.74 125.73 1y3n s LYS 42 Ca -0.01 -0.49 -0.06 0.00 -0.36 0.00 0.00 55.97 55.06 1y3n s LYS 42 Cb -0.14 -2.89 -0.03 0.00 -1.51 0.00 0.00 37.83 33.25 1y3n s LYS 42 CO -0.07 0.37 0.03 -0.51 -0.36 0.00 0.00 175.35 174.80 1y3n s LEU 43 N 0.03 3.54 -0.16 5.43 1.43 -1.26 -0.26 118.68 127.44 1y3n s LEU 43 Ca 0.01 -0.05 -0.03 0.00 -1.03 0.00 0.00 54.13 53.03 1y3n s LEU 43 Cb -0.13 -1.89 -0.02 0.00 0.03 0.00 0.00 46.19 44.17 1y3n s LEU 43 CO 0.02 0.13 -0.06 -0.69 0.23 0.00 0.00 176.35 175.98 1y3n s VAL 44 N 0.61 3.60 0.26 -1.59 1.01 0.36 -4.42 120.40 120.24 1y3n s VAL 44 Ca 0.01 -0.46 -0.28 0.00 0.00 0.00 0.00 61.98 61.25 1y3n s VAL 44 Cb -0.14 -2.57 -0.09 0.00 0.00 0.00 0.00 36.38 33.58 1y3n s VAL 44 CO 0.02 0.49 0.92 -0.83 0.00 0.00 0.00 175.10 175.70 1y3n s GLY 45 N 0.49 2.99 0.00 4.51 0.00 -1.26 -0.80 107.32 113.25 1y3n s GLY 45 Ca -0.05 0.56 0.00 0.00 0.00 0.00 0.00 44.72 45.23 1y3n s GLY 45 CO 0.03 1.07 0.76 3.33 0.00 0.00 0.00 173.10 178.30 1y3n n VAL 46 N 1.17 0.58 -2.42 1.40 0.24 -0.63 -4.90 118.33 113.76 1y3n n VAL 46 Ca -0.01 -0.70 -0.34 0.00 -2.04 0.00 0.00 64.34 61.26 1y3n n VAL 46 Cb 0.48 0.77 -0.02 0.00 -1.47 0.00 0.00 33.84 33.60 1y3n n VAL 46 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1y3n s ALA 47 N -0.58 2.83 -0.39 2.33 0.00 -1.26 -4.98 121.76 119.72 1y3n s ALA 47 Ca 0.00 0.59 -0.29 0.00 0.00 0.00 0.00 51.96 52.26 1y3n s ALA 47 Cb 0.00 -3.26 0.01 0.00 0.00 0.00 0.00 23.12 19.87 1y3n s ALA 47 CO 0.00 -0.45 1.38 1.21 0.00 0.00 0.00 175.76 177.90 1y3n s ASN 48 N -2.11 6.42 0.47 0.00 3.04 -1.26 -4.89 114.94 116.62 1y3n s ASN 48 Ca 0.67 0.91 0.31 0.00 0.04 0.00 0.00 52.86 54.79 1y3n s ASN 48 Cb -0.17 -2.54 1.29 0.00 -1.54 0.00 0.00 41.25 38.29 1y3n s ASN 48 CO 0.24 -1.35 1.92 0.03 -3.04 0.00 0.00 177.10 174.90 1y3n h ARG 49 N 10.34 0.00 -2.31 0.43 3.08 -1.98 -3.27 114.38 120.66 1y3n h ARG 49 Ca -0.27 0.00 -0.81 0.00 0.07 0.00 0.00 59.98 58.97 1y3n h ARG 49 Cb 1.10 0.00 -0.27 0.00 0.08 0.00 0.00 29.97 30.88 1y3n h ARG 49 CO 1.08 0.00 1.03 0.00 -1.07 0.00 0.00 179.97 181.01 1y3n n ALA 50 N -2.00 6.01 -3.22 0.04 0.00 -1.26 -4.92 120.51 115.16 1y3n n ALA 50 Ca 0.01 -4.62 -0.13 0.00 0.00 0.00 0.00 53.44 48.70 1y3n n ALA 50 Cb 0.28 -2.21 -0.12 0.00 0.00 0.00 0.00 19.45 17.40 1y3n n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1y3n s ALA 51 N -4.17 -0.61 -1.03 0.00 0.00 -1.24 -5.07 121.76 109.65 1y3n s ALA 51 Ca 0.38 0.75 0.15 0.00 0.00 0.00 0.00 51.96 53.24 1y3n s ALA 51 Cb 0.18 -0.44 0.45 0.00 0.00 0.00 0.00 23.12 23.31 1y3n s ALA 51 CO -0.11 -0.13 1.38 0.25 0.00 0.00 0.00 175.76 177.15 1y3n n THR 52 N 3.13 1.29 -3.61 0.00 -2.24 -1.26 -4.63 114.28 106.96 1y3n n THR 52 Ca -0.15 -1.15 -0.27 0.00 -2.27 0.00 0.00 64.05 60.22 1y3n n THR 52 Cb 0.58 0.35 -0.17 0.00 -2.10 0.00 0.00 70.33 68.98 1y3n n THR 52 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1y3n s ASN 53 N -1.12 2.55 0.30 3.42 3.84 -1.26 -4.68 114.94 117.99 1y3n s ASN 53 Ca 0.34 -0.72 -0.01 0.00 0.21 0.00 0.00 52.86 52.67 1y3n s ASN 53 Cb 0.20 -0.27 0.45 0.00 -0.55 0.00 0.00 41.25 41.07 1y3n s ASN 53 CO 0.19 -0.36 1.91 0.28 -2.79 0.00 0.00 177.10 176.33 1y3n h SER 54 N 8.41 0.85 -0.47 -4.21 0.02 -1.87 -2.20 113.55 114.07 1y3n h SER 54 Ca -0.16 -0.07 -0.13 0.00 -0.84 0.00 0.00 61.79 60.59 1y3n h SER 54 Cb 1.13 -0.22 -0.01 0.00 0.14 0.00 0.00 62.40 63.44 1y3n h SER 54 CO 0.32 0.70 -0.20 1.56 -1.14 0.00 0.00 176.83 178.07 1y3n h GLN 55 N 0.96 0.99 -0.67 3.45 1.08 -1.92 -1.92 115.11 117.07 1y3n h GLN 55 Ca 0.24 -0.41 -0.02 0.00 -1.45 0.00 0.00 58.65 57.01 1y3n h GLN 55 Cb 0.05 -0.04 -0.03 0.00 -0.05 0.00 0.00 27.48 27.41 1y3n h GLN 55 CO -0.04 1.09 0.33 1.49 -0.95 0.00 0.00 178.83 180.75 1y3n h GLU 56 N 0.85 0.95 -0.54 1.46 4.57 -1.92 -2.06 114.58 117.90 1y3n h GLU 56 Ca 0.11 -0.12 -0.11 0.00 -1.18 0.00 0.00 59.36 58.06 1y3n h GLU 56 Cb 0.78 -0.18 -0.02 0.00 -0.16 0.00 0.00 28.75 29.17 1y3n h GLU 56 CO 0.06 0.73 -0.09 1.96 -1.18 0.00 0.00 179.01 180.50 1y3n h GLN 57 N 0.95 1.00 -0.22 1.92 1.08 -1.07 0.55 115.11 119.32 1y3n h GLN 57 Ca 0.23 -0.35 0.00 0.00 -1.45 0.00 0.00 58.65 57.08 1y3n h GLN 57 Cb 0.09 -0.07 -0.01 0.00 -0.05 0.00 0.00 27.48 27.44 1y3n h GLN 57 CO -0.03 1.03 0.14 0.35 -0.95 0.00 0.00 178.83 179.37 1y3n h PHE 58 N 0.89 0.26 -0.83 2.96 3.04 -0.87 0.15 116.94 122.55 1y3n h PHE 58 Ca 0.14 0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.10 1y3n h PHE 58 Cb 0.65 -0.09 -0.04 0.00 2.56 0.00 0.00 35.95 39.03 1y3n h PHE 58 CO 0.04 0.16 0.54 -0.91 -2.02 0.00 0.00 178.31 176.12 1y3n h ASN 59 N 0.29 0.97 -0.42 0.41 2.35 -1.11 -0.93 115.58 117.13 1y3n h ASN 59 Ca 0.08 -0.04 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1y3n h ASN 59 Cb -0.03 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.08 1y3n h ASN 59 CO -0.02 0.72 0.17 -0.07 -1.65 0.00 0.00 177.43 176.57 1y3n h LEU 60 N 1.13 0.57 -0.37 1.61 3.38 -0.43 -2.25 115.31 118.95 1y3n h LEU 60 Ca 0.30 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.15 1y3n h LEU 60 Cb -0.11 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.45 1y3n h LEU 60 CO -0.06 0.58 0.12 -0.03 0.09 0.00 0.00 178.44 179.14 1y3n h MET 61 N 0.53 0.26 0.00 1.13 4.05 -0.23 -0.20 114.93 120.47 1y3n h MET 61 Ca 0.14 -0.02 -0.00 0.00 -0.28 0.00 0.00 59.70 59.54 1y3n h MET 61 Cb 0.18 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 30.92 1y3n h MET 61 CO -0.01 0.17 -0.01 1.98 0.23 0.00 0.00 176.91 179.28 1y3n h MET 62 N 0.27 0.00 -0.29 0.39 1.85 -0.86 -1.71 114.93 114.59 1y3n h MET 62 Ca 0.17 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.26 1y3n h MET 62 Cb 0.15 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.18 1y3n h MET 62 CO -0.18 0.01 0.00 0.00 -0.40 0.00 0.00 176.91 176.34 1y3n n ALA 63 N -2.11 2.19 -0.71 0.39 0.00 -0.49 -4.53 120.51 115.24 1y3n n ALA 63 Ca -0.02 -1.08 0.09 0.00 0.00 0.00 0.00 53.44 52.42 1y3n n ALA 63 Cb 0.11 -0.39 0.36 0.00 0.00 0.00 0.00 19.45 19.53 1y3n n ALA 63 CO 0.00 0.00 0.00 0.43 0.00 0.00 0.00 177.50 177.93 1y3n n SER 64 N 0.43 4.91 0.00 0.00 7.64 -0.21 -5.05 113.62 121.34 1y3n n SER 64 Ca 0.10 -2.60 0.00 0.00 1.01 0.00 0.00 58.87 57.38 1y3n n SER 64 Cb 0.40 -0.59 0.00 0.00 -1.01 0.00 0.00 64.21 63.00 1y3n n SER 64 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1y3n n GLY 65 N 0.87 -0.49 3.66 0.23 0.00 -1.26 -5.00 105.19 103.21 1y3n n GLY 65 Ca 0.26 -2.02 -0.48 0.00 0.00 0.00 0.00 46.02 43.78 1y3n n GLY 65 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1y3n n GLN 66 N 0.00 1.99 -1.34 1.61 7.27 -1.26 -4.86 117.38 120.79 1y3n n GLN 66 Ca 0.00 0.72 -0.31 0.00 0.07 0.00 0.00 57.00 57.48 1y3n n GLN 66 Cb 0.00 -2.49 0.09 0.00 2.41 0.00 0.00 30.24 30.25 1y3n n GLN 66 CO 0.00 0.00 0.00 -0.51 0.07 0.00 0.00 177.06 176.62 1y3n s LEU 67 N 1.60 3.10 0.00 1.69 1.43 -1.26 -5.06 118.68 120.18 1y3n s LEU 67 Ca 0.83 1.88 0.00 0.00 -1.03 0.00 0.00 54.13 55.81 1y3n s LEU 67 Cb -0.73 -4.53 0.00 0.00 0.03 0.00 0.00 46.19 40.96 1y3n s LEU 67 CO 0.43 -2.00 0.00 -0.81 0.23 0.00 0.00 176.35 174.20 1y3n n PRO 68 N -3.32 0.42 0.03 1.29 -0.04 -1.26 -4.87 135.00 127.25 1y3n n PRO 68 Ca 0.09 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.43 1y3n n PRO 68 Cb 0.53 0.00 -0.14 0.00 -0.04 0.00 0.00 33.50 33.85 1y3n n PRO 68 CO 0.00 0.00 0.00 -0.44 -0.04 0.00 0.00 175.50 175.02 1y3n h ASP 69 N -0.15 0.18 -4.52 3.54 5.19 -1.36 -3.42 116.42 115.88 1y3n h ASP 69 Ca 0.00 -0.27 -0.22 0.00 -0.62 0.00 0.00 57.03 55.91 1y3n h ASP 69 Cb 0.00 -0.06 -0.24 0.00 0.18 0.00 0.00 39.33 39.22 1y3n h ASP 69 CO 0.00 1.23 -0.72 -0.63 -3.12 0.00 0.00 179.24 176.00 1y3n s ILE 70 N -2.63 0.22 -0.06 0.35 1.01 -0.70 -2.19 121.20 117.21 1y3n s ILE 70 Ca -0.06 -0.66 0.02 0.00 0.00 0.00 0.00 60.65 59.95 1y3n s ILE 70 Cb 0.08 -0.29 0.02 0.00 0.01 0.00 0.00 42.46 42.27 1y3n s ILE 70 CO 0.83 -0.29 -0.10 -0.69 0.00 0.00 0.00 174.94 174.69 1y3n s VAL 71 N -0.95 0.96 0.14 2.92 1.01 -0.98 -0.73 120.40 122.77 1y3n s VAL 71 Ca -0.09 -0.37 0.00 0.00 0.00 0.00 0.00 61.98 61.52 1y3n s VAL 71 Cb -0.07 -0.90 -0.04 0.00 0.00 0.00 0.00 36.38 35.37 1y3n s VAL 71 CO -0.00 0.32 0.03 -0.83 0.00 0.00 0.00 175.10 174.62 1y3n s GLY 72 N 0.77 1.06 0.00 4.51 0.00 -0.57 -0.88 107.32 112.21 1y3n s GLY 72 Ca -0.13 -1.51 0.00 0.00 0.00 0.00 0.00 44.72 43.08 1y3n s GLY 72 CO 0.02 -1.43 0.00 0.61 0.00 0.00 0.00 173.10 172.30 1y3n n GLY 73 N -0.15 2.15 3.86 0.20 0.00 -0.30 -3.90 105.19 107.06 1y3n n GLY 73 Ca -0.06 -1.42 -0.32 0.00 0.00 0.00 0.00 46.02 44.22 1y3n n GLY 73 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1y3n s ASP 74 N 0.00 6.70 -1.43 1.61 -4.77 -1.26 -1.68 116.67 115.84 1y3n s ASP 74 Ca 0.00 1.14 -0.10 0.00 -3.30 0.00 0.00 52.55 50.30 1y3n s ASP 74 Cb 0.00 -2.32 0.04 0.00 -1.09 0.00 0.00 42.92 39.56 1y3n s ASP 74 CO 0.00 -0.18 1.04 0.59 0.70 0.00 0.00 175.17 177.32 1y3n n ASN 75 N -0.39 -4.95 -0.27 2.11 3.02 -0.93 -4.90 115.26 108.95 1y3n n ASN 75 Ca 0.02 -0.68 0.04 0.00 -0.03 0.00 0.00 54.58 53.93 1y3n n ASN 75 Cb 0.53 -4.43 0.02 0.00 -0.61 0.00 0.00 39.78 35.29 1y3n n ASN 75 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1y3n n LEU 76 N -4.75 1.50 -0.20 3.41 4.77 -0.42 -4.75 117.00 116.56 1y3n n LEU 76 Ca -0.02 -0.95 -0.05 0.00 -0.03 0.00 0.00 56.01 54.96 1y3n n LEU 76 Cb 0.56 0.00 0.01 0.00 -2.33 0.00 0.00 43.42 41.66 1y3n n LEU 76 CO 0.70 0.30 0.63 0.50 -1.33 0.00 0.00 177.39 178.20 1y3n h LYS 77 N 1.34 -0.15 -0.19 3.23 3.64 -1.75 0.24 116.57 122.93 1y3n h LYS 77 Ca 0.00 0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.35 1y3n h LYS 77 Cb 0.30 0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 32.14 1y3n h LYS 77 CO 0.00 -0.10 -0.06 -0.44 -2.27 0.00 0.00 179.45 176.58 1y3n h ASP 78 N -0.15 0.26 0.23 4.20 3.45 -1.87 -1.25 116.42 121.28 1y3n h ASP 78 Ca 0.24 -0.04 -0.21 0.00 0.43 0.00 0.00 57.03 57.44 1y3n h ASP 78 Cb 0.55 -0.07 0.00 0.00 -0.56 0.00 0.00 39.33 39.25 1y3n h ASP 78 CO -0.68 0.36 -0.85 0.11 -1.57 0.00 0.00 179.24 176.60 1y3n h LYS 79 N 0.27 0.47 -0.54 3.56 1.57 -1.41 -0.33 116.57 120.16 1y3n h LYS 79 Ca 0.06 -0.45 -0.03 0.00 -1.87 0.00 0.00 60.65 58.36 1y3n h LYS 79 Cb 0.28 0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1y3n h LYS 79 CO 0.01 1.09 0.21 0.74 -0.57 0.00 0.00 179.45 180.93 1y3n h PHE 80 N 0.29 0.83 -0.06 -1.35 0.05 -0.06 -0.63 116.94 116.01 1y3n h PHE 80 Ca -0.06 -0.06 -0.03 0.00 3.82 0.00 0.00 57.97 61.63 1y3n h PHE 80 Cb 1.47 -0.25 -0.00 0.00 2.00 0.00 0.00 35.95 39.17 1y3n h PHE 80 CO 0.06 0.68 -0.08 0.82 -0.18 0.00 0.00 178.31 179.62 1y3n h ILE 81 N 0.74 1.39 0.29 -0.55 2.04 -1.23 0.48 117.51 120.67 1y3n h ILE 81 Ca 0.18 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 64.75 1y3n h ILE 81 Cb 0.21 2.13 -0.02 0.00 -0.74 0.00 0.00 36.82 38.39 1y3n h ILE 81 CO -0.01 0.36 -0.32 -0.09 0.00 0.00 0.00 178.15 178.09 1y3n h ARG 82 N -0.32 -0.62 0.00 2.37 2.43 -0.97 -2.14 114.38 115.12 1y3n h ARG 82 Ca 0.01 0.04 -0.01 0.00 -0.81 0.00 0.00 59.98 59.21 1y3n h ARG 82 Cb 0.61 0.14 -0.00 0.00 -0.42 0.00 0.00 29.97 30.30 1y3n h ARG 82 CO 0.02 -0.41 -0.06 1.88 -1.51 0.00 0.00 179.97 179.88 1y3n h TYR 83 N -0.64 0.00 -0.28 2.20 0.05 -1.21 -2.98 116.97 114.12 1y3n h TYR 83 Ca -0.01 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.70 1y3n h TYR 83 Cb 0.60 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 38.33 1y3n h TYR 83 CO -0.20 0.06 -0.11 0.78 -1.05 0.00 0.00 178.16 177.64 1y3n h GLY 84 N 2.65 0.61 2.00 3.88 0.00 -0.57 0.19 103.07 111.82 1y3n h GLY 84 Ca -0.00 -0.53 0.00 0.00 0.00 0.00 0.00 47.33 46.80 1y3n h GLY 84 CO 0.01 0.48 0.00 -0.33 0.00 0.00 0.00 176.54 176.70 1y3n h MET 85 N 0.30 0.00 -0.01 4.80 2.86 -1.30 -1.14 114.93 120.44 1y3n h MET 85 Ca 0.06 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.70 1y3n h MET 85 Cb 0.61 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.27 1y3n h MET 85 CO 0.04 0.00 -0.14 0.39 1.06 0.00 0.00 176.91 178.26 1y3n n GLU 86 N -2.49 1.19 -0.44 1.72 1.02 -0.88 -4.94 120.64 115.83 1y3n n GLU 86 Ca 0.01 -0.68 0.00 0.00 -0.02 0.00 0.00 57.16 56.47 1y3n n GLU 86 Cb 0.24 -1.49 0.00 0.00 -0.02 0.00 0.00 31.44 30.18 1y3n n GLU 86 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y3n n GLY 87 N 1.26 0.80 0.20 0.62 0.00 -0.43 -4.94 105.19 102.70 1y3n n GLY 87 Ca 0.15 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 46.08 1y3n n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3n h ALA 88 N 0.00 0.70 -4.32 4.61 0.00 -1.16 -3.41 119.26 115.68 1y3n h ALA 88 Ca 0.00 -0.53 -0.70 0.00 0.00 0.00 0.00 54.91 53.69 1y3n h ALA 88 Cb 0.00 -0.08 -0.27 0.00 0.00 0.00 0.00 17.79 17.45 1y3n h ALA 88 CO 0.00 0.70 -0.84 -0.06 0.00 0.00 0.00 179.25 179.06 1y3n s PHE 89 N -3.91 2.50 0.33 0.00 0.08 -1.22 -1.06 117.98 114.70 1y3n s PHE 89 Ca -0.07 -0.31 -0.08 0.00 0.12 0.00 0.00 56.93 56.59 1y3n s PHE 89 Cb 0.11 -1.54 -0.06 0.00 -0.57 0.00 0.00 43.02 40.96 1y3n s PHE 89 CO 0.83 0.08 0.65 0.96 -0.10 0.00 0.00 175.22 177.64 1y3n s ILE 90 N -0.69 4.90 0.37 0.64 -4.36 -0.45 -4.53 121.20 117.09 1y3n s ILE 90 Ca 0.11 0.36 -0.27 0.00 -0.26 0.00 0.00 60.65 60.60 1y3n s ILE 90 Cb -0.10 -3.71 -0.09 0.00 1.25 0.00 0.00 42.46 39.80 1y3n s ILE 90 CO 0.00 -0.37 1.20 -2.84 0.24 0.00 0.00 174.94 173.18 1y3n s PRO 91 N -3.56 4.19 0.00 0.37 0.02 -1.26 -4.61 135.00 130.14 1y3n s PRO 91 Ca 0.48 1.94 0.15 0.00 0.02 0.00 0.00 61.00 63.58 1y3n s PRO 91 Cb -0.11 -2.84 -0.04 0.00 0.02 0.00 0.00 34.50 31.54 1y3n s PRO 91 CO 0.29 -0.24 0.75 1.28 -0.33 0.00 0.00 177.00 178.75 1y3n n LEU 92 N 0.38 1.30 -0.21 -5.54 4.77 0.38 -4.72 117.00 113.36 1y3n n LEU 92 Ca 0.03 -0.70 -0.11 0.00 -0.03 0.00 0.00 56.01 55.20 1y3n n LEU 92 Cb 0.45 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.46 1y3n n LEU 92 CO 0.53 0.26 0.52 0.78 -1.33 0.00 0.00 177.39 178.16 1y3n h ASN 93 N 1.21 -1.79 -0.03 -1.43 2.35 -1.93 0.55 115.58 114.51 1y3n h ASN 93 Ca 0.00 0.26 -0.00 0.00 -0.55 0.00 0.00 56.30 56.01 1y3n h ASN 93 Cb 0.46 0.77 -0.00 0.00 0.05 0.00 0.00 38.32 39.60 1y3n h ASN 93 CO 0.00 -0.35 0.01 0.50 -1.65 0.00 0.00 177.43 175.94 1y3n h LYS 94 N -0.27 0.04 -0.91 0.81 3.64 -1.98 -2.04 116.57 115.86 1y3n h LYS 94 Ca 0.13 -0.01 0.13 0.00 -1.27 0.00 0.00 60.65 59.63 1y3n h LYS 94 Cb 0.56 -0.01 -0.09 0.00 -0.41 0.00 0.00 32.23 32.28 1y3n h LYS 94 CO -0.69 0.20 0.52 -0.07 -2.27 0.00 0.00 179.45 177.14 1y3n h LEU 95 N -0.13 0.71 0.27 5.20 3.38 -1.75 -0.82 115.31 122.17 1y3n h LEU 95 Ca 0.01 0.07 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 1y3n h LEU 95 Cb 0.18 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.87 1y3n h LEU 95 CO -0.00 0.35 -0.13 0.40 0.09 0.00 0.00 178.44 179.15 1y3n h ILE 96 N 0.79 0.76 -0.30 1.22 2.04 -0.80 0.82 117.51 122.03 1y3n h ILE 96 Ca 0.47 -0.64 0.09 0.00 1.00 0.00 0.00 64.86 65.78 1y3n h ILE 96 Cb 0.57 1.10 -0.01 0.00 -0.74 0.00 0.00 36.82 37.74 1y3n h ILE 96 CO -0.31 0.13 0.24 -0.78 0.00 0.00 0.00 178.15 177.43 1y3n h ASP 97 N -0.72 0.00 0.00 1.72 1.82 -0.96 -1.06 116.42 117.22 1y3n h ASP 97 Ca -0.04 0.00 -0.18 0.00 -0.39 0.00 0.00 57.03 56.43 1y3n h ASP 97 Cb 0.49 0.00 -0.03 0.00 0.68 0.00 0.00 39.33 40.46 1y3n h ASP 97 CO 0.06 0.00 -2.12 0.00 -1.61 0.00 0.00 179.24 175.57 1y3n n GLN 98 N -4.25 0.76 0.00 0.28 6.02 -0.35 -4.75 117.38 115.09 1y3n n GLN 98 Ca 0.04 -0.10 0.00 0.00 -0.01 0.00 0.00 57.00 56.94 1y3n n GLN 98 Cb 0.41 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.18 1y3n n GLN 98 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1y3n n ASN 99 N -2.46 0.50 -3.72 1.08 4.13 0.27 -4.96 115.26 110.10 1y3n n ASN 99 Ca -0.18 -0.99 -0.28 0.00 1.68 0.00 0.00 54.58 54.82 1y3n n ASN 99 Cb 0.83 0.01 -0.11 0.00 -1.54 0.00 0.00 39.78 38.97 1y3n n ASN 99 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1y3n s ALA 100 N -0.01 2.96 0.40 5.41 0.00 -0.41 -4.66 121.76 125.46 1y3n s ALA 100 Ca 0.00 -3.35 0.07 0.00 0.00 0.00 0.00 51.96 48.68 1y3n s ALA 100 Cb 0.00 -1.97 0.83 0.00 0.00 0.00 0.00 23.12 21.99 1y3n s ALA 100 CO 0.00 -2.05 2.04 -1.00 0.00 0.00 0.00 175.76 174.74 1y3n h PRO 101 N 5.49 0.53 -0.28 0.00 0.13 -1.93 -0.38 132.00 135.56 1y3n h PRO 101 Ca 0.19 -0.04 -0.06 0.00 -0.87 0.00 0.00 66.00 65.21 1y3n h PRO 101 Cb 0.81 -0.11 -0.01 0.00 0.13 0.00 0.00 31.00 31.82 1y3n h PRO 101 CO 0.60 0.38 -0.07 -0.91 -0.23 0.00 0.00 178.00 177.77 1y3n h ASN 102 N 0.54 0.55 -0.40 1.44 2.35 -1.90 -1.90 115.58 116.26 1y3n h ASN 102 Ca 0.14 -0.36 -0.14 0.00 -0.55 0.00 0.00 56.30 55.39 1y3n h ASN 102 Cb -0.01 -0.15 -0.01 0.00 0.05 0.00 0.00 38.32 38.20 1y3n h ASN 102 CO -0.03 0.78 -0.28 -0.07 -1.65 0.00 0.00 177.43 176.18 1y3n h LEU 103 N 0.30 0.96 -0.40 1.61 3.38 -1.78 -1.03 115.31 118.35 1y3n h LEU 103 Ca 0.07 -0.39 0.01 0.00 0.09 0.00 0.00 57.88 57.66 1y3n h LEU 103 Cb 0.54 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.00 1y3n h LEU 103 CO 0.03 1.17 0.26 0.50 0.09 0.00 0.00 178.44 180.49 1y3n h LYS 104 N 0.78 0.52 -0.28 1.13 3.64 -1.02 -0.49 116.57 120.86 1y3n h LYS 104 Ca 0.09 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.41 1y3n h LYS 104 Cb 0.86 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 32.55 1y3n h LYS 104 CO 0.08 0.35 0.05 0.00 -2.27 0.00 0.00 179.45 177.65 1y3n h ALA 105 N 1.15 0.37 -0.28 5.00 0.00 -1.25 -2.27 119.26 121.98 1y3n h ALA 105 Ca 0.15 -0.18 0.06 0.00 0.00 0.00 0.00 54.91 54.94 1y3n h ALA 105 Cb -0.05 -0.11 -0.07 0.00 0.00 0.00 0.00 17.79 17.57 1y3n h ALA 105 CO -0.04 0.05 -0.15 0.35 0.00 0.00 0.00 179.25 179.46 1y3n h PHE 106 N 0.28 -0.36 -0.43 0.00 3.57 -0.80 -2.02 116.94 117.19 1y3n h PHE 106 Ca 0.09 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.57 1y3n h PHE 106 Cb 0.32 0.20 -0.02 0.00 2.79 0.00 0.00 35.95 39.24 1y3n h PHE 106 CO 0.02 -0.22 0.05 0.74 -2.23 0.00 0.00 178.31 176.68 1y3n h PHE 107 N -0.11 0.68 -0.48 0.41 0.05 -1.02 0.12 116.94 116.59 1y3n h PHE 107 Ca 0.15 -0.07 -0.06 0.00 3.82 0.00 0.00 57.97 61.82 1y3n h PHE 107 Cb 0.34 -0.20 -0.02 0.00 2.00 0.00 0.00 35.95 38.06 1y3n h PHE 107 CO -0.34 0.62 0.06 0.87 -0.18 0.00 0.00 178.31 179.35 1y3n h LYS 108 N 0.64 0.75 -0.00 1.51 6.56 -0.80 -2.36 116.57 122.87 1y3n h LYS 108 Ca 0.14 -0.17 0.00 0.00 -1.06 0.00 0.00 60.65 59.56 1y3n h LYS 108 Cb 0.32 -0.11 0.00 0.00 -0.57 0.00 0.00 32.23 31.87 1y3n h LYS 108 CO 0.01 0.72 -0.47 0.25 -2.06 0.00 0.00 179.45 177.89 1y3n n THR 109 N -4.26 0.00 -3.13 -0.16 -2.24 -0.82 -4.35 114.28 99.33 1y3n n THR 109 Ca 0.03 -0.03 -0.24 0.00 -2.27 0.00 0.00 64.05 61.54 1y3n n THR 109 Cb 0.25 0.33 -0.05 0.00 -2.10 0.00 0.00 70.33 68.77 1y3n n THR 109 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1y3n n HIS 110 N -1.30 2.16 -0.13 4.78 8.25 0.37 -4.94 115.22 124.40 1y3n n HIS 110 Ca 0.07 -3.91 0.08 0.00 -0.26 0.00 0.00 57.72 53.70 1y3n n HIS 110 Cb 0.34 -0.46 0.41 0.00 1.12 0.00 0.00 29.99 31.40 1y3n n HIS 110 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1y3n h PRO 111 N 3.29 0.61 -0.48 -0.41 0.13 -1.70 -1.92 132.00 131.52 1y3n h PRO 111 Ca 0.12 -0.04 -0.07 0.00 -0.87 0.00 0.00 66.00 65.15 1y3n h PRO 111 Cb 0.73 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.70 1y3n h PRO 111 CO 0.67 0.40 0.02 1.05 -0.23 0.00 0.00 178.00 179.91 1y3n h GLU 112 N 0.62 0.78 -0.36 0.86 9.09 -1.92 -1.30 114.58 122.36 1y3n h GLU 112 Ca 0.29 -0.20 -0.12 0.00 0.05 0.00 0.00 59.36 59.38 1y3n h GLU 112 Cb 0.32 -0.10 -0.01 0.00 -1.65 0.00 0.00 28.75 27.32 1y3n h GLU 112 CO -0.09 0.78 -0.23 0.28 0.05 0.00 0.00 179.01 179.80 1y3n h VAL 113 N 0.74 1.29 -0.62 -1.06 2.07 -1.67 -1.33 116.25 115.66 1y3n h VAL 113 Ca 0.15 -1.38 -0.02 0.00 0.82 0.00 0.00 66.70 66.27 1y3n h VAL 113 Cb 0.42 1.39 -0.03 0.00 -1.52 0.00 0.00 31.29 31.55 1y3n h VAL 113 CO 0.02 0.45 0.33 -0.61 0.02 0.00 0.00 177.57 177.78 1y3n h GLN 114 N 0.58 0.88 -0.32 1.57 4.15 -1.18 -2.60 115.11 118.19 1y3n h GLN 114 Ca 0.07 -0.11 -0.02 0.00 0.77 0.00 0.00 58.65 59.36 1y3n h GLN 114 Cb 0.79 -0.17 -0.01 0.00 0.21 0.00 0.00 27.48 28.30 1y3n h GLN 114 CO 0.06 0.68 0.14 -0.09 -1.93 0.00 0.00 178.83 177.69 1y3n h ARG 115 N 0.85 0.48 -0.59 1.69 2.43 -1.13 -2.58 114.38 115.52 1y3n h ARG 115 Ca 0.22 -0.08 0.10 0.00 -0.81 0.00 0.00 59.98 59.41 1y3n h ARG 115 Cb 0.07 -0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 29.50 1y3n h ARG 115 CO -0.03 0.47 0.40 0.00 -1.51 0.00 0.00 179.97 179.29 1y3n h ALA 116 N 0.98 2.05 -0.02 2.80 0.00 -0.95 -2.28 119.26 121.86 1y3n h ALA 116 Ca 0.11 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1y3n h ALA 116 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1y3n h ALA 116 CO -0.01 -0.19 -0.29 0.44 0.00 0.00 0.00 179.25 179.20 1y3n n ILE 117 N -4.47 0.00 -2.80 0.00 -5.35 -1.01 -4.95 119.36 100.79 1y3n n ILE 117 Ca 0.10 -0.27 -0.40 0.00 -0.27 0.00 0.00 62.75 61.90 1y3n n ILE 117 Cb 0.39 1.02 -0.05 0.00 -1.74 0.00 0.00 39.64 39.26 1y3n n ILE 117 CO 0.00 0.00 0.00 -0.89 -1.76 0.00 0.00 176.55 173.90 1y3n s THR 118 N -2.35 4.42 0.71 7.28 2.01 -0.86 -4.43 115.64 122.42 1y3n s THR 118 Ca 0.24 1.97 -0.09 0.00 0.31 0.00 0.00 61.69 64.12 1y3n s THR 118 Cb 0.19 -4.28 0.04 0.00 0.01 0.00 0.00 72.50 68.47 1y3n s THR 118 CO 0.49 0.39 1.05 0.00 -0.69 0.00 0.00 174.62 175.86 1y3n s ALA 119 N -0.41 2.99 0.52 7.40 0.00 -0.05 -4.92 121.76 127.29 1y3n s ALA 119 Ca 0.43 -0.66 0.24 0.00 0.00 0.00 0.00 51.96 51.97 1y3n s ALA 119 Cb -0.24 -2.80 1.35 0.00 0.00 0.00 0.00 23.12 21.43 1y3n s ALA 119 CO 0.29 -1.26 1.98 -1.35 0.00 0.00 0.00 175.76 175.42 1y3n h PRO 120 N -0.64 0.06 -0.23 0.00 0.11 -1.88 0.17 132.00 129.59 1y3n h PRO 120 Ca -0.45 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.65 1y3n h PRO 120 Cb 1.29 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.39 1y3n h PRO 120 CO 0.63 0.04 0.00 -0.40 -0.21 0.00 0.00 178.00 178.06 1y3n n ASP 121 N -4.39 1.17 0.00 -2.05 5.68 -1.26 -4.61 116.55 111.09 1y3n n ASP 121 Ca 0.11 -2.01 0.00 0.00 -0.50 0.00 0.00 54.79 52.39 1y3n n ASP 121 Cb 0.61 -0.15 0.00 0.00 -1.14 0.00 0.00 41.12 40.44 1y3n n ASP 121 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1y3n n GLY 122 N 0.83 0.63 3.89 6.12 0.00 0.59 -5.02 105.19 112.23 1y3n n GLY 122 Ca 0.07 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.77 1y3n n GLY 122 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1y3n s ASN 123 N -2.41 6.50 -0.35 1.61 0.01 -1.26 -4.77 114.94 114.28 1y3n s ASN 123 Ca 0.00 0.58 -0.13 0.00 -0.71 0.00 0.00 52.86 52.60 1y3n s ASN 123 Cb 0.00 -2.09 -0.01 0.00 0.41 0.00 0.00 41.25 39.56 1y3n s ASN 123 CO 0.00 0.10 0.25 -0.63 -1.51 0.00 0.00 177.10 175.30 1y3n s ILE 124 N -1.58 5.22 -2.68 0.60 1.01 -1.26 -0.87 121.20 121.64 1y3n s ILE 124 Ca 0.38 -0.32 0.23 0.00 0.00 0.00 0.00 60.65 60.93 1y3n s ILE 124 Cb -0.12 -3.73 0.14 0.00 0.01 0.00 0.00 42.46 38.75 1y3n s ILE 124 CO 0.23 -0.07 1.19 -1.22 0.00 0.00 0.00 174.94 175.08 1y3n n TYR 125 N 5.11 0.00 -3.54 3.97 4.02 -1.26 -0.47 117.16 124.98 1y3n n TYR 125 Ca -0.12 0.00 -0.10 0.00 -0.01 0.00 0.00 57.90 57.67 1y3n n TYR 125 Cb 0.49 0.00 -0.02 0.00 -0.02 0.00 0.00 39.34 39.79 1y3n n TYR 125 CO 0.00 0.00 0.00 1.52 -1.01 0.00 0.00 176.86 177.37 1y3n s TYR 126 N -2.05 -0.40 -0.17 -0.72 -0.85 -1.26 -4.45 117.35 107.46 1y3n s TYR 126 Ca 0.25 0.16 -0.05 0.00 -0.52 0.00 0.00 57.07 56.91 1y3n s TYR 126 Cb 0.19 0.59 -0.03 0.00 0.38 0.00 0.00 41.96 43.09 1y3n s TYR 126 CO 0.35 -0.85 -0.00 -0.51 -1.52 0.00 0.00 175.55 173.02 1y3n s LEU 127 N -2.73 3.42 0.54 -3.49 1.43 -0.35 -4.96 118.68 112.53 1y3n s LEU 127 Ca 0.05 -0.08 -0.06 0.00 -1.03 0.00 0.00 54.13 53.01 1y3n s LEU 127 Cb -0.02 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 44.34 1y3n s LEU 127 CO -0.07 0.16 0.85 -2.16 0.23 0.00 0.00 176.35 175.36 1y3n s PRO 128 N 0.45 3.28 -0.27 1.29 0.04 -1.26 -1.97 135.00 136.56 1y3n s PRO 128 Ca -0.01 0.15 -0.26 0.00 0.04 0.00 0.00 61.00 60.92 1y3n s PRO 128 Cb -0.14 -2.31 0.00 0.00 0.04 0.00 0.00 34.50 32.09 1y3n s PRO 128 CO 0.02 -0.44 0.89 -0.47 0.04 0.00 0.00 177.00 177.04 1y3n s TYR 129 N -2.88 3.27 -0.47 0.56 5.04 -0.44 -2.62 117.35 119.81 1y3n s TYR 129 Ca 0.51 1.13 -0.09 0.00 -2.44 0.00 0.00 57.07 56.17 1y3n s TYR 129 Cb -0.10 -3.21 0.11 0.00 0.35 0.00 0.00 41.96 39.11 1y3n s TYR 129 CO 0.46 -0.50 0.34 0.08 -1.34 0.00 0.00 175.55 174.58 1y3n s VAL 130 N 3.04 4.24 0.94 3.14 1.01 0.01 -1.72 120.40 131.07 1y3n s VAL 130 Ca 0.37 -1.72 -0.11 0.00 0.00 0.00 0.00 61.98 60.52 1y3n s VAL 130 Cb -0.15 -3.76 0.16 0.00 0.00 0.00 0.00 36.38 32.63 1y3n s VAL 130 CO 0.09 -0.74 1.09 -2.84 0.00 0.00 0.00 175.10 172.70 1y3n s PRO 131 N 1.38 0.86 -0.06 2.72 0.02 -1.26 -0.55 135.00 138.10 1y3n s PRO 131 Ca 0.05 0.97 0.00 0.00 0.02 0.00 0.00 61.00 62.04 1y3n s PRO 131 Cb -0.26 -1.75 0.02 0.00 0.02 0.00 0.00 34.50 32.53 1y3n s PRO 131 CO -0.00 -2.55 -0.04 0.34 -0.33 0.00 0.00 177.00 174.42 1y3n s ASP 132 N -3.12 1.39 0.00 2.53 3.68 -1.26 -4.71 116.67 115.17 1y3n s ASP 132 Ca 0.65 -0.15 0.00 0.00 2.13 0.00 0.00 52.55 55.18 1y3n s ASP 132 Cb -0.20 -0.52 0.00 0.00 -1.45 0.00 0.00 42.92 40.75 1y3n s ASP 132 CO 0.58 -0.11 0.00 0.61 0.13 0.00 0.00 175.17 176.39 1y3n n GLY 133 N 4.54 0.71 1.02 2.66 0.00 -1.26 -4.46 105.19 108.40 1y3n n GLY 133 Ca -0.17 -1.89 0.00 0.00 0.00 0.00 0.00 46.02 43.97 1y3n n GLY 133 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1y3n n LEU 134 N 0.00 0.10 -4.90 0.99 7.94 -1.26 -4.85 117.00 115.02 1y3n n LEU 134 Ca 0.00 0.01 -0.28 0.00 -1.11 0.00 0.00 56.01 54.63 1y3n n LEU 134 Cb 0.00 -0.03 0.02 0.00 0.53 0.00 0.00 43.42 43.94 1y3n n LEU 134 CO 0.00 -0.52 0.58 0.68 -1.11 0.00 0.00 177.39 177.01 1y3n s VAL 135 N -1.09 4.25 0.00 1.96 -7.23 -1.26 -1.70 120.40 115.32 1y3n s VAL 135 Ca 0.00 0.32 0.00 0.00 -1.81 0.00 0.00 61.98 60.49 1y3n s VAL 135 Cb 0.00 -3.67 0.00 0.00 0.56 0.00 0.00 36.38 33.27 1y3n s VAL 135 CO 0.00 -0.76 0.00 -1.54 -0.31 0.00 0.00 175.10 172.49 1y3n n SER 136 N -2.58 0.00 -4.97 4.85 3.41 -1.26 -4.42 113.62 108.65 1y3n n SER 136 Ca 0.04 0.00 -0.21 0.00 -0.26 0.00 0.00 58.87 58.44 1y3n n SER 136 Cb 0.56 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.50 1y3n n SER 136 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 1y3n s ARG 137 N -0.18 3.24 0.19 4.33 0.52 -1.26 -2.60 118.95 123.18 1y3n s ARG 137 Ca 0.00 -0.73 -0.22 0.00 -0.52 0.00 0.00 55.73 54.26 1y3n s ARG 137 Cb 0.00 -2.76 0.05 0.00 0.52 0.00 0.00 34.95 32.77 1y3n s ARG 137 CO 0.00 0.09 0.61 0.20 0.02 0.00 0.00 175.30 176.21 1y3n s GLY 138 N -4.12 -0.44 0.21 -3.53 0.00 -0.69 -4.89 107.32 93.86 1y3n s GLY 138 Ca 0.42 0.23 -0.26 0.00 0.00 0.00 0.00 44.72 45.11 1y3n s GLY 138 CO 0.33 0.04 0.83 -0.19 0.00 0.00 0.00 173.10 174.11 1y3n s TYR 139 N -3.80 3.88 -0.02 1.90 2.02 -1.25 -2.06 117.35 118.02 1y3n s TYR 139 Ca 0.04 1.70 0.04 0.00 -0.37 0.00 0.00 57.07 58.48 1y3n s TYR 139 Cb -0.02 -2.82 -0.01 0.00 -0.40 0.00 0.00 41.96 38.71 1y3n s TYR 139 CO -0.08 0.45 -0.13 -0.06 -1.57 0.00 0.00 175.55 174.16 1y3n s PHE 140 N -1.24 1.19 0.05 2.71 0.40 -0.28 -0.14 117.98 120.66 1y3n s PHE 140 Ca 0.39 -0.25 0.01 0.00 -0.60 0.00 0.00 56.93 56.49 1y3n s PHE 140 Cb -0.23 -0.78 -0.03 0.00 0.51 0.00 0.00 43.02 42.49 1y3n s PHE 140 CO 0.27 -0.04 -0.06 -1.50 0.70 0.00 0.00 175.22 174.58 1y3n s ILE 141 N -0.20 0.49 -0.80 0.64 2.07 -0.06 -1.48 121.20 121.85 1y3n s ILE 141 Ca 0.03 -1.33 -0.26 0.00 -1.41 0.00 0.00 60.65 57.69 1y3n s ILE 141 Cb -0.06 -0.90 0.01 0.00 0.13 0.00 0.00 42.46 41.64 1y3n s ILE 141 CO -0.00 -0.57 1.57 -0.13 -1.91 0.00 0.00 174.94 173.90 1y3n s ARG 142 N -2.32 3.04 0.32 3.50 1.81 -0.37 -1.22 118.95 123.70 1y3n s ARG 142 Ca -0.04 -0.24 0.01 0.00 -1.72 0.00 0.00 55.73 53.75 1y3n s ARG 142 Cb -0.05 -4.64 0.53 0.00 -0.45 0.00 0.00 34.95 30.34 1y3n s ARG 142 CO -0.02 -2.51 1.90 0.37 -0.68 0.00 0.00 175.30 174.36 1y3n h GLN 143 N 11.43 0.75 -0.24 3.54 5.75 -1.02 -1.66 115.11 133.66 1y3n h GLN 143 Ca -0.10 -0.12 -0.06 0.00 -0.15 0.00 0.00 58.65 58.22 1y3n h GLN 143 Cb 1.06 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 29.47 1y3n h GLN 143 CO 1.29 0.63 -0.14 0.38 -2.65 0.00 0.00 178.83 178.34 1y3n h ASP 144 N 0.74 0.38 -0.08 -0.69 -0.00 -1.81 0.37 116.42 115.33 1y3n h ASP 144 Ca 0.18 -0.09 -0.18 0.00 -0.00 0.00 0.00 57.03 56.94 1y3n h ASP 144 Cb 0.17 -0.10 -0.00 0.00 -0.00 0.00 0.00 39.33 39.40 1y3n h ASP 144 CO -0.01 0.55 -0.59 -0.50 -0.00 0.00 0.00 179.24 178.69 1y3n h TRP 145 N 0.37 0.86 -0.35 4.15 4.06 -1.73 -0.62 115.95 122.69 1y3n h TRP 145 Ca 0.07 -0.32 -0.01 0.00 2.06 0.00 0.00 58.89 60.70 1y3n h TRP 145 Cb 0.46 -0.16 -0.02 0.00 -1.00 0.00 0.00 29.16 28.45 1y3n h TRP 145 CO 0.01 1.10 0.19 -0.07 -3.56 0.00 0.00 178.44 176.11 1y3n h LEU 146 N 0.51 0.43 -0.25 -4.49 3.38 -0.71 -1.82 115.31 112.35 1y3n h LEU 146 Ca 0.00 -0.08 -0.01 0.00 0.09 0.00 0.00 57.88 57.88 1y3n h LEU 146 Cb 1.16 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.79 1y3n h LEU 146 CO 0.12 0.38 0.11 0.44 0.09 0.00 0.00 178.44 179.58 1y3n h ASP 147 N 0.44 0.34 -0.56 -0.43 3.45 -0.82 0.50 116.42 119.35 1y3n h ASP 147 Ca 0.12 -0.16 0.03 0.00 0.43 0.00 0.00 57.03 57.45 1y3n h ASP 147 Cb 0.05 -0.09 -0.03 0.00 -0.56 0.00 0.00 39.33 38.70 1y3n h ASP 147 CO -0.02 0.41 0.37 0.50 -1.57 0.00 0.00 179.24 178.92 1y3n h LYS 148 N 0.26 0.65 -0.33 3.56 3.64 -0.97 -1.56 116.57 121.83 1y3n h LYS 148 Ca 0.08 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.43 1y3n h LYS 148 Cb 0.17 -0.15 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 1y3n h LYS 148 CO -0.01 0.43 0.00 1.28 -2.27 0.00 0.00 179.45 178.88 1y3n n LEU 149 N -4.46 2.67 -3.72 5.20 4.77 -0.70 -4.95 117.00 115.81 1y3n n LEU 149 Ca 0.06 -1.17 -0.24 0.00 -0.03 0.00 0.00 56.01 54.63 1y3n n LEU 149 Cb 0.12 -0.21 0.05 0.00 -2.33 0.00 0.00 43.42 41.04 1y3n n LEU 149 CO 0.35 0.59 0.08 1.41 -1.33 0.00 0.00 177.39 178.48 1y3n n HIS 150 N 0.98 -2.27 -4.58 -1.77 8.25 -0.48 -4.99 115.22 110.36 1y3n n HIS 150 Ca 0.18 0.91 -0.32 0.00 -0.26 0.00 0.00 57.72 58.22 1y3n n HIS 150 Cb 0.47 -4.47 -0.11 0.00 1.12 0.00 0.00 29.99 27.00 1y3n n HIS 150 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 1y3n s LEU 151 N -6.96 3.02 0.51 2.41 1.43 0.04 -5.03 118.68 114.11 1y3n s LEU 151 Ca 0.34 -0.17 -0.07 0.00 -1.03 0.00 0.00 54.13 53.19 1y3n s LEU 151 Cb -0.16 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.30 1y3n s LEU 151 CO 0.79 0.30 0.85 -0.54 0.23 0.00 0.00 176.35 177.98 1y3n s LYS 152 N -1.22 3.58 0.15 1.70 -0.14 -1.26 -4.46 119.74 118.08 1y3n s LYS 152 Ca 0.15 0.37 -0.32 0.00 -1.36 0.00 0.00 55.97 54.81 1y3n s LYS 152 Cb -0.11 -2.30 -0.11 0.00 -1.68 0.00 0.00 37.83 33.63 1y3n s LYS 152 CO 0.05 -0.29 1.78 2.41 -0.76 0.00 0.00 175.35 178.54 1y3n n THR 153 N -2.31 0.22 -2.06 2.17 -1.04 -1.26 -4.89 114.28 105.11 1y3n n THR 153 Ca 0.02 -0.04 -0.42 0.00 -2.04 0.00 0.00 64.05 61.57 1y3n n THR 153 Cb 0.55 -2.02 -0.03 0.00 -1.82 0.00 0.00 70.33 67.01 1y3n n THR 153 CO 0.00 0.00 0.00 -2.16 -0.64 0.00 0.00 175.07 172.27 1y3n s PRO 154 N 2.08 4.27 -0.02 -2.82 0.04 -1.26 -4.91 135.00 132.38 1y3n s PRO 154 Ca 0.80 2.20 0.20 0.00 0.04 0.00 0.00 61.00 64.24 1y3n s PRO 154 Cb -0.51 -3.27 -0.28 0.00 0.04 0.00 0.00 34.50 30.48 1y3n s PRO 154 CO 0.36 -0.54 0.61 1.04 0.04 0.00 0.00 177.00 178.51 1y3n n GLN 155 N 4.21 0.54 -4.31 4.56 1.13 -1.26 -4.76 117.38 117.50 1y3n n GLN 155 Ca 0.13 -0.11 -0.16 0.00 -1.94 0.00 0.00 57.00 54.92 1y3n n GLN 155 Cb 0.41 -1.47 -0.10 0.00 0.11 0.00 0.00 30.24 29.19 1y3n n GLN 155 CO 0.00 0.00 0.00 0.95 -1.44 0.00 0.00 177.06 176.57 1y3n s THR 156 N -3.21 0.52 0.26 5.09 -4.23 -1.26 -0.57 115.64 112.24 1y3n s THR 156 Ca -0.02 -2.00 -0.01 0.00 -1.18 0.00 0.00 61.69 58.48 1y3n s THR 156 Cb 0.14 -2.62 0.10 0.00 1.34 0.00 0.00 72.50 71.47 1y3n s THR 156 CO 0.84 -0.01 1.75 0.58 -0.54 0.00 0.00 174.62 177.24 1y3n h VAL 157 N 2.41 1.24 -0.63 2.29 2.07 -1.83 -0.45 116.25 121.36 1y3n h VAL 157 Ca -0.38 -1.04 -0.09 0.00 0.82 0.00 0.00 66.70 66.00 1y3n h VAL 157 Cb 1.25 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.95 1y3n h VAL 157 CO 0.60 0.36 0.03 0.44 0.02 0.00 0.00 177.57 179.02 1y3n h ASP 158 N 0.69 1.06 -0.20 0.57 3.32 -1.97 -0.02 116.42 119.86 1y3n h ASP 158 Ca 0.13 -0.29 -0.11 0.00 0.02 0.00 0.00 57.03 56.78 1y3n h ASP 158 Cb 0.49 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.74 1y3n h ASP 158 CO 0.03 1.09 -0.26 -0.33 -1.72 0.00 0.00 179.24 178.05 1y3n h GLU 159 N 0.99 0.68 -0.60 3.56 5.08 -1.89 -2.58 114.58 119.83 1y3n h GLU 159 Ca 0.18 -0.28 -0.09 0.00 -1.00 0.00 0.00 59.36 58.17 1y3n h GLU 159 Cb 0.53 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.73 1y3n h GLU 159 CO 0.03 0.87 0.01 1.25 -1.00 0.00 0.00 179.01 180.16 1y3n h LEU 160 N 0.59 1.01 -0.26 1.33 5.85 -0.68 -1.55 115.31 121.58 1y3n h LEU 160 Ca 0.08 -0.27 0.03 0.00 0.84 0.00 0.00 57.88 58.55 1y3n h LEU 160 Cb 0.75 -0.27 -0.03 0.00 0.37 0.00 0.00 40.66 41.48 1y3n h LEU 160 CO 0.06 1.05 0.08 0.22 -0.34 0.00 0.00 178.44 179.51 1y3n h TYR 161 N 0.95 0.15 -0.64 1.25 5.03 -0.76 0.21 116.97 123.15 1y3n h TYR 161 Ca 0.17 0.01 0.02 0.00 2.58 0.00 0.00 58.73 61.52 1y3n h TYR 161 Cb 0.53 -0.03 -0.04 0.00 1.55 0.00 0.00 36.73 38.74 1y3n h TYR 161 CO 0.04 0.06 0.40 1.15 -1.32 0.00 0.00 178.16 178.49 1y3n h THR 162 N 0.20 1.10 -0.32 1.81 2.02 -1.18 -0.27 112.91 116.26 1y3n h THR 162 Ca 0.12 -0.27 -0.03 0.00 0.77 0.00 0.00 66.41 66.99 1y3n h THR 162 Cb 0.09 0.23 -0.01 0.00 -1.74 0.00 0.00 68.15 66.72 1y3n h THR 162 CO -0.13 0.15 0.09 0.58 0.37 0.00 0.00 175.52 176.58 1y3n h VAL 163 N 0.80 1.21 -0.25 3.16 2.07 -0.77 -1.38 116.25 121.09 1y3n h VAL 163 Ca 0.25 -0.69 -0.10 0.00 0.82 0.00 0.00 66.70 66.98 1y3n h VAL 163 Cb -0.01 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1y3n h VAL 163 CO -0.09 0.23 -0.26 -0.07 0.02 0.00 0.00 177.57 177.40 1y3n h LEU 164 N 0.36 0.50 -0.95 2.57 3.38 -0.74 -1.02 115.31 119.41 1y3n h LEU 164 Ca 0.10 -0.17 -0.07 0.00 0.09 0.00 0.00 57.88 57.83 1y3n h LEU 164 Cb 0.27 -0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.86 1y3n h LEU 164 CO -0.00 0.75 -0.04 0.11 0.09 0.00 0.00 178.44 179.35 1y3n h LYS 165 N 0.43 0.72 -0.42 1.13 1.57 -0.87 -1.61 116.57 117.51 1y3n h LYS 165 Ca 0.06 -0.20 -0.07 0.00 -1.87 0.00 0.00 60.65 58.58 1y3n h LYS 165 Cb 0.69 -0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.90 1y3n h LYS 165 CO 0.05 0.76 0.01 0.00 -0.57 0.00 0.00 179.45 179.70 1y3n h ALA 166 N 1.29 0.57 -0.80 3.86 0.00 -0.67 -0.23 119.26 123.28 1y3n h ALA 166 Ca 0.13 -0.26 0.05 0.00 0.00 0.00 0.00 54.91 54.82 1y3n h ALA 166 Cb 0.48 -0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.05 1y3n h ALA 166 CO 0.02 0.35 0.50 0.74 0.00 0.00 0.00 179.25 180.86 1y3n h PHE 167 N 0.58 0.92 -0.31 0.00 0.04 -0.86 0.42 116.94 117.73 1y3n h PHE 167 Ca 0.12 0.03 -0.16 0.00 2.80 0.00 0.00 57.97 60.76 1y3n h PHE 167 Cb 0.48 -0.30 -0.00 0.00 2.20 0.00 0.00 35.95 38.33 1y3n h PHE 167 CO 0.04 0.50 -0.42 -0.22 -0.60 0.00 0.00 178.31 177.60 1y3n h LYS 168 N 0.94 0.84 0.00 1.51 3.64 -1.00 -3.38 116.57 119.12 1y3n h LYS 168 Ca 0.33 -0.48 0.00 0.00 -1.27 0.00 0.00 60.65 59.23 1y3n h LYS 168 Cb 0.09 0.04 0.00 0.00 -0.41 0.00 0.00 32.23 31.95 1y3n h LYS 168 CO -0.14 1.12 -1.57 0.39 -2.27 0.00 0.00 179.45 176.98 1y3n n GLU 169 N -4.10 0.68 -0.68 1.90 1.02 -0.12 -4.58 120.64 114.74 1y3n n GLU 169 Ca -0.04 -0.12 0.08 0.00 -0.02 0.00 0.00 57.16 57.06 1y3n n GLU 169 Cb 0.56 -1.43 0.35 0.00 -0.02 0.00 0.00 31.44 30.91 1y3n n GLU 169 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1y3n n LYS 170 N -1.94 3.99 -3.90 3.49 4.76 0.15 -4.99 118.16 119.72 1y3n n LYS 170 Ca -0.01 -2.79 -0.38 0.00 -2.87 0.00 0.00 58.31 52.26 1y3n n LYS 170 Cb 0.43 -2.00 0.02 0.00 -1.84 0.00 0.00 35.03 31.64 1y3n n LYS 170 CO 0.00 0.00 0.00 -3.47 -1.37 0.00 0.00 177.40 172.56 1y3n n ASP 171 N 0.88 -4.12 0.24 4.39 4.64 -1.26 -4.86 116.55 116.45 1y3n n ASP 171 Ca 0.25 -1.15 0.07 0.00 -1.38 0.00 0.00 54.79 52.58 1y3n n ASP 171 Cb 0.96 -2.54 0.59 0.00 -1.04 0.00 0.00 41.12 39.09 1y3n n ASP 171 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1y3n h PRO 172 N -2.21 0.00 -0.01 -0.67 0.13 -1.85 -0.36 132.00 127.03 1y3n h PRO 172 Ca -0.68 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.45 1y3n h PRO 172 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1y3n h PRO 172 CO 0.52 0.09 0.00 0.27 -0.23 0.00 0.00 178.00 178.65 1y3n n ASN 173 N -4.35 0.11 -2.10 1.44 0.23 -1.26 -4.92 115.26 104.41 1y3n n ASN 173 Ca -0.03 -1.35 -0.15 0.00 -0.53 0.00 0.00 54.58 52.53 1y3n n ASN 173 Cb 0.17 -0.01 -0.03 0.00 -2.08 0.00 0.00 39.78 37.84 1y3n n ASN 173 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1y3n n GLY 174 N 0.86 0.13 1.15 4.83 0.00 -0.15 -4.88 105.19 107.14 1y3n n GLY 174 Ca 0.16 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.27 1y3n n GLY 174 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1y3n n ASN 175 N -1.48 3.36 0.00 1.61 2.04 -1.26 -4.92 115.26 114.60 1y3n n ASN 175 Ca -0.17 -2.12 0.00 0.00 -0.44 0.00 0.00 54.58 51.86 1y3n n ASN 175 Cb 0.59 -0.43 0.00 0.00 -2.53 0.00 0.00 39.78 37.41 1y3n n ASN 175 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1y3n n GLY 176 N 1.27 0.36 3.37 4.83 0.00 -1.26 -5.00 105.19 108.77 1y3n n GLY 176 Ca 0.20 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.93 1y3n n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3n s LYS 177 N -0.75 1.42 -1.26 1.61 1.02 -1.26 -5.04 119.74 115.46 1y3n s LYS 177 Ca 0.00 -1.30 -0.10 0.00 0.02 0.00 0.00 55.97 54.60 1y3n s LYS 177 Cb 0.00 -1.85 0.17 0.00 -0.52 0.00 0.00 37.83 35.63 1y3n s LYS 177 CO 0.00 0.44 1.81 0.00 -0.92 0.00 0.00 175.35 176.69 1y3n n ALA 178 N 1.04 5.20 0.65 5.17 0.00 -1.26 -4.54 120.51 126.76 1y3n n ALA 178 Ca -0.18 -4.33 0.07 0.00 0.00 0.00 0.00 53.44 49.00 1y3n n ALA 178 Cb 0.53 -2.96 -0.05 0.00 0.00 0.00 0.00 19.45 16.96 1y3n n ALA 178 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1y3n n ASP 179 N 3.95 0.92 -4.77 0.00 3.85 -1.26 -5.02 116.55 114.22 1y3n n ASP 179 Ca 0.39 -0.96 -0.41 0.00 -0.71 0.00 0.00 54.79 53.10 1y3n n ASP 179 Cb 0.37 0.83 -0.01 0.00 -1.35 0.00 0.00 41.12 40.96 1y3n n ASP 179 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1y3n s GLU 180 N -2.12 4.27 -0.31 0.11 8.01 -1.26 -4.86 118.70 122.54 1y3n s GLU 180 Ca 0.07 2.34 0.03 0.00 0.01 0.00 0.00 54.97 57.42 1y3n s GLU 180 Cb 0.11 -3.03 0.09 0.00 -4.31 0.00 0.00 34.13 26.98 1y3n s GLU 180 CO 0.50 -0.31 0.02 0.42 0.01 0.00 0.00 175.26 175.90 1y3n s ILE 181 N -1.13 1.97 0.11 -1.63 1.01 0.32 -4.74 121.20 117.11 1y3n s ILE 181 Ca 0.50 -1.96 -0.30 0.00 0.00 0.00 0.00 60.65 58.89 1y3n s ILE 181 Cb -0.42 -2.37 -0.11 0.00 0.01 0.00 0.00 42.46 39.57 1y3n s ILE 181 CO 0.56 -0.46 1.49 -0.65 0.00 0.00 0.00 174.94 175.88 1y3n h PRO 182 N 7.75 -0.44 -5.16 2.79 0.11 -1.78 -2.43 132.00 132.84 1y3n h PRO 182 Ca -0.10 0.03 -0.66 0.00 0.11 0.00 0.00 66.00 65.39 1y3n h PRO 182 Cb 1.03 0.10 -0.29 0.00 0.11 0.00 0.00 31.00 31.95 1y3n h PRO 182 CO 0.49 -0.29 -0.77 0.12 -0.21 0.00 0.00 178.00 177.34 1y3n s PHE 183 N -5.37 2.85 0.27 0.65 2.19 -0.35 -0.01 117.98 118.22 1y3n s PHE 183 Ca -0.13 -0.91 0.08 0.00 0.33 0.00 0.00 56.93 56.29 1y3n s PHE 183 Cb 0.07 -1.95 -0.06 0.00 -1.31 0.00 0.00 43.02 39.78 1y3n s PHE 183 CO 0.54 -0.43 -0.09 0.96 1.83 0.00 0.00 175.22 178.03 1y3n s ILE 184 N 0.90 1.79 -0.28 3.12 -5.25 -0.09 -1.23 121.20 120.16 1y3n s ILE 184 Ca -0.03 -2.17 -0.21 0.00 -0.99 0.00 0.00 60.65 57.25 1y3n s ILE 184 Cb -0.15 -2.39 0.13 0.00 2.95 0.00 0.00 42.46 43.00 1y3n s ILE 184 CO -0.00 -0.35 0.99 0.21 -1.79 0.00 0.00 174.94 174.00 1y3n s ASN 185 N -3.45 -0.50 0.44 4.36 2.47 -1.26 -4.24 114.94 112.76 1y3n s ASN 185 Ca 0.29 0.89 0.12 0.00 0.42 0.00 0.00 52.86 54.57 1y3n s ASN 185 Cb 0.02 1.04 0.96 0.00 -1.45 0.00 0.00 41.25 41.83 1y3n s ASN 185 CO 0.12 -0.15 2.01 0.03 -3.72 0.00 0.00 177.10 175.39 1y3n h ARG 186 N 5.11 0.16 -4.90 0.43 3.08 -1.91 -3.41 114.38 112.94 1y3n h ARG 186 Ca -0.28 -0.02 -0.66 0.00 0.07 0.00 0.00 59.98 59.08 1y3n h ARG 186 Cb 1.19 -0.03 -0.24 0.00 0.08 0.00 0.00 29.97 30.97 1y3n h ARG 186 CO 0.15 0.23 -0.62 -0.51 -1.07 0.00 0.00 179.97 178.15 1y3n s ASP 187 N -6.93 5.13 0.44 7.04 1.11 -1.26 -3.77 116.67 118.42 1y3n s ASP 187 Ca -0.05 -0.36 0.13 0.00 0.18 0.00 0.00 52.55 52.44 1y3n s ASP 187 Cb 0.16 -1.91 1.02 0.00 1.07 0.00 0.00 42.92 43.26 1y3n s ASP 187 CO 0.71 -0.09 2.00 -0.65 1.18 0.00 0.00 175.17 178.32 1y3n h PRO 188 N 8.24 0.39 0.00 8.23 0.11 -1.81 -0.85 132.00 146.33 1y3n h PRO 188 Ca -0.36 -0.02 -0.00 0.00 0.11 0.00 0.00 66.00 65.72 1y3n h PRO 188 Cb 1.16 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 32.18 1y3n h PRO 188 CO 0.59 0.26 -0.01 0.93 -0.21 0.00 0.00 178.00 179.56 1y3n h GLU 189 N 0.41 0.00 0.00 1.05 3.07 -1.93 -1.26 114.58 115.92 1y3n h GLU 189 Ca 0.25 0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 59.08 1y3n h GLU 189 Cb 0.44 0.00 -0.00 0.00 -0.84 0.00 0.00 28.75 28.35 1y3n h GLU 189 CO -0.06 0.01 -0.10 0.93 -1.40 0.00 0.00 179.01 178.38 1y3n h GLU 190 N 0.00 0.00 -0.12 2.33 4.39 -1.56 -2.14 114.58 117.48 1y3n h GLU 190 Ca -0.00 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.62 1y3n h GLU 190 Cb 0.04 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.68 1y3n h GLU 190 CO 0.00 0.10 -0.30 -0.24 -1.16 0.00 0.00 179.01 177.41 1y3n h VAL 191 N 0.00 1.26 -0.15 3.13 3.04 -1.38 -2.15 116.25 120.00 1y3n h VAL 191 Ca -0.00 -1.23 -0.14 0.00 -1.01 0.00 0.00 66.70 64.33 1y3n h VAL 191 Cb 0.51 1.50 -0.01 0.00 -2.01 0.00 0.00 31.29 31.28 1y3n h VAL 191 CO 0.01 0.37 -0.49 -0.26 -1.01 0.00 0.00 177.57 176.19 1y3n h PHE 192 N 0.20 0.49 0.00 3.17 0.05 -1.54 -2.81 116.94 116.50 1y3n h PHE 192 Ca 0.03 -0.16 0.00 0.00 3.82 0.00 0.00 57.97 61.66 1y3n h PHE 192 Cb 0.64 -0.10 0.00 0.00 2.00 0.00 0.00 35.95 38.49 1y3n h PHE 192 CO 0.01 0.82 0.00 -0.09 -0.18 0.00 0.00 178.31 178.86 1y3n h ARG 193 N 0.32 0.00 0.00 1.51 2.43 -1.23 -2.26 114.38 115.16 1y3n h ARG 193 Ca 0.02 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.19 1y3n h ARG 193 Cb 0.98 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.53 1y3n h ARG 193 CO 0.08 0.00 0.00 -0.07 -1.51 0.00 0.00 179.97 178.47 1y3n h LEU 194 N 0.00 0.00 -0.60 3.80 3.38 -1.37 -1.15 115.31 119.37 1y3n h LEU 194 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1y3n h LEU 194 Cb 0.24 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1y3n h LEU 194 CO 0.00 0.00 0.00 1.33 0.09 0.00 0.00 178.44 179.86 1y3n n VAL 195 N -2.38 1.13 0.13 1.22 0.24 -0.85 -1.30 118.33 116.52 1y3n n VAL 195 Ca 0.00 0.41 0.05 0.00 -2.04 0.00 0.00 64.34 62.76 1y3n n VAL 195 Cb 0.15 -1.33 0.49 0.00 -1.47 0.00 0.00 33.84 31.69 1y3n n VAL 195 CO 0.00 0.00 0.00 0.78 -2.14 0.00 0.00 176.83 175.47 1y3n h ASN 196 N 0.00 0.22 0.31 -1.34 2.35 -0.98 -0.90 115.58 115.25 1y3n h ASN 196 Ca 0.00 -0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.73 1y3n h ASN 196 Cb 0.18 -0.05 -0.00 0.00 0.05 0.00 0.00 38.32 38.50 1y3n h ASN 196 CO 0.00 0.23 -0.00 -0.26 -1.65 0.00 0.00 177.43 175.75 1y3n h PHE 197 N 0.24 0.00 -0.29 1.19 0.04 -1.42 -2.14 116.94 114.57 1y3n h PHE 197 Ca 0.06 0.00 -0.17 0.00 2.80 0.00 0.00 57.97 60.67 1y3n h PHE 197 Cb 0.11 0.00 -0.10 0.00 2.20 0.00 0.00 35.95 38.15 1y3n h PHE 197 CO 0.00 0.00 -0.26 0.91 -0.60 0.00 0.00 178.31 178.37 1y3n n TRP 198 N -3.11 0.92 -1.14 -0.55 8.01 -0.40 -2.12 117.44 119.05 1y3n n TRP 198 Ca -0.02 -1.66 -0.05 0.00 -1.31 0.00 0.00 57.50 54.46 1y3n n TRP 198 Cb 0.14 -0.43 -0.02 0.00 -2.01 0.00 0.00 31.31 29.00 1y3n n TRP 198 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1y3n n GLY 199 N -1.09 0.73 3.51 6.99 0.00 -0.80 -4.76 105.19 109.76 1y3n n GLY 199 Ca 0.30 -0.43 -0.30 0.00 0.00 0.00 0.00 46.02 45.59 1y3n n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3n s ALA 200 N -2.04 2.74 0.43 4.61 0.00 -0.86 -4.98 121.76 121.66 1y3n s ALA 200 Ca 0.00 -1.22 -0.06 0.00 0.00 0.00 0.00 51.96 50.68 1y3n s ALA 200 Cb 0.00 -0.80 -0.04 0.00 0.00 0.00 0.00 23.12 22.28 1y3n s ALA 200 CO 0.00 0.60 0.73 1.03 0.00 0.00 0.00 175.76 178.12 1y3n s ARG 201 N -1.76 3.61 0.00 0.00 1.81 -1.26 -2.68 118.95 118.67 1y3n s ARG 201 Ca 0.17 0.20 0.00 0.00 -1.72 0.00 0.00 55.73 54.38 1y3n s ARG 201 Cb -0.11 -2.44 0.00 0.00 -0.45 0.00 0.00 34.95 31.96 1y3n s ARG 201 CO 0.08 -0.08 0.00 -1.13 -0.68 0.00 0.00 175.30 173.49 1y3n n SER 202 N -1.82 4.73 -3.59 0.23 3.41 -1.26 -4.70 113.62 110.61 1y3n n SER 202 Ca 0.00 0.00 -0.09 0.00 -0.26 0.00 0.00 58.87 58.52 1y3n n SER 202 Cb 0.55 0.89 -0.05 0.00 -0.26 0.00 0.00 64.21 65.34 1y3n n SER 202 CO 0.00 0.00 0.00 0.28 -0.16 0.00 0.00 175.04 175.16 1y3n s THR 203 N -1.90 0.00 -1.35 6.66 -1.32 -1.26 -4.27 115.64 112.19 1y3n s THR 203 Ca 0.00 0.00 0.27 0.00 -1.21 0.00 0.00 61.69 60.75 1y3n s THR 203 Cb 0.00 -1.00 0.23 0.00 -1.51 0.00 0.00 72.50 70.22 1y3n s THR 203 CO 0.00 0.00 1.66 0.61 -2.21 0.00 0.00 174.62 174.68 1y3n n GLY 204 N 0.80 -1.06 1.10 6.08 0.00 -0.68 -4.88 105.19 106.55 1y3n n GLY 204 Ca -0.09 -0.30 -0.03 0.00 0.00 0.00 0.00 46.02 45.61 1y3n n GLY 204 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1y3n n SER 205 N -1.16 -0.65 0.18 1.61 3.41 -1.26 -0.89 113.62 114.86 1y3n n SER 205 Ca 0.10 -1.48 0.13 0.00 -0.26 0.00 0.00 58.87 57.36 1y3n n SER 205 Cb 0.32 1.09 0.61 0.00 -0.26 0.00 0.00 64.21 65.97 1y3n n SER 205 CO 0.00 0.00 0.00 -1.13 -0.16 0.00 0.00 175.04 173.75 1y3n h ASN 206 N 0.58 0.00 -3.27 4.04 -0.73 -1.89 -3.41 115.58 110.91 1y3n h ASN 206 Ca -0.10 0.00 -0.55 0.00 1.87 0.00 0.00 56.30 57.52 1y3n h ASN 206 Cb 0.36 0.00 -0.03 0.00 0.27 0.00 0.00 38.32 38.92 1y3n h ASN 206 CO 0.12 0.00 0.54 -0.89 -0.37 0.00 0.00 177.43 176.83 1y3n s THR 207 N -3.51 4.72 0.46 -3.57 2.01 -1.26 -4.99 115.64 109.51 1y3n s THR 207 Ca 0.01 1.98 -0.24 0.00 0.31 0.00 0.00 61.69 63.74 1y3n s THR 207 Cb 0.09 -4.27 -0.08 0.00 0.01 0.00 0.00 72.50 68.25 1y3n s THR 207 CO 0.35 0.04 1.34 0.79 -0.69 0.00 0.00 174.62 176.45 1y3n n TRP 208 N 4.76 2.33 -4.03 4.92 5.03 -1.26 -3.17 117.44 126.02 1y3n n TRP 208 Ca 0.08 0.46 -0.27 0.00 3.03 0.00 0.00 57.50 60.81 1y3n n TRP 208 Cb 0.49 -2.40 -0.04 0.00 -1.03 0.00 0.00 31.31 28.33 1y3n n TRP 208 CO 0.00 0.00 0.00 -1.33 -0.03 0.00 0.00 177.69 176.33 1y3n n MET 209 N -0.30 -2.78 -3.41 -0.99 2.81 -1.26 -4.96 117.12 106.23 1y3n n MET 209 Ca 0.07 0.34 -0.27 0.00 -1.81 0.00 0.00 57.70 56.03 1y3n n MET 209 Cb 0.42 -4.32 -0.02 0.00 -0.71 0.00 0.00 33.22 28.58 1y3n n MET 209 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1y3n s ASP 210 N -4.38 6.37 0.93 7.83 3.68 -1.19 -4.95 116.67 124.97 1y3n s ASP 210 Ca 0.00 0.56 -0.12 0.00 2.13 0.00 0.00 52.55 55.11 1y3n s ASP 210 Cb -0.00 -2.08 0.15 0.00 -1.45 0.00 0.00 42.92 39.54 1y3n s ASP 210 CO 0.91 -0.21 1.13 -0.36 0.13 0.00 0.00 175.17 176.77 1y3n s PHE 211 N -2.14 2.39 0.18 -5.34 0.40 -1.26 -1.68 117.98 110.53 1y3n s PHE 211 Ca 0.41 0.85 -0.06 0.00 -0.60 0.00 0.00 56.93 57.54 1y3n s PHE 211 Cb -0.10 -3.38 -0.02 0.00 0.51 0.00 0.00 43.02 40.02 1y3n s PHE 211 CO 0.32 -2.49 0.23 1.52 0.70 0.00 0.00 175.22 175.50 1y3n s TYR 212 N -3.23 0.67 -0.05 0.36 1.13 -0.27 -3.08 117.35 112.87 1y3n s TYR 212 Ca 0.64 -1.00 0.06 0.00 -1.41 0.00 0.00 57.07 55.36 1y3n s TYR 212 Cb -0.15 -0.23 -0.02 0.00 -1.10 0.00 0.00 41.96 40.46 1y3n s TYR 212 CO 0.54 -0.70 -0.22 0.08 -2.51 0.00 0.00 175.55 172.74 1y3n s VAL 213 N -4.04 2.37 -0.10 -3.49 1.01 -1.26 -0.63 120.40 114.25 1y3n s VAL 213 Ca 0.24 -0.97 -0.04 0.00 0.00 0.00 0.00 61.98 61.22 1y3n s VAL 213 Cb 0.04 -1.87 0.05 0.00 0.00 0.00 0.00 36.38 34.60 1y3n s VAL 213 CO 0.05 0.58 0.16 -0.70 0.00 0.00 0.00 175.10 175.18 1y3n s GLU 214 N -0.43 0.05 -1.35 2.72 2.12 -0.53 -4.88 118.70 116.41 1y3n s GLU 214 Ca 0.04 0.48 -0.04 0.00 0.36 0.00 0.00 54.97 55.81 1y3n s GLU 214 Cb -0.12 -0.48 0.02 0.00 0.26 0.00 0.00 34.13 33.81 1y3n s GLU 214 CO 0.01 -0.37 0.87 -1.71 -0.54 0.00 0.00 175.26 173.52 1y3n n ASN 215 N 5.32 -2.77 -0.24 -1.70 5.15 -1.26 -1.78 115.26 117.98 1y3n n ASN 215 Ca -0.05 -0.75 -0.03 0.00 -0.60 0.00 0.00 54.58 53.15 1y3n n ASN 215 Cb 0.50 -4.30 -0.01 0.00 -0.53 0.00 0.00 39.78 35.44 1y3n n ASN 215 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1y3n n GLY 216 N -1.58 0.54 3.18 8.20 0.00 -1.26 -5.00 105.19 109.27 1y3n n GLY 216 Ca -0.18 -0.18 -0.31 0.00 0.00 0.00 0.00 46.02 45.35 1y3n n GLY 216 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3n s LYS 217 N -1.54 2.81 0.17 1.61 1.02 -0.73 -4.96 119.74 118.12 1y3n s LYS 217 Ca 0.00 -0.80 -0.30 0.00 0.02 0.00 0.00 55.97 54.89 1y3n s LYS 217 Cb 0.00 -2.15 -0.08 0.00 -0.52 0.00 0.00 37.83 35.08 1y3n s LYS 217 CO 0.00 0.14 1.12 0.42 -0.92 0.00 0.00 175.35 176.12 1y3n s ILE 218 N 0.42 3.82 0.05 2.17 -1.09 -1.26 -1.45 121.20 123.86 1y3n s ILE 218 Ca -0.18 1.55 -0.03 0.00 -2.23 0.00 0.00 60.65 59.76 1y3n s ILE 218 Cb -0.18 -3.99 -0.03 0.00 -1.58 0.00 0.00 42.46 36.69 1y3n s ILE 218 CO 0.08 0.26 0.03 -0.54 -1.23 0.00 0.00 174.94 173.54 1y3n s LYS 219 N -0.29 0.64 -0.13 2.79 1.02 0.20 -4.96 119.74 118.99 1y3n s LYS 219 Ca 0.50 -1.06 0.03 0.00 0.02 0.00 0.00 55.97 55.46 1y3n s LYS 219 Cb -0.30 0.23 0.01 0.00 -0.52 0.00 0.00 37.83 37.25 1y3n s LYS 219 CO 0.35 -0.14 -0.22 -1.58 -0.92 0.00 0.00 175.35 172.84 1y3n s HIS 220 N -3.57 2.63 0.24 3.18 5.65 -1.26 -1.12 115.29 121.04 1y3n s HIS 220 Ca 0.03 -1.30 -0.14 0.00 0.25 0.00 0.00 55.06 53.91 1y3n s HIS 220 Cb 0.05 -1.79 0.31 0.00 -1.18 0.00 0.00 32.58 29.98 1y3n s HIS 220 CO -0.09 -0.59 1.56 -1.35 -0.65 0.00 0.00 174.74 173.62 1y3n h PRO 221 N 7.26 -0.01 0.00 2.88 0.11 -1.84 -1.24 132.00 139.16 1y3n h PRO 221 Ca -0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.80 1y3n h PRO 221 Cb 1.19 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1y3n h PRO 221 CO 0.54 -0.01 0.00 1.19 -0.21 0.00 0.00 178.00 179.51 1y3n n PHE 222 N -5.53 0.00 0.79 0.65 3.01 -1.26 -2.69 117.46 112.43 1y3n n PHE 222 Ca 0.12 0.00 0.09 0.00 1.01 0.00 0.00 57.45 58.67 1y3n n PHE 222 Cb 0.43 -0.45 -0.11 0.00 -0.01 0.00 0.00 39.48 39.34 1y3n n PHE 222 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1y3n n ALA 223 N -1.45 4.26 -1.78 4.37 0.00 -0.47 -4.93 120.51 120.51 1y3n n ALA 223 Ca 0.04 -0.51 -0.37 0.00 0.00 0.00 0.00 53.44 52.59 1y3n n ALA 223 Cb 0.13 -0.67 -0.06 0.00 0.00 0.00 0.00 19.45 18.86 1y3n n ALA 223 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1y3n s GLU 224 N -2.78 4.50 0.51 0.00 0.41 -1.10 -4.94 118.70 115.30 1y3n s GLU 224 Ca 0.06 1.42 0.18 0.00 -0.41 0.00 0.00 54.97 56.21 1y3n s GLU 224 Cb 0.14 -2.78 1.29 0.00 -1.78 0.00 0.00 34.13 31.00 1y3n s GLU 224 CO 0.76 0.18 2.13 0.28 -0.49 0.00 0.00 175.26 178.12 1y3n h VAL 225 N 2.56 0.95 -0.22 2.63 2.07 -1.94 -0.02 116.25 122.29 1y3n h VAL 225 Ca -0.47 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.91 1y3n h VAL 225 Cb 1.20 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 32.03 1y3n h VAL 225 CO 0.65 0.04 0.12 0.00 0.02 0.00 0.00 177.57 178.39 1y3n h ALA 226 N 1.96 1.79 -0.38 1.67 0.00 -1.92 -1.61 119.26 120.77 1y3n h ALA 226 Ca -0.00 -0.04 -0.16 0.00 0.00 0.00 0.00 54.91 54.71 1y3n h ALA 226 Cb 0.07 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 1y3n h ALA 226 CO 0.01 0.18 -0.39 0.35 0.00 0.00 0.00 179.25 179.40 1y3n h PHE 227 N 0.31 1.11 0.03 0.00 3.04 -1.22 0.31 116.94 120.52 1y3n h PHE 227 Ca 0.08 -0.33 0.02 0.00 3.98 0.00 0.00 57.97 61.71 1y3n h PHE 227 Cb 0.02 -0.23 -0.02 0.00 2.56 0.00 0.00 35.95 38.27 1y3n h PHE 227 CO 0.00 1.16 -0.14 -0.22 -2.02 0.00 0.00 178.31 177.10 1y3n h LYS 228 N 0.76 -0.24 -0.58 1.11 3.64 -1.22 0.26 116.57 120.30 1y3n h LYS 228 Ca 0.06 0.02 -0.09 0.00 -1.27 0.00 0.00 60.65 59.37 1y3n h LYS 228 Cb 0.98 0.05 -0.02 0.00 -0.41 0.00 0.00 32.23 32.84 1y3n h LYS 228 CO 0.10 -0.16 0.03 -0.44 -2.27 0.00 0.00 179.45 176.70 1y3n h ASP 229 N -0.25 0.98 -0.36 4.20 3.45 -1.38 -2.88 116.42 120.19 1y3n h ASP 229 Ca 0.04 -0.29 -0.10 0.00 0.43 0.00 0.00 57.03 57.10 1y3n h ASP 229 Cb 0.29 -0.26 -0.01 0.00 -0.56 0.00 0.00 39.33 38.79 1y3n h ASP 229 CO -0.11 1.03 -0.16 1.23 -1.57 0.00 0.00 179.24 179.66 1y3n h GLY 230 N 0.90 0.81 2.00 2.75 0.00 -0.63 -2.98 103.07 105.91 1y3n h GLY 230 Ca 0.17 -0.72 -0.01 0.00 0.00 0.00 0.00 47.33 46.77 1y3n h GLY 230 CO 0.02 0.65 -0.07 1.19 0.00 0.00 0.00 176.54 178.34 1y3n h ILE 231 N 0.53 0.23 -0.40 2.60 6.09 -0.48 -1.45 117.51 124.63 1y3n h ILE 231 Ca 0.08 -0.53 -0.11 0.00 -1.37 0.00 0.00 64.86 62.93 1y3n h ILE 231 Cb 0.70 1.43 -0.01 0.00 0.47 0.00 0.00 36.82 39.40 1y3n h ILE 231 CO 0.05 0.07 -0.20 0.50 -3.07 0.00 0.00 178.15 175.49 1y3n h LYS 232 N 0.00 0.77 -0.34 2.19 3.64 -1.35 -0.04 116.57 121.45 1y3n h LYS 232 Ca -0.00 -0.30 -0.17 0.00 -1.27 0.00 0.00 60.65 58.90 1y3n h LYS 232 Cb 0.42 -0.04 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1y3n h LYS 232 CO 0.01 0.92 -0.46 0.45 -2.27 0.00 0.00 179.45 178.10 1y3n h HIS 233 N 0.68 1.11 -0.63 1.91 3.86 -1.27 -1.99 115.15 118.82 1y3n h HIS 233 Ca 0.10 -0.36 -0.05 0.00 -1.16 0.00 0.00 60.37 58.90 1y3n h HIS 233 Cb 0.71 -0.22 -0.03 0.00 1.06 0.00 0.00 27.41 28.93 1y3n h HIS 233 CO 0.04 1.19 0.20 0.28 0.86 0.00 0.00 177.93 180.50 1y3n h VAL 234 N 0.72 1.24 -0.86 2.45 2.07 -1.20 -1.49 116.25 119.19 1y3n h VAL 234 Ca 0.04 -0.82 0.01 0.00 0.82 0.00 0.00 66.70 66.74 1y3n h VAL 234 Cb 1.06 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 31.38 1y3n h VAL 234 CO 0.11 0.32 0.57 0.00 0.02 0.00 0.00 177.57 178.58 1y3n h ALA 235 N 1.07 1.37 -0.43 1.67 0.00 -0.87 0.34 119.26 122.41 1y3n h ALA 235 Ca 0.20 -0.07 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 1y3n h ALA 235 Cb 0.28 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1y3n h ALA 235 CO -0.01 0.58 0.02 0.37 0.00 0.00 0.00 179.25 180.21 1y3n h GLN 236 N 1.17 0.75 -0.42 0.00 5.75 -0.78 0.13 115.11 121.71 1y3n h GLN 236 Ca 0.32 -0.23 -0.06 0.00 -0.15 0.00 0.00 58.65 58.53 1y3n h GLN 236 Cb -0.12 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.33 1y3n h GLN 236 CO -0.07 0.81 0.02 -1.49 -2.65 0.00 0.00 178.83 175.45 1y3n h TRP 237 N 0.59 0.70 -0.40 3.99 4.06 -0.71 -0.93 115.95 123.25 1y3n h TRP 237 Ca 0.12 -0.08 -0.14 0.00 2.06 0.00 0.00 58.89 60.86 1y3n h TRP 237 Cb 0.46 -0.20 -0.01 0.00 -1.00 0.00 0.00 29.16 28.41 1y3n h TRP 237 CO 0.03 0.66 -0.29 -0.92 -3.56 0.00 0.00 178.44 174.36 1y3n h TYR 238 N 0.64 1.07 -0.84 0.49 5.03 -0.62 -0.15 116.97 122.59 1y3n h TYR 238 Ca 0.13 -0.29 0.02 0.00 2.58 0.00 0.00 58.73 61.17 1y3n h TYR 238 Cb 0.37 -0.24 -0.05 0.00 1.55 0.00 0.00 36.73 38.37 1y3n h TYR 238 CO 0.02 1.10 0.55 -0.22 -1.32 0.00 0.00 178.16 178.28 1y3n h LYS 239 N 0.73 1.06 -0.00 1.82 3.64 -0.20 -1.61 116.57 122.00 1y3n h LYS 239 Ca 0.08 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.39 1y3n h LYS 239 Cb 0.87 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1y3n h LYS 239 CO 0.08 0.70 0.00 0.39 -2.27 0.00 0.00 179.45 178.35 1y3n n GLU 240 N -4.53 1.03 -1.14 1.90 1.02 -0.40 -4.89 120.64 113.62 1y3n n GLU 240 Ca 0.09 -0.04 -0.05 0.00 -0.02 0.00 0.00 57.16 57.15 1y3n n GLU 240 Cb 0.05 -1.39 -0.02 0.00 -0.02 0.00 0.00 31.44 30.05 1y3n n GLU 240 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1y3n n GLY 241 N 0.90 0.75 0.16 0.62 0.00 -0.61 -4.89 105.19 102.13 1y3n n GLY 241 Ca 0.19 -0.67 0.05 0.00 0.00 0.00 0.00 46.02 45.59 1y3n n GLY 241 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1y3n h LEU 242 N 0.00 0.00 -9.05 0.99 3.38 -1.25 -3.41 115.31 105.97 1y3n h LEU 242 Ca -0.10 0.00 -0.66 0.00 0.09 0.00 0.00 57.88 57.21 1y3n h LEU 242 Cb 0.36 0.00 -0.19 0.00 0.09 0.00 0.00 40.66 40.92 1y3n h LEU 242 CO 0.15 0.38 -0.66 -0.63 0.09 0.00 0.00 178.44 177.77 1y3n s ILE 243 N -3.08 4.00 -0.33 1.22 1.01 -1.20 -1.21 121.20 121.62 1y3n s ILE 243 Ca 0.04 -0.34 -0.44 0.00 0.00 0.00 0.00 60.65 59.91 1y3n s ILE 243 Cb 0.07 -2.70 -0.19 0.00 0.01 0.00 0.00 42.46 39.65 1y3n s ILE 243 CO 0.72 0.55 1.53 -0.67 0.00 0.00 0.00 174.94 177.07 1y3n n ASP 244 N 2.77 1.31 0.28 3.58 4.64 -0.36 -4.80 116.55 123.96 1y3n n ASP 244 Ca -0.18 1.15 0.13 0.00 -1.38 0.00 0.00 54.79 54.51 1y3n n ASP 244 Cb 0.53 -0.97 0.79 0.00 -1.04 0.00 0.00 41.12 40.44 1y3n n ASP 244 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1y3n h PRO 245 N 5.16 0.00 -0.65 -0.67 0.13 -1.91 -1.63 132.00 132.42 1y3n h PRO 245 Ca -0.46 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.67 1y3n h PRO 245 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1y3n h PRO 245 CO 0.91 0.06 0.00 0.39 -0.23 0.00 0.00 178.00 179.13 1y3n n GLU 246 N -3.84 3.88 -0.12 0.86 -0.58 -1.26 -4.63 120.64 114.94 1y3n n GLU 246 Ca -0.02 -2.50 0.27 0.00 -0.42 0.00 0.00 57.16 54.48 1y3n n GLU 246 Cb 0.16 -2.02 0.72 0.00 -0.57 0.00 0.00 31.44 29.73 1y3n n GLU 246 CO 0.00 0.00 0.00 0.97 -0.48 0.00 0.00 177.13 177.62 1y3n h ILE 247 N 3.31 0.52 -0.00 -3.67 6.09 -1.65 0.22 117.51 122.32 1y3n h ILE 247 Ca 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 1y3n h ILE 247 Cb 1.56 0.57 0.00 0.00 0.47 0.00 0.00 36.82 39.41 1y3n h ILE 247 CO 0.33 0.00 -0.49 0.49 -3.07 0.00 0.00 178.15 175.42 1y3n n PHE 248 N -4.15 0.00 0.00 2.19 3.01 -1.26 -4.01 117.46 113.23 1y3n n PHE 248 Ca 0.16 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.62 1y3n n PHE 248 Cb 0.90 -0.17 0.00 0.00 -0.01 0.00 0.00 39.48 40.20 1y3n n PHE 248 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1y3n n THR 249 N -1.16 0.00 0.50 4.37 -2.24 0.27 -4.84 114.28 111.17 1y3n n THR 249 Ca 0.07 0.00 -0.20 0.00 -2.27 0.00 0.00 64.05 61.65 1y3n n THR 249 Cb 0.35 -0.93 -0.10 0.00 -2.10 0.00 0.00 70.33 67.55 1y3n n THR 249 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1y3n h ARG 250 N 0.00 -1.24 0.00 -0.78 2.43 -0.93 -3.47 114.38 110.39 1y3n h ARG 250 Ca 0.00 0.08 0.00 0.00 -0.81 0.00 0.00 59.98 59.25 1y3n h ARG 250 Cb 0.95 0.28 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1y3n h ARG 250 CO 0.00 -0.83 0.00 1.63 -1.51 0.00 0.00 179.97 179.26 1y3n n LYS 251 N -5.65 0.00 -0.24 0.20 5.02 -1.26 -4.39 118.16 111.84 1y3n n LYS 251 Ca -0.16 0.00 0.03 0.00 -2.02 0.00 0.00 58.31 56.15 1y3n n LYS 251 Cb 0.51 0.00 0.07 0.00 -0.02 0.00 0.00 35.03 35.60 1y3n n LYS 251 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y3n n ALA 252 N 11.40 0.09 -1.18 7.82 0.00 -1.25 -1.09 120.51 136.31 1y3n n ALA 252 Ca 0.00 0.70 -0.16 0.00 0.00 0.00 0.00 53.44 53.99 1y3n n ALA 252 Cb 0.00 -0.39 0.23 0.00 0.00 0.00 0.00 19.45 19.29 1y3n n ALA 252 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1y3n n ARG 253 N -5.04 2.78 -0.28 0.00 1.74 -1.26 -4.62 116.66 109.98 1y3n n ARG 253 Ca 0.09 -3.05 0.06 0.00 -0.77 0.00 0.00 57.85 54.18 1y3n n ARG 253 Cb 0.31 -2.17 0.28 0.00 -1.02 0.00 0.00 32.46 29.86 1y3n n ARG 253 CO 0.00 0.00 0.00 0.77 -1.52 0.00 0.00 177.63 176.88 1y3n h SER 254 N 1.63 0.84 -0.09 0.55 0.02 -1.37 -1.65 113.55 113.47 1y3n h SER 254 Ca 0.47 0.01 -0.04 0.00 -0.84 0.00 0.00 61.79 61.39 1y3n h SER 254 Cb 2.58 -0.16 -0.00 0.00 0.14 0.00 0.00 62.40 64.96 1y3n h SER 254 CO 0.92 0.52 -0.11 0.03 -1.14 0.00 0.00 176.83 177.05 1y3n h ARG 255 N 0.94 0.23 -0.87 3.45 3.08 -1.84 -0.93 114.38 118.44 1y3n h ARG 255 Ca 0.39 -0.13 0.06 0.00 0.07 0.00 0.00 59.98 60.38 1y3n h ARG 255 Cb 0.30 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 30.29 1y3n h ARG 255 CO -0.16 0.67 0.54 0.93 -1.07 0.00 0.00 179.97 180.89 1y3n h GLU 256 N -0.20 0.95 0.43 0.04 3.07 -1.84 -0.53 114.58 116.50 1y3n h GLU 256 Ca 0.01 -0.06 -0.02 0.00 -0.50 0.00 0.00 59.36 58.79 1y3n h GLU 256 Cb 0.64 -0.22 0.00 0.00 -0.84 0.00 0.00 28.75 28.34 1y3n h GLU 256 CO 0.03 0.63 -0.20 1.96 -1.40 0.00 0.00 179.01 180.02 1y3n h GLN 257 N 0.98 -0.55 0.04 2.33 4.20 -1.28 -2.26 115.11 118.57 1y3n h GLN 257 Ca 0.38 0.04 -0.24 0.00 0.06 0.00 0.00 58.65 58.89 1y3n h GLN 257 Cb 0.18 0.13 0.02 0.00 0.30 0.00 0.00 27.48 28.11 1y3n h GLN 257 CO -0.18 -0.28 -0.95 1.79 -0.67 0.00 0.00 178.83 178.54 1y3n h THR 258 N -1.06 1.34 -0.09 -0.54 1.35 -1.16 -1.60 112.91 111.14 1y3n h THR 258 Ca -0.06 -2.27 -0.21 0.00 -0.55 0.00 0.00 66.41 63.32 1y3n h THR 258 Cb 0.53 2.57 0.01 0.00 -1.73 0.00 0.00 68.15 69.53 1y3n h THR 258 CO 0.10 0.68 -0.77 -0.26 -0.25 0.00 0.00 175.52 175.02 1y3n h PHE 259 N 0.18 0.95 -0.60 4.73 0.05 -1.27 0.27 116.94 121.25 1y3n h PHE 259 Ca -0.13 -0.45 0.03 0.00 3.82 0.00 0.00 57.97 61.24 1y3n h PHE 259 Cb 1.64 -0.13 -0.03 0.00 2.00 0.00 0.00 35.95 39.42 1y3n h PHE 259 CO 0.12 1.28 0.40 0.78 -0.18 0.00 0.00 178.31 180.71 1y3n h GLY 260 N 0.36 0.81 -2.49 -1.45 0.00 -1.32 -0.79 103.07 98.19 1y3n h GLY 260 Ca -0.07 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 46.98 1y3n h GLY 260 CO 0.16 0.25 0.00 -2.01 0.00 0.00 0.00 176.54 174.94 1y3n n ASN 261 N -4.46 3.70 -3.76 0.19 4.05 -0.60 -4.96 115.26 109.42 1y3n n ASN 261 Ca 0.07 -2.15 -0.24 0.00 0.45 0.00 0.00 54.58 52.71 1y3n n ASN 261 Cb 0.12 -0.47 0.03 0.00 1.23 0.00 0.00 39.78 40.70 1y3n n ASN 261 CO 0.00 0.00 0.00 -3.20 -3.05 0.00 0.00 177.26 171.01 1y3n n ASN 262 N 1.20 -2.45 0.00 1.20 5.15 -0.30 -4.89 115.26 115.17 1y3n n ASN 262 Ca 0.22 -0.80 0.00 0.00 -0.60 0.00 0.00 54.58 53.40 1y3n n ASN 262 Cb 0.63 -4.04 0.00 0.00 -0.53 0.00 0.00 39.78 35.84 1y3n n ASN 262 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 1y3n n ILE 263 N -4.43 0.00 -3.53 -1.44 -5.35 0.84 -4.78 119.36 100.68 1y3n n ILE 263 Ca -0.19 -0.35 -0.37 0.00 -0.27 0.00 0.00 62.75 61.58 1y3n n ILE 263 Cb 0.63 1.12 -0.07 0.00 -1.74 0.00 0.00 39.64 39.58 1y3n n ILE 263 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1y3n s GLY 264 N -0.43 2.30 -0.01 3.28 0.00 -0.58 0.12 107.32 112.00 1y3n s GLY 264 Ca 0.00 -0.38 0.12 0.00 0.00 0.00 0.00 44.72 44.47 1y3n s GLY 264 CO 0.00 0.33 0.35 0.61 0.00 0.00 0.00 173.10 174.39 1y3n n GLY 265 N 2.84 -0.43 3.52 0.20 0.00 -0.91 -4.78 105.19 105.63 1y3n n GLY 265 Ca -0.12 -0.31 -0.11 0.00 0.00 0.00 0.00 46.02 45.48 1y3n n GLY 265 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1y3n s MET 266 N -2.63 0.81 0.38 1.61 -2.45 0.99 -1.24 119.30 116.77 1y3n s MET 266 Ca -0.02 -0.10 -0.15 0.00 -1.25 0.00 0.00 55.69 54.18 1y3n s MET 266 Cb 0.08 0.38 0.05 0.00 1.25 0.00 0.00 34.83 36.59 1y3n s MET 266 CO 0.51 -0.32 0.76 -0.08 1.05 0.00 0.00 175.02 176.94 1y3n s THR 267 N -2.29 0.00 -0.23 10.11 -1.32 -0.55 -0.91 115.64 120.46 1y3n s THR 267 Ca 0.01 -1.06 -0.04 0.00 -1.21 0.00 0.00 61.69 59.38 1y3n s THR 267 Cb -0.01 -2.83 0.08 0.00 -1.51 0.00 0.00 72.50 68.23 1y3n s THR 267 CO -0.04 0.00 0.11 -2.28 -2.21 0.00 0.00 174.62 170.20 1y3n s HIS 268 N -2.43 0.31 0.35 9.09 5.65 -1.26 -1.13 115.29 125.88 1y3n s HIS 268 Ca 0.17 -0.62 -0.12 0.00 0.25 0.00 0.00 55.06 54.74 1y3n s HIS 268 Cb -0.05 -0.82 0.03 0.00 -1.18 0.00 0.00 32.58 30.57 1y3n s HIS 268 CO 0.12 -0.67 0.67 0.34 -0.65 0.00 0.00 174.74 174.56 1y3n s ASP 269 N 2.10 0.23 0.29 9.88 -1.08 -0.88 -4.86 116.67 122.36 1y3n s ASP 269 Ca 0.05 -1.18 -0.30 0.00 -0.52 0.00 0.00 52.55 50.60 1y3n s ASP 269 Cb -0.16 0.77 -0.12 0.00 -1.46 0.00 0.00 42.92 41.95 1y3n s ASP 269 CO -0.22 -1.51 1.59 0.79 0.52 0.00 0.00 175.17 176.34 1y3n n TRP 270 N -0.52 2.83 -0.01 -5.34 7.02 -1.26 -1.70 117.44 118.46 1y3n n TRP 270 Ca -0.05 0.26 -0.09 0.00 -1.02 0.00 0.00 57.50 56.60 1y3n n TRP 270 Cb 0.60 -2.59 -0.03 0.00 -2.42 0.00 0.00 31.31 26.88 1y3n n TRP 270 CO 0.00 0.00 0.00 0.74 -2.02 0.00 0.00 177.69 176.41 1y3n h PHE 271 N 4.76 -0.39 0.98 -5.99 0.04 -1.84 -2.35 116.94 112.16 1y3n h PHE 271 Ca -0.47 0.02 -0.05 0.00 2.80 0.00 0.00 57.97 60.28 1y3n h PHE 271 Cb 1.23 0.20 0.01 0.00 2.20 0.00 0.00 35.95 39.58 1y3n h PHE 271 CO 0.58 -0.22 -0.47 0.00 -0.60 0.00 0.00 178.31 177.60 1y3n h ALA 272 N 0.91 -1.32 -0.28 2.45 0.00 -1.90 -1.74 119.26 117.37 1y3n h ALA 272 Ca 0.10 -0.29 -0.09 0.00 0.00 0.00 0.00 54.91 54.63 1y3n h ALA 272 Cb 0.33 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 18.62 1y3n h ALA 272 CO -0.26 -1.24 -0.21 0.66 0.00 0.00 0.00 179.25 178.20 1y3n h SER 273 N -1.33 0.53 -0.31 0.00 4.64 -1.89 -2.68 113.55 112.52 1y3n h SER 273 Ca -0.14 -0.17 -0.07 0.00 -0.47 0.00 0.00 61.79 60.94 1y3n h SER 273 Cb 1.01 -0.14 -0.01 0.00 -0.31 0.00 0.00 62.40 62.95 1y3n h SER 273 CO 0.22 0.74 -0.09 0.74 -0.87 0.00 0.00 176.83 177.57 1y3n h THR 274 N 0.47 1.28 0.00 2.95 2.02 -1.44 -2.89 112.91 115.31 1y3n h THR 274 Ca 0.07 -1.15 -0.02 0.00 0.77 0.00 0.00 66.41 66.08 1y3n h THR 274 Cb 0.63 1.40 -0.00 0.00 -1.74 0.00 0.00 68.15 68.43 1y3n h THR 274 CO 0.04 0.37 -0.09 0.00 0.37 0.00 0.00 175.52 176.22 1y3n h ALA 275 N 0.78 1.11 0.00 6.16 0.00 -1.27 -2.75 119.26 123.30 1y3n h ALA 275 Ca 0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.89 1y3n h ALA 275 Cb 0.59 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.37 1y3n h ALA 275 CO 0.03 0.11 -0.07 1.25 0.00 0.00 0.00 179.25 180.58 1y3n h LEU 276 N 0.00 0.00 -2.32 0.00 6.46 -1.25 -2.35 115.31 115.85 1y3n h LEU 276 Ca -0.00 0.00 -0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1y3n h LEU 276 Cb 0.41 0.00 -0.00 0.00 -0.73 0.00 0.00 40.66 40.34 1y3n h LEU 276 CO 0.01 0.07 -0.02 -0.26 -0.62 0.00 0.00 178.44 177.62 1y3n h PHE 277 N 0.00 0.00 -0.50 1.25 0.04 -1.59 -0.89 116.94 115.26 1y3n h PHE 277 Ca -0.00 0.00 -0.10 0.00 2.80 0.00 0.00 57.97 60.67 1y3n h PHE 277 Cb 0.16 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.29 1y3n h PHE 277 CO 0.00 0.02 -0.08 -0.91 -0.60 0.00 0.00 178.31 176.74 1y3n h ASN 278 N 0.00 0.88 0.16 2.17 2.35 -1.64 -1.13 115.58 118.37 1y3n h ASN 278 Ca -0.00 -0.26 -0.28 0.00 -0.55 0.00 0.00 56.30 55.21 1y3n h ASN 278 Cb 0.22 -0.24 0.03 0.00 0.05 0.00 0.00 38.32 38.38 1y3n h ASN 278 CO 0.00 0.98 -1.18 0.44 -1.65 0.00 0.00 177.43 176.03 1y3n h ASP 279 N 0.81 0.76 0.07 5.81 3.32 -1.38 -2.87 116.42 122.94 1y3n h ASP 279 Ca 0.14 -0.88 -0.08 0.00 0.02 0.00 0.00 57.03 56.23 1y3n h ASP 279 Cb 0.59 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 1y3n h ASP 279 CO 0.04 1.57 -0.26 0.00 -1.72 0.00 0.00 179.24 178.87 1y3n h ALA 280 N 0.20 1.26 -0.17 3.45 0.00 -1.20 -3.16 119.26 119.63 1y3n h ALA 280 Ca -0.19 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.40 1y3n h ALA 280 Cb 1.89 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.58 1y3n h ALA 280 CO 0.22 0.49 0.00 1.28 0.00 0.00 0.00 179.25 181.25 1y3n n LEU 281 N -4.14 3.09 -0.19 0.00 4.77 -0.43 -4.55 117.00 115.55 1y3n n LEU 281 Ca -0.01 -1.22 0.13 0.00 -0.03 0.00 0.00 56.01 54.89 1y3n n LEU 281 Cb 0.38 -0.10 0.45 0.00 -2.33 0.00 0.00 43.42 41.82 1y3n n LEU 281 CO 0.40 0.59 1.21 -1.28 -1.33 0.00 0.00 177.39 176.98 1y3n h SER 282 N 4.34 0.49 -0.01 -1.43 0.87 -1.47 0.88 113.55 117.23 1y3n h SER 282 Ca 0.00 0.02 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1y3n h SER 282 Cb 0.94 -0.08 0.00 0.00 -0.44 0.00 0.00 62.40 62.83 1y3n h SER 282 CO 0.00 0.27 -0.12 0.50 -0.53 0.00 0.00 176.83 176.95 1y3n h LYS 283 N 0.53 0.10 0.00 2.24 1.63 -1.82 -3.31 116.57 115.94 1y3n h LYS 283 Ca 0.37 -0.09 -0.17 0.00 -0.85 0.00 0.00 60.65 59.90 1y3n h LYS 283 Cb 0.71 0.02 -0.02 0.00 -0.60 0.00 0.00 32.23 32.33 1y3n h LYS 283 CO -0.13 0.79 -0.83 -0.91 -3.45 0.00 0.00 179.45 174.92 1y3n h ASN 284 N -0.55 0.00 -2.80 4.20 2.35 -1.81 -3.39 115.58 113.58 1y3n h ASN 284 Ca -0.01 0.00 -0.61 0.00 -0.55 0.00 0.00 56.30 55.13 1y3n h ASN 284 Cb 0.83 0.00 -0.40 0.00 0.05 0.00 0.00 38.32 38.79 1y3n h ASN 284 CO 0.02 0.83 -0.73 -0.63 -1.65 0.00 0.00 177.43 175.27 1y3n s ILE 285 N -2.91 1.90 0.27 2.81 1.01 0.28 -5.10 121.20 119.46 1y3n s ILE 285 Ca 0.01 -3.66 -0.30 0.00 0.00 0.00 0.00 60.65 56.70 1y3n s ILE 285 Cb 0.10 -2.26 -0.13 0.00 0.01 0.00 0.00 42.46 40.18 1y3n s ILE 285 CO 0.79 -1.10 1.43 -2.65 0.00 0.00 0.00 174.94 173.41 1y3n n PRO 286 N 2.30 2.22 0.00 2.79 -0.02 -1.25 -1.10 135.00 139.94 1y3n n PRO 286 Ca 0.24 0.79 0.00 0.00 -2.02 0.00 0.00 63.50 62.51 1y3n n PRO 286 Cb 0.40 -2.46 0.00 0.00 -0.02 0.00 0.00 33.50 31.42 1y3n n PRO 286 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1y3n n GLY 287 N 1.87 2.25 3.69 -1.23 0.00 -1.26 -4.99 105.19 105.52 1y3n n GLY 287 Ca 0.09 0.00 -0.52 0.00 0.00 0.00 0.00 46.02 45.60 1y3n n GLY 287 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1y3n n PHE 288 N -2.00 2.21 -3.52 1.61 -0.00 -0.25 -4.60 117.46 110.91 1y3n n PHE 288 Ca 0.00 0.21 -0.28 0.00 -0.00 0.00 0.00 57.45 57.38 1y3n n PHE 288 Cb 0.00 -2.58 -0.14 0.00 -0.00 0.00 0.00 39.48 36.76 1y3n n PHE 288 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 1y3n s LYS 289 N 3.66 0.26 -0.33 -4.13 2.20 -1.26 -4.90 119.74 115.24 1y3n s LYS 289 Ca 0.94 -0.65 -0.13 0.00 -0.36 0.00 0.00 55.97 55.77 1y3n s LYS 289 Cb -0.83 -1.16 -0.02 0.00 -1.51 0.00 0.00 37.83 34.31 1y3n s LYS 289 CO 0.56 -1.05 0.26 -1.17 -0.36 0.00 0.00 175.35 173.59 1y3n s LEU 290 N 1.93 4.43 0.14 5.43 2.96 -1.26 -0.32 118.68 131.99 1y3n s LEU 290 Ca 0.11 -0.31 0.09 0.00 -0.22 0.00 0.00 54.13 53.80 1y3n s LEU 290 Cb -0.17 -2.19 -0.04 0.00 0.50 0.00 0.00 46.19 44.29 1y3n s LEU 290 CO -0.30 -0.23 -0.21 0.68 -1.32 0.00 0.00 176.35 174.97 1y3n s VAL 291 N 1.80 1.89 0.47 1.68 -7.23 -0.36 -4.89 120.40 113.76 1y3n s VAL 291 Ca 0.08 -1.76 -0.24 0.00 -1.81 0.00 0.00 61.98 58.24 1y3n s VAL 291 Cb -0.17 -1.78 -0.07 0.00 0.56 0.00 0.00 36.38 34.92 1y3n s VAL 291 CO 0.11 -0.14 1.35 -2.84 -0.31 0.00 0.00 175.10 173.26 1y3n s PRO 292 N -2.34 3.59 -0.01 4.82 0.02 -1.26 -0.88 135.00 138.93 1y3n s PRO 292 Ca 0.12 2.23 0.02 0.00 0.02 0.00 0.00 61.00 63.39 1y3n s PRO 292 Cb -0.08 -2.52 -0.00 0.00 0.02 0.00 0.00 34.50 31.91 1y3n s PRO 292 CO 0.06 -0.83 -0.08 1.41 -0.33 0.00 0.00 177.00 177.23 1y3n s MET 293 N -2.57 0.67 0.50 5.54 1.75 0.80 -4.83 119.30 121.14 1y3n s MET 293 Ca 0.64 -0.27 -0.22 0.00 -1.25 0.00 0.00 55.69 54.58 1y3n s MET 293 Cb -0.40 -0.65 -0.06 0.00 2.84 0.00 0.00 34.83 36.56 1y3n s MET 293 CO 0.49 0.15 1.18 0.00 -0.65 0.00 0.00 175.02 176.20 1y3n s ALA 294 N -0.11 2.87 0.44 4.11 0.00 -1.26 -3.94 121.76 123.86 1y3n s ALA 294 Ca 0.02 0.96 -0.25 0.00 0.00 0.00 0.00 51.96 52.69 1y3n s ALA 294 Cb -0.04 -3.40 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 1y3n s ALA 294 CO -0.00 -0.80 1.31 -2.30 0.00 0.00 0.00 175.76 173.97 1y3n n PRO 295 N -0.80 1.99 -1.83 0.00 -0.02 -1.26 -4.93 135.00 128.15 1y3n n PRO 295 Ca 0.09 0.71 -0.33 0.00 -2.02 0.00 0.00 63.50 61.95 1y3n n PRO 295 Cb 0.48 -2.45 0.04 0.00 -0.02 0.00 0.00 33.50 31.55 1y3n n PRO 295 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1y3n s PRO 296 N -2.30 2.91 0.01 0.52 0.04 -1.26 -4.74 135.00 130.17 1y3n s PRO 296 Ca 0.62 1.39 -0.30 0.00 0.04 0.00 0.00 61.00 62.74 1y3n s PRO 296 Cb -0.49 -1.96 -0.07 0.00 0.04 0.00 0.00 34.50 32.02 1y3n s PRO 296 CO 0.57 -1.17 1.64 0.42 0.04 0.00 0.00 177.00 178.50 1y3n s ILE 297 N -2.30 3.35 0.30 0.56 1.01 0.26 -4.40 121.20 119.98 1y3n s ILE 297 Ca 0.67 0.63 -0.03 0.00 0.00 0.00 0.00 60.65 61.92 1y3n s ILE 297 Cb -0.20 -3.41 0.07 0.00 0.01 0.00 0.00 42.46 38.93 1y3n s ILE 297 CO 0.40 -0.03 0.41 -0.46 0.00 0.00 0.00 174.94 175.26 1y3n n ASN 298 N 6.31 0.23 0.12 3.58 0.23 0.55 -2.75 115.26 123.53 1y3n n ASN 298 Ca 0.16 -1.27 0.10 0.00 -0.53 0.00 0.00 54.58 53.04 1y3n n ASN 298 Cb 0.42 -0.30 0.48 0.00 -2.08 0.00 0.00 39.78 38.30 1y3n n ASN 298 CO 0.00 0.00 0.00 -1.54 -0.93 0.00 0.00 177.26 174.79 1y3n n SER 299 N -3.15 0.54 -1.37 0.53 3.41 -0.90 -1.02 113.62 111.65 1y3n n SER 299 Ca 0.06 0.67 0.12 0.00 -0.26 0.00 0.00 58.87 59.46 1y3n n SER 299 Cb 0.20 -0.77 0.33 0.00 -0.26 0.00 0.00 64.21 63.71 1y3n n SER 299 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1y3n n LYS 300 N -2.14 2.75 -1.17 4.33 5.02 -1.26 -4.93 118.16 120.76 1y3n n LYS 300 Ca 0.01 -2.67 -0.06 0.00 -2.02 0.00 0.00 58.31 53.57 1y3n n LYS 300 Cb 0.15 -1.59 -0.02 0.00 -0.02 0.00 0.00 35.03 33.55 1y3n n LYS 300 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1y3n n GLY 301 N 1.66 0.83 3.30 0.72 0.00 -0.19 -5.04 105.19 106.47 1y3n n GLY 301 Ca 0.25 -0.73 -0.20 0.00 0.00 0.00 0.00 46.02 45.33 1y3n n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1y3n s GLN 302 N -2.41 1.20 -0.46 1.61 -0.21 -1.26 -4.78 119.66 113.34 1y3n s GLN 302 Ca 0.00 -1.37 -0.14 0.00 0.02 0.00 0.00 55.36 53.88 1y3n s GLN 302 Cb 0.00 -1.17 0.08 0.00 1.00 0.00 0.00 33.01 32.92 1y3n s GLN 302 CO 0.00 0.23 0.36 1.03 -2.12 0.00 0.00 175.29 174.79 1y3n s ARG 303 N -2.84 2.86 -0.15 2.91 0.52 -1.26 -0.33 118.95 120.66 1y3n s ARG 303 Ca 0.14 -1.40 -0.07 0.00 -0.52 0.00 0.00 55.73 53.88 1y3n s ARG 303 Cb -0.05 -4.03 -0.04 0.00 0.52 0.00 0.00 34.95 31.35 1y3n s ARG 303 CO 0.05 -1.02 0.09 -1.58 0.02 0.00 0.00 175.30 172.86 1y3n s TRP 304 N 1.57 3.37 -0.30 -0.53 0.51 -1.26 -4.75 118.94 117.55 1y3n s TRP 304 Ca 0.04 0.27 0.03 0.00 -2.12 0.00 0.00 56.10 54.32 1y3n s TRP 304 Cb -0.24 -2.01 0.08 0.00 -0.81 0.00 0.00 33.47 30.48 1y3n s TRP 304 CO 0.05 0.39 -0.02 -2.00 -0.51 0.00 0.00 176.95 174.86 1y3n s GLU 305 N -0.21 1.82 0.34 4.98 2.56 -0.78 -4.76 118.70 122.64 1y3n s GLU 305 Ca 0.09 -1.61 0.18 0.00 0.00 0.00 0.00 54.97 53.63 1y3n s GLU 305 Cb -0.12 -3.03 0.33 0.00 2.00 0.00 0.00 34.13 33.31 1y3n s GLU 305 CO 0.01 -0.76 1.57 1.49 -0.56 0.00 0.00 175.26 177.01 1y3n h GLU 306 N 7.70 0.00 -6.22 4.30 4.81 -1.94 -1.58 114.58 121.65 1y3n h GLU 306 Ca -0.11 0.00 -0.57 0.00 -0.13 0.00 0.00 59.36 58.55 1y3n h GLU 306 Cb 1.03 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.38 1y3n h GLU 306 CO 0.49 0.39 -0.28 0.34 -0.73 0.00 0.00 179.01 179.22 1y3n s ASP 307 N -6.38 6.51 0.16 1.04 3.68 -1.26 -4.71 116.67 115.70 1y3n s ASP 307 Ca 0.03 0.64 -0.20 0.00 2.13 0.00 0.00 52.55 55.15 1y3n s ASP 307 Cb 0.08 -2.11 0.05 0.00 -1.45 0.00 0.00 42.92 39.50 1y3n s ASP 307 CO 0.71 0.02 0.53 0.00 0.13 0.00 0.00 175.17 176.56 1y3n s ALA 308 N -1.70 -1.29 0.28 3.66 0.00 -1.26 -4.55 121.76 116.89 1y3n s ALA 308 Ca 0.42 0.20 -0.30 0.00 0.00 0.00 0.00 51.96 52.29 1y3n s ALA 308 Cb -0.12 0.82 -0.10 0.00 0.00 0.00 0.00 23.12 23.72 1y3n s ALA 308 CO 0.24 -0.74 1.42 0.50 0.00 0.00 0.00 175.76 177.18 1y3n s ARG 309 N -3.79 4.27 -0.23 0.00 3.52 -0.69 -4.22 118.95 117.81 1y3n s ARG 309 Ca 0.03 2.31 -0.05 0.00 -0.13 0.00 0.00 55.73 57.90 1y3n s ARG 309 Cb -0.00 -3.09 -0.01 0.00 -1.56 0.00 0.00 34.95 30.29 1y3n s ARG 309 CO -0.11 -0.39 -0.02 -1.14 -0.81 0.00 0.00 175.30 172.84 1y3n s GLN 310 N -0.79 3.40 -0.28 5.12 0.74 -1.26 -4.96 119.66 121.62 1y3n s GLN 310 Ca 0.57 -0.62 0.01 0.00 0.05 0.00 0.00 55.36 55.37 1y3n s GLN 310 Cb -0.42 -3.09 0.06 0.00 1.10 0.00 0.00 33.01 30.66 1y3n s GLN 310 CO 0.47 -0.22 -0.06 0.42 -0.55 0.00 0.00 175.29 175.35 1y3n s ILE 311 N 1.50 2.45 0.71 -2.34 1.01 -1.26 -3.13 121.20 120.14 1y3n s ILE 311 Ca 0.06 -1.62 -0.04 0.00 0.00 0.00 0.00 60.65 59.06 1y3n s ILE 311 Cb -0.15 -2.46 0.10 0.00 0.01 0.00 0.00 42.46 39.96 1y3n s ILE 311 CO -0.02 -0.10 0.99 -2.16 0.00 0.00 0.00 174.94 173.65 1y3n s PRO 312 N 1.13 1.86 0.34 2.79 0.04 -1.26 -4.78 135.00 135.12 1y3n s PRO 312 Ca -0.06 -0.76 -0.02 0.00 0.04 0.00 0.00 61.00 60.20 1y3n s PRO 312 Cb -0.20 -2.27 -0.04 0.00 0.04 0.00 0.00 34.50 32.03 1y3n s PRO 312 CO -0.04 -1.36 0.57 1.03 0.04 0.00 0.00 177.00 177.24 1y3n s ARG 313 N -5.17 3.54 -0.07 4.56 1.81 -0.70 -4.97 118.95 117.95 1y3n s ARG 313 Ca 0.64 -0.17 -0.02 0.00 -1.72 0.00 0.00 55.73 54.46 1y3n s ARG 313 Cb -0.07 -2.63 -0.02 0.00 -0.45 0.00 0.00 34.95 31.77 1y3n s ARG 313 CO 0.44 0.14 2.38 -0.35 -0.68 0.00 0.00 175.30 177.23 1y3n n PRO 314 N -1.53 1.39 -4.39 3.54 -0.04 -1.26 -4.33 135.00 128.38 1y3n n PRO 314 Ca -0.03 -0.54 -0.20 0.00 -0.04 0.00 0.00 63.50 62.69 1y3n n PRO 314 Cb 0.55 -1.35 -0.10 0.00 -0.04 0.00 0.00 33.50 32.56 1y3n n PRO 314 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1y3n s ASP 315 N 1.66 2.77 0.00 3.54 1.01 -1.26 -1.30 116.67 123.10 1y3n s ASP 315 Ca 0.21 -1.09 0.00 0.00 0.71 0.00 0.00 52.55 52.38 1y3n s ASP 315 Cb 0.12 -0.17 0.00 0.00 1.01 0.00 0.00 42.92 43.88 1y3n s ASP 315 CO -0.01 -0.21 0.00 0.61 0.21 0.00 0.00 175.17 175.77 1y3n n GLY 316 N -0.49 0.34 3.10 0.21 0.00 -0.68 -1.33 105.19 106.34 1y3n n GLY 316 Ca -0.07 -1.56 -0.08 0.00 0.00 0.00 0.00 46.02 44.32 1y3n n GLY 316 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1y3n s TRP 317 N -2.99 0.56 0.19 1.61 -2.14 -0.83 -1.14 118.94 114.20 1y3n s TRP 317 Ca 0.00 -1.02 0.01 0.00 2.66 0.00 0.00 56.10 57.75 1y3n s TRP 317 Cb 0.00 -0.40 -0.05 0.00 -3.10 0.00 0.00 33.47 29.93 1y3n s TRP 317 CO 0.00 -0.33 0.06 0.00 -2.66 0.00 0.00 176.95 174.02 1y3n s ALA 318 N -3.74 1.32 -0.19 2.67 0.00 -0.06 -1.21 121.76 120.55 1y3n s ALA 318 Ca 0.06 -1.66 -0.07 0.00 0.00 0.00 0.00 51.96 50.29 1y3n s ALA 318 Cb 0.07 0.90 -0.04 0.00 0.00 0.00 0.00 23.12 24.05 1y3n s ALA 318 CO -0.09 -0.44 0.05 0.42 0.00 0.00 0.00 175.76 175.70 1y3n s ILE 319 N -3.85 4.53 0.70 0.00 1.01 -1.26 -2.32 121.20 120.01 1y3n s ILE 319 Ca 0.30 -0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.72 1y3n s ILE 319 Cb 0.07 -3.05 0.01 0.00 0.01 0.00 0.00 42.46 39.50 1y3n s ILE 319 CO 0.08 0.43 1.10 0.42 0.00 0.00 0.00 174.94 176.96 1y3n s THR 320 N 0.69 3.50 -0.82 2.92 -4.23 -0.93 -1.34 115.64 115.42 1y3n s THR 320 Ca 0.02 0.48 0.21 0.00 -1.18 0.00 0.00 61.69 61.23 1y3n s THR 320 Cb -0.13 -3.48 0.20 0.00 1.34 0.00 0.00 72.50 70.42 1y3n s THR 320 CO 0.02 -0.63 1.66 0.00 -0.54 0.00 0.00 174.62 175.13 1y3n n ALA 321 N -3.00 1.87 0.69 3.99 0.00 -0.23 -2.47 120.51 121.36 1y3n n ALA 321 Ca 0.07 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.61 1y3n n ALA 321 Cb 0.57 -1.35 0.13 0.00 0.00 0.00 0.00 19.45 18.80 1y3n n ALA 321 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1y3n n THR 322 N -1.80 0.19 -1.71 0.00 -2.24 -1.26 -4.87 114.28 102.59 1y3n n THR 322 Ca 0.04 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.21 1y3n n THR 322 Cb 0.25 0.11 -0.03 0.00 -2.10 0.00 0.00 70.33 68.56 1y3n n THR 322 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1y3n s ASN 323 N -3.78 6.43 0.00 3.42 3.84 -1.03 -4.85 114.94 118.97 1y3n s ASN 323 Ca 0.07 2.58 0.27 0.00 0.21 0.00 0.00 52.86 55.99 1y3n s ASN 323 Cb 0.15 -2.53 0.88 0.00 -0.55 0.00 0.00 41.25 39.20 1y3n s ASN 323 CO 0.75 -1.08 1.67 0.29 -2.79 0.00 0.00 177.10 175.93 1y3n n LYS 324 N 7.55 0.18 -3.08 0.43 4.76 -1.26 -4.25 118.16 122.49 1y3n n LYS 324 Ca 0.20 -0.07 -0.24 0.00 -2.87 0.00 0.00 58.31 55.33 1y3n n LYS 324 Cb 0.41 -1.50 -0.04 0.00 -1.84 0.00 0.00 35.03 32.07 1y3n n LYS 324 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1y3n n ASN 325 N -1.35 2.88 -0.23 4.39 3.02 -1.26 -4.92 115.26 117.79 1y3n n ASN 325 Ca 0.08 -3.37 0.01 0.00 -0.03 0.00 0.00 54.58 51.26 1y3n n ASN 325 Cb 0.33 -0.59 0.24 0.00 -0.61 0.00 0.00 39.78 39.14 1y3n n ASN 325 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1y3n h PRO 326 N 3.12 1.01 -0.27 3.52 0.13 -1.97 -0.92 132.00 136.62 1y3n h PRO 326 Ca 0.12 -0.06 -0.03 0.00 -0.87 0.00 0.00 66.00 65.16 1y3n h PRO 326 Cb 0.70 -0.23 -0.01 0.00 0.13 0.00 0.00 31.00 31.60 1y3n h PRO 326 CO 0.68 0.67 0.04 0.28 -0.23 0.00 0.00 178.00 179.44 1y3n h VAL 327 N 1.04 1.23 -0.30 1.56 2.07 -1.96 -0.42 116.25 119.46 1y3n h VAL 327 Ca 0.28 -0.78 -0.08 0.00 0.82 0.00 0.00 66.70 66.94 1y3n h VAL 327 Cb -0.11 1.23 -0.02 0.00 -1.52 0.00 0.00 31.29 30.88 1y3n h VAL 327 CO -0.06 0.25 -0.16 -0.33 0.02 0.00 0.00 177.57 177.28 1y3n h GLU 328 N 0.25 0.53 -0.24 1.57 3.07 -1.83 -2.30 114.58 115.64 1y3n h GLU 328 Ca 0.08 -0.17 -0.04 0.00 -0.50 0.00 0.00 59.36 58.73 1y3n h GLU 328 Cb 0.33 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.19 1y3n h GLU 328 CO 0.01 0.68 -0.02 1.15 -1.40 0.00 0.00 179.01 179.43 1y3n h THR 329 N 0.48 1.27 0.00 1.13 2.02 -0.88 -1.30 112.91 115.63 1y3n h THR 329 Ca 0.08 -0.95 -0.06 0.00 0.77 0.00 0.00 66.41 66.25 1y3n h THR 329 Cb 0.57 1.41 -0.01 0.00 -1.74 0.00 0.00 68.15 68.38 1y3n h THR 329 CO 0.04 0.30 -0.29 -0.29 0.37 0.00 0.00 175.52 175.64 1y3n h ILE 330 N 0.19 1.12 -0.27 3.11 6.09 -1.00 0.38 117.51 127.14 1y3n h ILE 330 Ca 0.07 -1.04 -0.15 0.00 -1.37 0.00 0.00 64.86 62.36 1y3n h ILE 330 Cb 0.45 1.57 -0.01 0.00 0.47 0.00 0.00 36.82 39.30 1y3n h ILE 330 CO 0.02 0.29 -0.45 0.11 -3.07 0.00 0.00 178.15 175.04 1y3n h LYS 331 N 0.00 0.70 -0.32 2.19 1.57 -1.17 0.25 116.57 119.79 1y3n h LYS 331 Ca -0.00 -0.39 -0.03 0.00 -1.87 0.00 0.00 60.65 58.36 1y3n h LYS 331 Cb 0.55 0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.87 1y3n h LYS 331 CO 0.04 1.01 0.10 1.25 -0.57 0.00 0.00 179.45 181.27 1y3n h LEU 332 N 0.56 0.47 -0.92 2.94 5.85 -0.40 -2.14 115.31 121.67 1y3n h LEU 332 Ca 0.03 -0.21 0.04 0.00 0.84 0.00 0.00 57.88 58.59 1y3n h LEU 332 Cb 1.00 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.86 1y3n h LEU 332 CO 0.09 0.55 0.60 -0.26 -0.34 0.00 0.00 178.44 179.08 1y3n h PHE 333 N 0.36 1.12 -0.09 1.25 0.05 -0.67 -2.20 116.94 116.77 1y3n h PHE 333 Ca 0.10 0.03 -0.06 0.00 3.82 0.00 0.00 57.97 61.86 1y3n h PHE 333 Cb 0.25 -0.37 -0.01 0.00 2.00 0.00 0.00 35.95 37.82 1y3n h PHE 333 CO 0.01 0.64 -0.24 0.22 -0.18 0.00 0.00 178.31 178.76 1y3n h ASP 334 N 1.15 0.14 -0.92 2.17 -0.00 -0.60 -2.68 116.42 115.68 1y3n h ASP 334 Ca 0.37 -0.04 0.15 0.00 -0.00 0.00 0.00 57.03 57.51 1y3n h ASP 334 Cb 0.02 -0.04 -0.08 0.00 -0.00 0.00 0.00 39.33 39.23 1y3n h ASP 334 CO -0.13 0.39 0.59 0.15 -0.00 0.00 0.00 179.24 180.24 1y3n h PHE 335 N 0.14 0.89 0.00 0.28 3.57 -0.74 -0.37 116.94 120.71 1y3n h PHE 335 Ca 0.02 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.54 1y3n h PHE 335 Cb 0.50 -0.28 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 1y3n h PHE 335 CO 0.00 0.32 -0.02 1.88 -2.23 0.00 0.00 178.31 178.26 1y3n h TYR 336 N 0.74 0.00 -0.58 0.41 -1.99 -1.54 -2.00 116.97 112.00 1y3n h TYR 336 Ca 0.47 0.00 0.00 0.00 2.00 0.00 0.00 58.73 61.20 1y3n h TYR 336 Cb 0.71 0.00 0.00 0.00 2.00 0.00 0.00 36.73 39.44 1y3n h TYR 336 CO -0.00 0.02 0.00 1.19 -0.00 0.00 0.00 178.16 179.37 1y3n n PHE 337 N -3.18 0.77 -2.63 4.88 3.01 -0.15 -2.47 117.46 117.69 1y3n n PHE 337 Ca -0.01 -0.39 -0.22 0.00 1.01 0.00 0.00 57.45 57.84 1y3n n PHE 337 Cb 0.19 0.00 0.04 0.00 -0.01 0.00 0.00 39.48 39.69 1y3n n PHE 337 CO 0.00 0.00 0.00 0.20 1.01 0.00 0.00 176.76 177.97 1y3n s GLY 338 N -1.16 1.80 0.12 1.37 0.00 -0.75 -4.85 107.32 103.85 1y3n s GLY 338 Ca 0.43 -1.28 -0.25 0.00 0.00 0.00 0.00 44.72 43.62 1y3n s GLY 338 CO 0.31 -0.99 1.65 -2.55 0.00 0.00 0.00 173.10 171.52 1y3n h PRO 339 N 0.04 -0.34 -0.43 2.90 0.11 -1.91 -0.70 132.00 131.69 1y3n h PRO 339 Ca -0.42 0.02 -0.03 0.00 0.11 0.00 0.00 66.00 65.68 1y3n h PRO 339 Cb 1.29 0.08 -0.02 0.00 0.11 0.00 0.00 31.00 32.46 1y3n h PRO 339 CO 0.53 -0.22 0.14 -0.22 -0.21 0.00 0.00 178.00 178.01 1y3n h LYS 340 N -0.35 0.66 -0.69 1.05 1.63 -1.95 -1.88 116.57 115.04 1y3n h LYS 340 Ca 0.05 -0.14 -0.03 0.00 -0.85 0.00 0.00 60.65 59.69 1y3n h LYS 340 Cb 0.41 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.92 1y3n h LYS 340 CO -0.18 0.64 0.33 0.78 -3.45 0.00 0.00 179.45 177.57 1y3n h GLY 341 N 0.55 1.06 1.41 5.01 0.00 -1.59 -1.67 103.07 107.84 1y3n h GLY 341 Ca 0.14 -0.53 -0.07 0.00 0.00 0.00 0.00 47.33 46.87 1y3n h GLY 341 CO -0.01 0.50 -0.03 -0.09 0.00 0.00 0.00 176.54 176.91 1y3n h ARG 342 N 0.95 0.72 -0.34 4.80 2.43 -0.80 -1.88 114.38 120.27 1y3n h ARG 342 Ca 0.24 -0.20 -0.05 0.00 -0.81 0.00 0.00 59.98 59.16 1y3n h ARG 342 Cb 0.12 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 29.57 1y3n h ARG 342 CO -0.03 0.76 0.02 1.49 -1.51 0.00 0.00 179.97 180.70 1y3n h GLU 343 N 0.67 0.59 -0.21 0.20 4.81 -0.86 -2.73 114.58 117.05 1y3n h GLU 343 Ca 0.13 -0.18 -0.02 0.00 -0.13 0.00 0.00 59.36 59.16 1y3n h GLU 343 Cb 0.46 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1y3n h GLU 343 CO 0.02 0.70 0.04 -0.07 -0.73 0.00 0.00 179.01 178.96 1y3n h LEU 344 N 0.40 0.33 -1.09 1.64 3.38 -1.16 0.51 115.31 119.33 1y3n h LEU 344 Ca 0.10 -0.26 0.00 0.00 0.09 0.00 0.00 57.88 57.81 1y3n h LEU 344 Cb 0.42 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.08 1y3n h LEU 344 CO 0.01 0.50 0.00 -1.54 0.09 0.00 0.00 178.44 177.50 1y3n n SER 345 N -4.74 0.59 -0.10 -0.43 3.41 -0.72 -1.40 113.62 110.23 1y3n n SER 345 Ca -0.04 0.71 -0.19 0.00 -0.26 0.00 0.00 58.87 59.09 1y3n n SER 345 Cb 0.19 -0.81 -0.08 0.00 -0.26 0.00 0.00 64.21 63.24 1y3n n SER 345 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1y3n n ASN 346 N -2.23 1.87 -0.00 4.04 3.02 -1.03 -1.20 115.26 119.72 1y3n n ASN 346 Ca 0.00 0.12 0.10 0.00 -0.03 0.00 0.00 54.58 54.77 1y3n n ASN 346 Cb 0.12 -0.51 -0.13 0.00 -0.61 0.00 0.00 39.78 38.65 1y3n n ASN 346 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1y3n n PHE 347 N -3.62 0.00 0.00 3.10 3.01 0.15 -4.57 117.46 115.53 1y3n n PHE 347 Ca -0.39 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.07 1y3n n PHE 347 Cb 0.83 -0.17 0.00 0.00 -0.01 0.00 0.00 39.48 40.13 1y3n n PHE 347 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1y3n n GLY 348 N 1.42 0.70 3.06 1.37 0.00 -0.49 -4.57 105.19 106.67 1y3n n GLY 348 Ca 0.01 -1.29 -0.25 0.00 0.00 0.00 0.00 46.02 44.49 1y3n n GLY 348 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1y3n s VAL 349 N 0.00 1.23 0.19 1.61 1.01 -1.26 -4.47 120.40 118.72 1y3n s VAL 349 Ca 0.00 -0.55 -0.32 0.00 0.00 0.00 0.00 61.98 61.11 1y3n s VAL 349 Cb 0.00 -1.10 -0.11 0.00 0.00 0.00 0.00 36.38 35.16 1y3n s VAL 349 CO 0.00 0.37 1.68 -2.16 0.00 0.00 0.00 175.10 174.99 1y3n s PRO 350 N 0.50 4.15 0.00 2.72 0.04 -1.26 -1.18 135.00 139.97 1y3n s PRO 350 Ca -0.12 2.53 0.00 0.00 0.04 0.00 0.00 61.00 63.45 1y3n s PRO 350 Cb -0.15 -3.13 0.00 0.00 0.04 0.00 0.00 34.50 31.27 1y3n s PRO 350 CO 0.04 -0.71 0.00 0.41 0.04 0.00 0.00 177.00 176.77 1y3n n GLY 351 N 3.93 2.08 0.46 0.56 0.00 0.12 -4.84 105.19 107.49 1y3n n GLY 351 Ca 0.15 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 46.12 1y3n n GLY 351 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 1y3n n LEU 352 N 0.00 1.57 -0.01 0.99 7.94 -0.33 -4.86 117.00 122.30 1y3n n LEU 352 Ca 0.00 0.25 0.05 0.00 -1.11 0.00 0.00 56.01 55.20 1y3n n LEU 352 Cb 0.00 -0.58 -0.11 0.00 0.53 0.00 0.00 43.42 43.27 1y3n n LEU 352 CO 0.00 -0.46 -0.70 0.35 -1.11 0.00 0.00 177.39 175.47 1y3n n THR 353 N -4.04 0.11 -4.02 1.96 -2.24 -0.60 -4.95 114.28 100.50 1y3n n THR 353 Ca -0.08 -0.35 -0.10 0.00 -2.27 0.00 0.00 64.05 61.25 1y3n n THR 353 Cb 0.31 0.07 -0.06 0.00 -2.10 0.00 0.00 70.33 68.55 1y3n n THR 353 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1y3n s TYR 354 N -2.89 0.48 0.03 4.78 1.13 -1.23 -1.88 117.35 117.76 1y3n s TYR 354 Ca -0.05 -0.82 0.01 0.00 -1.41 0.00 0.00 57.07 54.80 1y3n s TYR 354 Cb 0.08 0.06 -0.02 0.00 -1.10 0.00 0.00 41.96 40.98 1y3n s TYR 354 CO 0.58 -0.92 -0.05 -0.51 -2.51 0.00 0.00 175.55 172.13 1y3n s ASP 355 N -3.03 0.54 -0.30 -0.18 1.01 -0.50 0.12 116.67 114.34 1y3n s ASP 355 Ca 0.24 -0.52 -0.23 0.00 0.71 0.00 0.00 52.55 52.75 1y3n s ASP 355 Cb 0.01 0.07 -0.00 0.00 1.01 0.00 0.00 42.92 44.00 1y3n s ASP 355 CO 0.09 -0.25 0.77 -0.63 0.21 0.00 0.00 175.17 175.36 1y3n s ILE 356 N -1.40 4.82 -0.17 0.77 -1.09 -1.26 -0.47 121.20 122.40 1y3n s ILE 356 Ca -0.13 1.19 0.00 0.00 -2.23 0.00 0.00 60.65 59.48 1y3n s ILE 356 Cb -0.10 -4.12 0.03 0.00 -1.58 0.00 0.00 42.46 36.69 1y3n s ILE 356 CO -0.00 -0.21 -0.09 -0.54 -1.23 0.00 0.00 174.94 172.86 1y3n s LYS 357 N 2.90 1.86 -1.15 2.79 1.02 0.12 -4.67 119.74 122.62 1y3n s LYS 357 Ca 0.32 -0.60 -0.07 0.00 0.02 0.00 0.00 55.97 55.64 1y3n s LYS 357 Cb -0.14 -2.11 0.01 0.00 -0.52 0.00 0.00 37.83 35.06 1y3n s LYS 357 CO 0.12 -0.36 0.88 0.09 -0.92 0.00 0.00 175.35 175.16 1y3n n ASN 358 N 4.79 -5.56 0.00 2.83 5.03 -1.26 -2.24 115.26 118.86 1y3n n ASN 358 Ca -0.14 -0.40 0.00 0.00 0.87 0.00 0.00 54.58 54.91 1y3n n ASN 358 Cb 0.48 -4.21 0.00 0.00 -1.02 0.00 0.00 39.78 35.03 1y3n n ASN 358 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1y3n n GLY 359 N -1.67 0.60 3.42 7.41 0.00 -1.26 -5.00 105.19 108.68 1y3n n GLY 359 Ca -0.01 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.69 1y3n n GLY 359 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1y3n s LYS 360 N -0.41 2.37 -0.00 1.61 1.02 -0.95 -5.06 119.74 118.32 1y3n s LYS 360 Ca 0.00 -0.78 -0.30 0.00 0.02 0.00 0.00 55.97 54.91 1y3n s LYS 360 Cb 0.00 -2.26 -0.05 0.00 -0.52 0.00 0.00 37.83 35.00 1y3n s LYS 360 CO 0.00 0.60 1.39 -1.25 -0.92 0.00 0.00 175.35 175.17 1y3n s PRO 361 N -0.69 4.29 -0.12 -1.68 0.04 -1.26 -0.70 135.00 134.88 1y3n s PRO 361 Ca 0.11 1.95 0.00 0.00 0.04 0.00 0.00 61.00 63.10 1y3n s PRO 361 Cb -0.10 -3.57 0.02 0.00 0.04 0.00 0.00 34.50 30.89 1y3n s PRO 361 CO -0.00 -0.57 -0.11 0.08 0.04 0.00 0.00 177.00 176.44 1y3n s VAL 362 N 2.39 1.25 0.48 -0.36 1.01 0.38 -4.94 120.40 120.61 1y3n s VAL 362 Ca 0.63 -0.44 -0.24 0.00 0.00 0.00 0.00 61.98 61.93 1y3n s VAL 362 Cb -0.31 -1.21 -0.07 0.00 0.00 0.00 0.00 36.38 34.79 1y3n s VAL 362 CO 0.26 0.40 1.41 -1.22 0.00 0.00 0.00 175.10 175.96 1y3n n TYR 363 N 4.74 2.58 -1.39 5.22 4.01 -1.26 -1.40 117.16 129.65 1y3n n TYR 363 Ca -0.15 0.43 -0.31 0.00 -0.16 0.00 0.00 57.90 57.71 1y3n n TYR 363 Cb 0.50 -2.43 0.08 0.00 -0.31 0.00 0.00 39.34 37.18 1y3n n TYR 363 CO 0.00 0.00 0.00 0.15 -0.46 0.00 0.00 176.86 176.55 1y3n s LYS 364 N -2.60 2.43 0.35 -0.72 1.02 -0.79 -4.87 119.74 114.56 1y3n s LYS 364 Ca 0.65 1.20 0.06 0.00 0.02 0.00 0.00 55.97 57.90 1y3n s LYS 364 Cb -0.44 -1.92 0.65 0.00 -0.52 0.00 0.00 37.83 35.61 1y3n s LYS 364 CO 0.55 -1.51 1.87 -0.44 -0.92 0.00 0.00 175.35 174.89 1y3n h ASP 365 N -0.84 0.37 -0.53 2.83 3.32 -1.93 -2.29 116.42 117.35 1y3n h ASP 365 Ca -0.44 -0.08 0.02 0.00 0.02 0.00 0.00 57.03 56.54 1y3n h ASP 365 Cb 1.23 -0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.66 1y3n h ASP 365 CO 0.52 0.51 0.35 0.71 -1.72 0.00 0.00 179.24 179.61 1y3n h THR 366 N 0.37 1.10 -0.00 0.35 1.35 -1.96 0.20 112.91 114.32 1y3n h THR 366 Ca 0.07 -0.23 -0.00 0.00 -0.55 0.00 0.00 66.41 65.70 1y3n h THR 366 Cb 0.40 0.38 0.00 0.00 -1.73 0.00 0.00 68.15 67.20 1y3n h THR 366 CO 0.02 0.12 -0.01 0.58 -0.25 0.00 0.00 175.52 175.98 1y3n h VAL 367 N 0.66 1.58 0.00 6.82 2.07 -1.76 -2.97 116.25 122.65 1y3n h VAL 367 Ca 0.20 -1.72 -0.04 0.00 0.82 0.00 0.00 66.70 65.96 1y3n h VAL 367 Cb -0.00 2.74 -0.01 0.00 -1.52 0.00 0.00 31.29 32.50 1y3n h VAL 367 CO -0.05 0.45 -0.19 -0.07 0.02 0.00 0.00 177.57 177.73 1y3n h LEU 368 N -0.71 0.00 -1.03 2.57 3.38 -1.06 -2.63 115.31 115.83 1y3n h LEU 368 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1y3n h LEU 368 Cb 0.74 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.49 1y3n h LEU 368 CO 0.00 0.19 -0.15 0.29 0.09 0.00 0.00 178.44 178.86 1y3n n LYS 369 N -4.10 1.49 -1.80 1.13 5.02 0.67 -4.95 118.16 115.61 1y3n n LYS 369 Ca -0.02 -1.03 -0.35 0.00 -2.02 0.00 0.00 58.31 54.89 1y3n n LYS 369 Cb 0.26 -1.48 0.05 0.00 -0.02 0.00 0.00 35.03 33.85 1y3n n LYS 369 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1y3n s ALA 370 N -2.22 2.41 0.08 7.82 0.00 -1.00 -4.93 121.76 123.93 1y3n s ALA 370 Ca 0.29 0.91 0.18 0.00 0.00 0.00 0.00 51.96 53.34 1y3n s ALA 370 Cb 0.20 -3.44 0.54 0.00 0.00 0.00 0.00 23.12 20.42 1y3n s ALA 370 CO 0.42 -1.39 1.66 0.00 0.00 0.00 0.00 175.76 176.45 1y3n h ALA 371 N 0.41 0.90 -2.64 0.00 0.00 -1.91 -3.44 119.26 112.58 1y3n h ALA 371 Ca -0.49 -0.37 -0.54 0.00 0.00 0.00 0.00 54.91 53.52 1y3n h ALA 371 Cb 1.29 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.98 1y3n h ALA 371 CO 0.53 0.50 0.22 -0.65 0.00 0.00 0.00 179.25 179.85 1y3n s GLN 372 N -3.43 4.56 0.45 0.00 1.11 -1.26 -4.86 119.66 116.23 1y3n s GLN 372 Ca 0.01 1.18 -0.23 0.00 0.01 0.00 0.00 55.36 56.33 1y3n s GLN 372 Cb 0.10 -3.36 -0.09 0.00 -1.01 0.00 0.00 33.01 28.65 1y3n s GLN 372 CO 0.70 0.29 1.03 -2.30 0.01 0.00 0.00 175.29 175.02 1y3n n PRO 373 N 2.69 1.34 -0.01 2.91 -0.02 -1.26 -4.76 135.00 135.89 1y3n n PRO 373 Ca -0.01 0.49 0.05 0.00 -2.02 0.00 0.00 63.50 62.00 1y3n n PRO 373 Cb 0.50 -2.11 0.44 0.00 -0.02 0.00 0.00 33.50 32.31 1y3n n PRO 373 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1y3n h VAL 374 N 1.41 1.07 -0.29 -1.45 2.07 -1.93 -1.35 116.25 115.77 1y3n h VAL 374 Ca -0.46 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 66.80 1y3n h VAL 374 Cb 1.34 0.50 -0.02 0.00 -1.52 0.00 0.00 31.29 31.59 1y3n h VAL 374 CO 0.56 0.10 -0.17 -0.55 0.02 0.00 0.00 177.57 177.52 1y3n h ASN 375 N 0.52 0.52 -0.68 0.57 -1.07 -1.98 -0.53 115.58 112.94 1y3n h ASN 375 Ca 0.17 -0.15 -0.08 0.00 0.07 0.00 0.00 56.30 56.31 1y3n h ASN 375 Cb 0.03 -0.14 -0.03 0.00 -2.07 0.00 0.00 38.32 36.11 1y3n h ASN 375 CO -0.04 0.71 0.12 0.78 0.07 0.00 0.00 177.43 179.08 1y3n h ASN 376 N 0.48 1.06 -0.31 6.14 2.35 -1.62 -1.44 115.58 122.24 1y3n h ASN 376 Ca 0.08 -0.25 -0.04 0.00 -0.55 0.00 0.00 56.30 55.53 1y3n h ASN 376 Cb 0.58 -0.28 -0.02 0.00 0.05 0.00 0.00 38.32 38.65 1y3n h ASN 376 CO 0.04 1.04 0.06 1.56 -1.65 0.00 0.00 177.43 178.48 1y3n h GLN 377 N 1.04 0.60 -0.29 0.81 4.20 -0.74 -2.54 115.11 118.20 1y3n h GLN 377 Ca 0.21 -0.12 -0.11 0.00 0.06 0.00 0.00 58.65 58.70 1y3n h GLN 377 Cb 0.43 -0.09 -0.01 0.00 0.30 0.00 0.00 27.48 28.11 1y3n h GLN 377 CO 0.01 0.58 -0.23 0.52 -0.67 0.00 0.00 178.83 179.04 1y3n h MET 378 N 0.58 0.67 -0.77 1.46 2.86 -0.57 -3.08 114.93 116.08 1y3n h MET 378 Ca 0.13 -0.33 0.11 0.00 -2.06 0.00 0.00 59.70 57.55 1y3n h MET 378 Cb 0.28 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 31.86 1y3n h MET 378 CO 0.00 0.94 0.38 1.88 1.06 0.00 0.00 176.91 181.17 1y3n h TYR 379 N 0.41 0.68 -0.06 -0.22 0.99 -0.94 0.13 116.97 117.96 1y3n h TYR 379 Ca 0.05 0.03 0.02 0.00 2.00 0.00 0.00 58.73 60.83 1y3n h TYR 379 Cb 0.79 -0.19 -0.00 0.00 1.00 0.00 0.00 36.73 38.33 1y3n h TYR 379 CO 0.07 0.21 0.10 -0.44 -0.00 0.00 0.00 178.16 178.10 1y3n h ASP 380 N 0.61 0.00 -0.13 3.88 3.45 -1.37 -2.39 116.42 120.47 1y3n h ASP 380 Ca 0.39 0.00 0.00 0.00 0.43 0.00 0.00 57.03 57.85 1y3n h ASP 380 Cb 0.47 0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.24 1y3n h ASP 380 CO -0.31 0.00 0.00 2.30 -1.57 0.00 0.00 179.24 179.66 1y3n n ILE 381 N -3.57 0.97 -0.27 0.35 -5.35 -0.39 -4.91 119.36 106.19 1y3n n ILE 381 Ca -0.01 -0.99 0.00 0.00 -0.27 0.00 0.00 62.75 61.48 1y3n n ILE 381 Cb 0.19 0.52 0.00 0.00 -1.74 0.00 0.00 39.64 38.60 1y3n n ILE 381 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 1y3n n GLY 382 N -0.11 0.85 3.69 3.28 0.00 -0.76 -2.01 105.19 110.13 1y3n n GLY 382 Ca 0.04 -0.16 -0.23 0.00 0.00 0.00 0.00 46.02 45.67 1y3n n GLY 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1y3n s ALA 383 N -2.00 3.29 -1.54 4.61 0.00 -0.11 -4.59 121.76 121.43 1y3n s ALA 383 Ca 0.00 -1.62 -0.02 0.00 0.00 0.00 0.00 51.96 50.32 1y3n s ALA 383 Cb 0.00 -0.89 0.01 0.00 0.00 0.00 0.00 23.12 22.24 1y3n s ALA 383 CO 0.00 0.24 0.17 1.04 0.00 0.00 0.00 175.76 177.21 1y3n n GLN 384 N -0.99 -2.67 -3.84 0.00 1.13 -0.34 -2.73 117.38 107.94 1y3n n GLN 384 Ca -0.06 0.86 -0.31 0.00 -1.94 0.00 0.00 57.00 55.55 1y3n n GLN 384 Cb 0.59 -5.57 -0.04 0.00 0.11 0.00 0.00 30.24 25.33 1y3n n GLN 384 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1y3n s ILE 385 N -2.98 5.32 -0.14 5.09 -4.36 -1.26 -4.83 121.20 118.04 1y3n s ILE 385 Ca 0.10 -0.25 -0.03 0.00 -0.26 0.00 0.00 60.65 60.21 1y3n s ILE 385 Cb -0.05 -3.63 -0.10 0.00 1.25 0.00 0.00 42.46 39.94 1y3n s ILE 385 CO 0.12 0.11 1.85 -0.81 0.24 0.00 0.00 174.94 176.45 1y3n n PRO 386 N 0.23 1.01 -0.88 0.37 -0.04 -1.26 -4.83 135.00 129.61 1y3n n PRO 386 Ca -0.04 -0.60 0.00 0.00 -0.04 0.00 0.00 63.50 62.82 1y3n n PRO 386 Cb 0.51 -1.84 0.00 0.00 -0.04 0.00 0.00 33.50 32.13 1y3n n PRO 386 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1y3n n ILE 387 N 3.11 0.00 -2.67 0.52 -5.35 -1.26 -2.64 119.36 111.07 1y3n n ILE 387 Ca 0.22 0.00 -0.42 0.00 -0.27 0.00 0.00 62.75 62.28 1y3n n ILE 387 Cb 0.34 -1.11 -0.03 0.00 -1.74 0.00 0.00 39.64 37.09 1y3n n ILE 387 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1y3n s GLY 388 N -2.11 1.18 0.15 3.28 0.00 -1.26 -3.58 107.32 104.99 1y3n s GLY 388 Ca 0.00 -1.14 -0.18 0.00 0.00 0.00 0.00 44.72 43.40 1y3n s GLY 388 CO 0.00 2.37 0.48 -0.11 0.00 0.00 0.00 173.10 175.84 1y3n s PHE 389 N 4.75 -0.24 -0.39 1.90 -0.12 -1.08 -4.90 117.98 117.91 1y3n s PHE 389 Ca 0.36 -0.06 -0.09 0.00 -0.05 0.00 0.00 56.93 57.09 1y3n s PHE 389 Cb -0.10 0.36 0.05 0.00 -0.63 0.00 0.00 43.02 42.71 1y3n s PHE 389 CO 0.20 -0.80 0.22 -0.46 -0.05 0.00 0.00 175.22 174.33 1y3n s TRP 390 N -3.82 3.29 0.57 3.49 -0.00 -1.26 -0.81 118.94 120.41 1y3n s TRP 390 Ca 0.05 -1.30 -0.20 0.00 -0.00 0.00 0.00 56.10 54.64 1y3n s TRP 390 Cb 0.00 -2.66 -0.04 0.00 -0.00 0.00 0.00 33.47 30.77 1y3n s TRP 390 CO -0.09 -0.76 1.26 -1.14 -0.00 0.00 0.00 176.95 176.22 1y3n s GLN 391 N 1.47 3.06 -0.24 5.86 0.74 0.28 -4.92 119.66 125.91 1y3n s GLN 391 Ca 0.02 1.97 0.02 0.00 0.05 0.00 0.00 55.36 57.41 1y3n s GLN 391 Cb -0.21 -2.07 0.05 0.00 1.10 0.00 0.00 33.01 31.88 1y3n s GLN 391 CO 0.04 -1.17 -0.10 0.34 -0.55 0.00 0.00 175.29 173.85 1y3n s ASP 392 N -1.36 4.00 0.66 6.67 -1.08 -1.26 -4.32 116.67 119.98 1y3n s ASP 392 Ca 0.75 -1.19 0.38 0.00 -0.52 0.00 0.00 52.55 51.96 1y3n s ASP 392 Cb -0.34 -1.39 2.07 0.00 -1.46 0.00 0.00 42.92 41.81 1y3n s ASP 392 CO 0.38 -0.18 2.20 0.22 0.52 0.00 0.00 175.17 178.31 1y3n h TYR 393 N 7.87 0.00 0.00 -5.34 5.03 -1.96 -0.99 116.97 121.58 1y3n h TYR 393 Ca -0.22 0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.09 1y3n h TYR 393 Cb 1.07 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.35 1y3n h TYR 393 CO 0.57 0.00 -0.01 1.49 -1.32 0.00 0.00 178.16 178.88 1y3n h GLU 394 N 0.00 0.00 -0.58 1.82 4.57 -1.95 -0.00 114.58 118.44 1y3n h GLU 394 Ca 0.01 0.00 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 1y3n h GLU 394 Cb 0.27 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 1y3n h GLU 394 CO -0.00 0.01 0.04 0.10 -1.18 0.00 0.00 179.01 177.98 1y3n h TYR 395 N 0.00 1.05 0.07 0.92 -0.00 -1.56 -3.14 116.97 114.30 1y3n h TYR 395 Ca -0.00 -0.15 -0.27 0.00 0.00 0.00 0.00 58.73 58.31 1y3n h TYR 395 Cb 0.02 -0.28 0.02 0.00 0.00 0.00 0.00 36.73 36.49 1y3n h TYR 395 CO 0.00 0.92 -1.13 1.49 -0.00 0.00 0.00 178.16 179.44 1y3n h GLU 396 N 0.91 0.54 -0.96 0.10 4.81 -1.30 -3.30 114.58 115.38 1y3n h GLU 396 Ca 0.17 -0.67 0.11 0.00 -0.13 0.00 0.00 59.36 58.85 1y3n h GLU 396 Cb 0.47 0.21 -0.08 0.00 0.63 0.00 0.00 28.75 29.99 1y3n h GLU 396 CO 0.02 1.28 0.61 -0.09 -0.73 0.00 0.00 179.01 180.10 1y3n h ARG 397 N 0.26 0.91 -0.01 1.92 2.43 -1.03 -1.71 114.38 117.16 1y3n h ARG 397 Ca -0.14 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 58.98 1y3n h ARG 397 Cb 1.79 -0.20 -0.00 0.00 -0.42 0.00 0.00 29.97 31.14 1y3n h ARG 397 CO 0.21 0.60 0.01 1.96 -1.51 0.00 0.00 179.97 181.24 1y3n h GLN 398 N 0.93 0.00 0.00 0.20 4.20 -1.62 -2.59 115.11 116.24 1y3n h GLN 398 Ca 0.46 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 59.17 1y3n h GLN 398 Cb 0.48 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.26 1y3n h GLN 398 CO -0.23 0.00 -0.08 -2.67 -0.67 0.00 0.00 178.83 175.18 1y3n n TRP 399 N -3.69 0.00 -3.28 2.96 4.27 -0.68 -4.93 117.44 112.09 1y3n n TRP 399 Ca -0.03 -1.05 -0.45 0.00 -3.89 0.00 0.00 57.50 52.09 1y3n n TRP 399 Cb 0.09 -0.16 -0.06 0.00 -1.36 0.00 0.00 31.31 29.82 1y3n n TRP 399 CO 0.00 0.00 0.00 0.99 -2.29 0.00 0.00 177.69 176.39 1y3n s THR 400 N -2.87 5.09 1.05 -1.67 2.01 -0.98 -4.84 115.64 113.44 1y3n s THR 400 Ca 0.32 -1.02 -0.15 0.00 0.31 0.00 0.00 61.69 61.15 1y3n s THR 400 Cb 0.29 -4.26 0.22 0.00 0.01 0.00 0.00 72.50 68.75 1y3n s THR 400 CO 0.01 -0.77 1.14 0.54 -0.69 0.00 0.00 174.62 174.86 1y3n s ASN 401 N 2.98 2.24 0.30 3.53 2.20 -1.26 -4.65 114.94 120.27 1y3n s ASN 401 Ca 0.07 0.79 0.02 0.00 -0.94 0.00 0.00 52.86 52.80 1y3n s ASN 401 Cb -0.24 -1.19 0.56 0.00 -2.00 0.00 0.00 41.25 38.37 1y3n s ASN 401 CO 0.07 -3.32 1.88 0.44 -2.94 0.00 0.00 177.10 173.22 1y3n h ASP 402 N -2.03 0.90 -0.40 3.54 3.45 -1.98 0.88 116.42 120.77 1y3n h ASP 402 Ca -0.49 0.02 -0.01 0.00 0.43 0.00 0.00 57.03 56.99 1y3n h ASP 402 Cb 1.31 -0.16 -0.02 0.00 -0.56 0.00 0.00 39.33 39.89 1y3n h ASP 402 CO 0.47 0.53 0.22 0.58 -1.57 0.00 0.00 179.24 179.47 1y3n h VAL 403 N 1.00 1.15 -0.27 -1.35 2.07 -1.95 -0.60 116.25 116.30 1y3n h VAL 403 Ca 0.44 -0.41 -0.04 0.00 0.82 0.00 0.00 66.70 67.51 1y3n h VAL 403 Cb 0.35 0.69 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 1y3n h VAL 403 CO -0.19 0.16 -0.00 0.00 0.02 0.00 0.00 177.57 177.56 1y3n h ALA 404 N 1.07 0.37 -0.52 1.67 0.00 -1.61 -2.38 119.26 117.86 1y3n h ALA 404 Ca 0.14 -0.23 0.04 0.00 0.00 0.00 0.00 54.91 54.87 1y3n h ALA 404 Cb 0.07 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 17.71 1y3n h ALA 404 CO -0.02 0.11 0.27 -0.07 0.00 0.00 0.00 179.25 179.54 1y3n h LEU 405 N 0.26 0.40 -1.12 0.00 3.38 -0.66 0.16 115.31 117.74 1y3n h LEU 405 Ca 0.08 0.03 -0.08 0.00 0.09 0.00 0.00 57.88 57.99 1y3n h LEU 405 Cb 0.43 -0.05 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1y3n h LEU 405 CO 0.01 0.27 -0.25 1.56 0.09 0.00 0.00 178.44 180.12 1y3n h GLN 406 N 0.53 0.30 -0.22 1.13 4.20 -1.08 0.33 115.11 120.30 1y3n h GLN 406 Ca 0.23 -0.10 -0.07 0.00 0.06 0.00 0.00 58.65 58.77 1y3n h GLN 406 Cb 0.13 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1y3n h GLN 406 CO -0.15 0.54 -0.14 0.78 -0.67 0.00 0.00 178.83 179.19 1y3n h GLY 407 N 0.99 0.51 0.86 3.46 0.00 -0.83 -1.22 103.07 106.85 1y3n h GLY 407 Ca 0.04 -0.48 0.02 0.00 0.00 0.00 0.00 47.33 46.91 1y3n h GLY 407 CO 0.04 0.44 0.14 -2.22 0.00 0.00 0.00 176.54 174.94 1y3n h ILE 408 N 0.17 0.99 -0.91 2.60 2.04 -0.66 -1.27 117.51 120.47 1y3n h ILE 408 Ca 0.04 -0.10 -0.02 0.00 1.00 0.00 0.00 64.86 65.78 1y3n h ILE 408 Cb 0.65 0.66 -0.04 0.00 -0.74 0.00 0.00 36.82 37.35 1y3n h ILE 408 CO 0.04 0.05 0.50 0.44 0.00 0.00 0.00 178.15 179.18 1y3n h ASP 409 N 0.30 1.13 -0.40 1.72 3.32 -0.87 -1.15 116.42 120.47 1y3n h ASP 409 Ca 0.12 -0.10 -0.02 0.00 0.02 0.00 0.00 57.03 57.05 1y3n h ASP 409 Cb 0.04 -0.29 -0.02 0.00 0.22 0.00 0.00 39.33 39.29 1y3n h ASP 409 CO -0.09 0.91 0.16 -0.03 -1.72 0.00 0.00 179.24 178.47 1y3n h MET 410 N 1.27 0.60 -0.72 3.56 4.05 -0.80 0.74 114.93 123.62 1y3n h MET 410 Ca 0.32 -0.11 -0.07 0.00 -0.28 0.00 0.00 59.70 59.56 1y3n h MET 410 Cb 0.03 -0.10 -0.03 0.00 -0.80 0.00 0.00 31.60 30.70 1y3n h MET 410 CO -0.05 0.57 0.18 1.88 0.23 0.00 0.00 176.91 179.71 1y3n h TYR 411 N 0.50 1.20 -0.18 1.39 -1.99 -0.93 -0.74 116.97 116.22 1y3n h TYR 411 Ca 0.13 -0.14 -0.04 0.00 2.00 0.00 0.00 58.73 60.68 1y3n h TYR 411 Cb 0.19 -0.34 -0.01 0.00 2.00 0.00 0.00 36.73 38.58 1y3n h TYR 411 CO -0.00 0.97 -0.04 0.82 -0.00 0.00 0.00 178.16 179.92 1y3n h ILE 412 N 1.09 1.28 -0.49 -2.88 2.04 -1.04 -2.24 117.51 115.28 1y3n h ILE 412 Ca 0.23 -0.99 -0.01 0.00 1.00 0.00 0.00 64.86 65.09 1y3n h ILE 412 Cb 0.37 1.56 -0.02 0.00 -0.74 0.00 0.00 36.82 37.99 1y3n h ILE 412 CO 0.00 0.30 0.27 0.50 0.00 0.00 0.00 178.15 179.22 1y3n h LYS 413 N 0.07 0.68 -0.10 2.37 3.64 -0.70 -2.94 116.57 119.60 1y3n h LYS 413 Ca 0.05 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.35 1y3n h LYS 413 Cb 0.47 -0.13 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1y3n h LYS 413 CO 0.02 0.53 0.00 0.09 -2.27 0.00 0.00 179.45 177.82 1y3n n ASN 414 N -4.66 1.35 -3.95 4.20 3.02 -0.30 -4.97 115.26 109.96 1y3n n ASN 414 Ca 0.02 -1.58 -0.27 0.00 -0.03 0.00 0.00 54.58 52.72 1y3n n ASN 414 Cb 0.08 -0.06 -0.02 0.00 -0.61 0.00 0.00 39.78 39.18 1y3n n ASN 414 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1y3n n LYS 415 N 0.09 -2.79 0.12 3.52 5.02 -0.85 -4.89 118.16 118.39 1y3n n LYS 415 Ca 0.17 0.38 -0.02 0.00 -2.02 0.00 0.00 58.31 56.82 1y3n n LYS 415 Cb 0.30 -4.35 0.12 0.00 -0.02 0.00 0.00 35.03 31.08 1y3n n LYS 415 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 1y3n h TYR 416 N -1.87 0.00 -2.56 2.13 0.99 -1.84 -3.45 116.97 110.38 1y3n h TYR 416 Ca -0.64 0.00 -0.54 0.00 2.00 0.00 0.00 58.73 59.55 1y3n h TYR 416 Cb 1.38 0.00 0.02 0.00 1.00 0.00 0.00 36.73 39.12 1y3n h TYR 416 CO 0.47 0.68 1.10 0.08 -0.00 0.00 0.00 178.16 180.49 1y3n s VAL 417 N -3.43 3.11 0.57 -2.88 1.01 -1.25 -1.86 120.40 115.67 1y3n s VAL 417 Ca -0.01 0.36 -0.17 0.00 0.00 0.00 0.00 61.98 62.16 1y3n s VAL 417 Cb 0.12 -3.23 -0.05 0.00 0.00 0.00 0.00 36.38 33.22 1y3n s VAL 417 CO 0.77 -0.02 1.07 -0.76 0.00 0.00 0.00 175.10 176.16 1y3n s LEU 418 N 3.54 3.60 0.31 3.92 1.43 -0.59 -4.94 118.68 125.94 1y3n s LEU 418 Ca 0.79 1.91 -0.30 0.00 -1.03 0.00 0.00 54.13 55.51 1y3n s LEU 418 Cb -0.40 -4.55 -0.12 0.00 0.03 0.00 0.00 46.19 41.16 1y3n s LEU 418 CO 0.35 -1.14 1.50 -2.65 0.23 0.00 0.00 176.35 174.63 1y3n n PRO 419 N -1.73 2.49 -3.49 1.29 -0.02 -1.26 -4.96 135.00 127.32 1y3n n PRO 419 Ca 0.09 0.88 -0.31 0.00 -2.02 0.00 0.00 63.50 62.14 1y3n n PRO 419 Cb 0.52 -2.60 -0.05 0.00 -0.02 0.00 0.00 33.50 31.35 1y3n n PRO 419 CO 0.00 0.00 0.00 -0.65 1.98 0.00 0.00 175.50 176.83 1y3n s GLN 420 N -0.98 3.72 -0.11 -0.52 -1.52 -1.26 -4.99 119.66 114.00 1y3n s GLN 420 Ca 0.62 0.13 -0.30 0.00 -1.95 0.00 0.00 55.36 53.86 1y3n s GLN 420 Cb -0.53 -2.71 -0.02 0.00 -0.22 0.00 0.00 33.01 29.53 1y3n s GLN 420 CO 0.53 0.35 1.09 0.12 -0.25 0.00 0.00 175.29 177.14 1y3n s PHE 421 N -1.79 3.35 -1.09 0.91 5.99 -0.06 -4.93 117.98 120.35 1y3n s PHE 421 Ca 0.45 1.42 0.18 0.00 0.00 0.00 0.00 56.93 58.99 1y3n s PHE 421 Cb -0.11 -3.29 0.74 0.00 0.00 0.00 0.00 43.02 40.35 1y3n s PHE 421 CO 0.23 -0.69 1.65 0.25 -0.00 0.00 0.00 175.22 176.66 1y3n n THR 422 N 4.73 1.91 -0.24 0.12 -2.24 -1.26 -4.77 114.28 112.52 1y3n n THR 422 Ca 0.10 -1.21 0.03 0.00 -2.27 0.00 0.00 64.05 60.70 1y3n n THR 422 Cb 0.47 0.10 -0.01 0.00 -2.10 0.00 0.00 70.33 68.80 1y3n n THR 422 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1y3n n GLY 423 N 1.13 -1.89 3.38 3.38 0.00 -1.26 -4.98 105.19 104.95 1y3n n GLY 423 Ca 0.26 -1.44 -0.19 0.00 0.00 0.00 0.00 46.02 44.65 1y3n n GLY 423 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1y3n s VAL 424 N -1.96 0.96 -0.42 1.61 -7.23 -1.26 -5.07 120.40 107.04 1y3n s VAL 424 Ca 0.00 -2.01 -0.06 0.00 -1.81 0.00 0.00 61.98 58.10 1y3n s VAL 424 Cb 0.00 -2.64 0.09 0.00 0.56 0.00 0.00 36.38 34.39 1y3n s VAL 424 CO 0.00 -0.08 0.24 0.20 -0.31 0.00 0.00 175.10 175.15 1y3n s ASN 425 N -3.39 5.46 0.29 4.85 0.02 -1.26 -5.07 114.94 115.83 1y3n s ASN 425 Ca 0.35 -1.74 -0.18 0.00 -1.02 0.00 0.00 52.86 50.27 1y3n s ASN 425 Cb 0.08 -1.92 -0.09 0.00 0.02 0.00 0.00 41.25 39.34 1y3n s ASN 425 CO 0.13 -0.55 0.76 -0.76 0.02 0.00 0.00 177.10 176.70 1y3n s LEU 426 N 1.30 4.18 0.96 0.60 1.43 -1.26 -4.80 118.68 121.10 1y3n s LEU 426 Ca 0.05 1.40 -0.16 0.00 -1.03 0.00 0.00 54.13 54.39 1y3n s LEU 426 Cb -0.23 -3.91 0.19 0.00 0.03 0.00 0.00 46.19 42.27 1y3n s LEU 426 CO -0.01 -0.11 1.28 0.42 0.23 0.00 0.00 176.35 178.16 1y3n s THR 427 N -1.79 1.96 0.14 5.49 -4.23 -1.26 -4.37 115.64 111.58 1y3n s THR 427 Ca 0.50 0.00 -0.14 0.00 -1.18 0.00 0.00 61.69 60.87 1y3n s THR 427 Cb -0.13 -2.94 0.01 0.00 1.34 0.00 0.00 72.50 70.77 1y3n s THR 427 CO 0.19 0.00 1.62 0.58 -0.54 0.00 0.00 174.62 176.47 1y3n h VAL 428 N -1.66 1.25 -0.65 2.29 2.07 -1.99 -0.40 116.25 117.16 1y3n h VAL 428 Ca -0.45 -0.91 -0.09 0.00 0.82 0.00 0.00 66.70 66.08 1y3n h VAL 428 Cb 1.26 0.96 -0.02 0.00 -1.52 0.00 0.00 31.29 31.96 1y3n h VAL 428 CO 0.42 0.32 0.07 -0.33 0.02 0.00 0.00 177.57 178.07 1y3n h GLU 429 N 0.61 1.11 -0.53 1.57 3.07 -1.99 -1.79 114.58 116.63 1y3n h GLU 429 Ca 0.14 -0.32 -0.05 0.00 -0.50 0.00 0.00 59.36 58.63 1y3n h GLU 429 Cb 0.39 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 28.16 1y3n h GLU 429 CO 0.01 1.04 0.13 0.93 -1.40 0.00 0.00 179.01 179.71 1y3n h GLU 430 N 1.02 0.84 -0.30 2.33 5.08 -1.89 -2.60 114.58 119.07 1y3n h GLU 430 Ca 0.19 -0.20 -0.02 0.00 -1.00 0.00 0.00 59.36 58.33 1y3n h GLU 430 Cb 0.49 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1y3n h GLU 430 CO 0.02 0.80 0.11 -0.09 -1.00 0.00 0.00 179.01 178.85 1y3n h ARG 431 N 0.74 0.42 -0.98 2.33 9.65 -0.77 -2.21 114.38 123.55 1y3n h ARG 431 Ca 0.17 -0.05 0.02 0.00 -1.10 0.00 0.00 59.98 59.02 1y3n h ARG 431 Cb 0.33 -0.08 -0.05 0.00 -1.39 0.00 0.00 29.97 28.78 1y3n h ARG 431 CO 0.00 0.36 0.65 0.93 2.80 0.00 0.00 179.97 184.71 1y3n h GLU 432 N 0.42 1.26 -0.34 0.20 5.08 -0.93 0.52 114.58 120.79 1y3n h GLU 432 Ca 0.10 -0.08 -0.12 0.00 -1.00 0.00 0.00 59.36 58.27 1y3n h GLU 432 Cb 0.11 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.07 1y3n h GLU 432 CO -0.01 0.84 -0.26 0.82 -1.00 0.00 0.00 179.01 179.39 1y3n h ILE 433 N 1.30 1.29 0.31 3.13 1.08 -1.36 -2.14 117.51 121.12 1y3n h ILE 433 Ca 0.37 -1.42 -0.01 0.00 -0.39 0.00 0.00 64.86 63.41 1y3n h ILE 433 Cb -0.10 1.45 0.00 0.00 -3.07 0.00 0.00 36.82 35.11 1y3n h ILE 433 CO -0.10 0.46 -0.17 0.22 -0.69 0.00 0.00 178.15 177.88 1y3n h TYR 434 N 0.55 -0.43 0.00 1.37 5.03 -0.88 -1.87 116.97 120.74 1y3n h TYR 434 Ca 0.06 -0.01 -0.04 0.00 2.58 0.00 0.00 58.73 61.33 1y3n h TYR 434 Cb 0.83 0.15 -0.01 0.00 1.55 0.00 0.00 36.73 39.25 1y3n h TYR 434 CO 0.07 -0.27 -0.19 -0.44 -1.32 0.00 0.00 178.16 176.01 1y3n h ASP 435 N -0.45 0.00 -0.01 -2.11 3.32 -0.96 -0.75 116.42 115.46 1y3n h ASP 435 Ca -0.04 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.76 1y3n h ASP 435 Cb 0.35 0.00 0.02 0.00 0.22 0.00 0.00 39.33 39.92 1y3n h ASP 435 CO 0.06 0.19 -0.96 0.50 -1.72 0.00 0.00 179.24 177.31 1y3n h LYS 436 N 0.00 0.67 0.00 3.56 3.64 -1.09 -3.42 116.57 119.92 1y3n h LYS 436 Ca -0.00 -0.70 -0.21 0.00 -1.27 0.00 0.00 60.65 58.46 1y3n h LYS 436 Cb 0.54 0.20 -0.04 0.00 -0.41 0.00 0.00 32.23 32.52 1y3n h LYS 436 CO 0.02 1.29 -1.81 0.66 -2.27 0.00 0.00 179.45 177.35 1y3n n TYR 437 N -3.92 0.00 -0.04 1.91 4.02 -0.73 -4.82 117.16 113.58 1y3n n TYR 437 Ca -0.11 0.00 -0.09 0.00 -0.01 0.00 0.00 57.90 57.69 1y3n n TYR 437 Cb 0.84 -0.55 -0.03 0.00 -0.02 0.00 0.00 39.34 39.58 1y3n n TYR 437 CO 0.00 0.00 0.00 2.35 -1.01 0.00 0.00 176.86 178.20 1y3n h TRP 438 N 0.00 -0.84 -0.73 -0.72 -0.00 -1.31 -2.27 115.95 110.08 1y3n h TRP 438 Ca -0.32 0.04 0.14 0.00 -0.00 0.00 0.00 58.89 58.75 1y3n h TRP 438 Cb 1.50 0.40 -0.14 0.00 -0.00 0.00 0.00 29.16 30.93 1y3n h TRP 438 CO 0.02 -0.38 -0.27 -1.35 -0.00 0.00 0.00 178.44 176.46 1y3n h PRO 439 N -0.32 -0.06 -0.11 2.65 0.11 -1.82 0.65 132.00 133.10 1y3n h PRO 439 Ca 0.13 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.13 1y3n h PRO 439 Cb 0.53 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.64 1y3n h PRO 439 CO -0.41 -0.04 -0.44 -0.44 -0.21 0.00 0.00 178.00 176.45 1y3n h ASP 440 N -0.06 0.27 -0.41 -2.05 3.32 -1.83 -2.46 116.42 113.19 1y3n h ASP 440 Ca 0.32 -0.12 -0.12 0.00 0.02 0.00 0.00 57.03 57.12 1y3n h ASP 440 Cb 0.56 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 40.03 1y3n h ASP 440 CO -0.78 0.68 -0.22 0.58 -1.72 0.00 0.00 179.24 177.79 1y3n h VAL 441 N 0.21 1.28 -0.49 -1.35 2.07 -0.60 -1.66 116.25 115.70 1y3n h VAL 441 Ca 0.02 -1.37 0.00 0.00 0.82 0.00 0.00 66.70 66.17 1y3n h VAL 441 Cb 0.87 1.27 -0.02 0.00 -1.52 0.00 0.00 31.29 31.89 1y3n h VAL 441 CO 0.07 0.46 0.32 0.50 0.02 0.00 0.00 177.57 178.93 1y3n h LYS 442 N 0.69 0.65 -0.62 1.57 3.64 -0.80 0.83 116.57 122.54 1y3n h LYS 442 Ca 0.09 -0.04 -0.04 0.00 -1.27 0.00 0.00 60.65 59.39 1y3n h LYS 442 Cb 0.78 -0.14 -0.03 0.00 -0.41 0.00 0.00 32.23 32.43 1y3n h LYS 442 CO 0.06 0.44 0.25 1.15 -2.27 0.00 0.00 179.45 179.08 1y3n h THR 443 N 0.66 1.23 -0.69 1.00 2.02 -1.35 -2.10 112.91 113.68 1y3n h THR 443 Ca 0.18 -0.72 -0.05 0.00 0.77 0.00 0.00 66.41 66.59 1y3n h THR 443 Cb -0.06 0.56 -0.03 0.00 -1.74 0.00 0.00 68.15 66.88 1y3n h THR 443 CO -0.04 0.28 0.25 0.22 0.37 0.00 0.00 175.52 176.61 1y3n h TYR 444 N 0.86 1.07 -0.71 3.16 3.20 -0.81 -2.02 116.97 121.72 1y3n h TYR 444 Ca 0.21 -0.09 -0.02 0.00 3.14 0.00 0.00 58.73 61.96 1y3n h TYR 444 Cb 0.20 -0.32 -0.03 0.00 1.54 0.00 0.00 36.73 38.12 1y3n h TYR 444 CO 0.01 0.84 0.36 0.52 -1.64 0.00 0.00 178.16 178.25 1y3n h MET 445 N 0.99 1.02 -0.21 1.82 2.86 -0.58 -1.01 114.93 119.83 1y3n h MET 445 Ca 0.23 -0.14 -0.01 0.00 -2.06 0.00 0.00 59.70 57.72 1y3n h MET 445 Cb 0.25 -0.19 -0.01 0.00 0.06 0.00 0.00 31.60 31.71 1y3n h MET 445 CO -0.01 0.79 0.11 0.35 1.06 0.00 0.00 176.91 179.20 1y3n h PHE 446 N 0.99 0.29 -0.61 -0.22 3.57 -1.15 0.45 116.94 120.26 1y3n h PHE 446 Ca 0.25 -0.01 0.05 0.00 3.53 0.00 0.00 57.97 61.79 1y3n h PHE 446 Cb 0.10 -0.09 -0.05 0.00 2.79 0.00 0.00 35.95 38.70 1y3n h PHE 446 CO 0.00 0.27 0.34 0.93 -2.23 0.00 0.00 178.31 177.63 1y3n h GLU 447 N 0.22 0.62 -0.33 1.11 5.08 -1.00 0.53 114.58 120.81 1y3n h GLU 447 Ca 0.07 -0.04 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 1y3n h GLU 447 Cb 0.09 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.18 1y3n h GLU 447 CO -0.01 0.41 0.02 0.52 -1.00 0.00 0.00 179.01 178.95 1y3n h MET 448 N 0.64 0.58 -0.57 2.33 2.86 -1.00 -1.70 114.93 118.06 1y3n h MET 448 Ca 0.27 -0.17 0.06 0.00 -2.06 0.00 0.00 59.70 57.80 1y3n h MET 448 Cb 0.14 -0.06 -0.06 0.00 0.06 0.00 0.00 31.60 31.69 1y3n h MET 448 CO -0.16 0.69 0.27 0.78 1.06 0.00 0.00 176.91 179.54 1y3n h GLY 449 N 0.39 0.81 1.00 8.32 0.00 -0.32 0.27 103.07 113.54 1y3n h GLY 449 Ca 0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.21 1y3n h GLY 449 CO 0.01 0.08 0.23 -1.61 0.00 0.00 0.00 176.54 175.25 1y3n h GLN 450 N 0.51 0.92 -0.88 4.80 4.15 -0.74 -1.67 115.11 122.20 1y3n h GLN 450 Ca 0.27 -0.18 0.00 0.00 0.77 0.00 0.00 58.65 59.51 1y3n h GLN 450 Cb 0.23 -0.15 -0.04 0.00 0.21 0.00 0.00 27.48 27.73 1y3n h GLN 450 CO -0.21 0.79 0.56 0.77 -1.93 0.00 0.00 178.83 178.81 1y3n h SER 451 N 0.85 1.04 -0.39 -0.69 0.02 -0.54 -1.02 113.55 112.83 1y3n h SER 451 Ca 0.20 -0.05 -0.08 0.00 -0.84 0.00 0.00 61.79 61.03 1y3n h SER 451 Cb 0.23 -0.26 -0.01 0.00 0.14 0.00 0.00 62.40 62.49 1y3n h SER 451 CO -0.01 0.78 -0.06 -0.50 -1.14 0.00 0.00 176.83 175.89 1y3n h TRP 452 N 1.21 0.81 -0.46 3.45 6.55 -0.64 -1.46 115.95 125.40 1y3n h TRP 452 Ca 0.32 -0.16 -0.04 0.00 0.95 0.00 0.00 58.89 59.96 1y3n h TRP 452 Cb -0.10 -0.20 -0.02 0.00 -0.86 0.00 0.00 29.16 27.98 1y3n h TRP 452 CO -0.00 0.84 0.13 0.28 -1.05 0.00 0.00 178.44 178.64 1y3n h VAL 453 N 0.54 1.23 0.00 1.49 2.07 -1.03 -2.84 116.25 117.70 1y3n h VAL 453 Ca 0.10 -0.77 0.00 0.00 0.82 0.00 0.00 66.70 66.85 1y3n h VAL 453 Cb 0.56 0.86 0.00 0.00 -1.52 0.00 0.00 31.29 31.19 1y3n h VAL 453 CO 0.03 0.28 0.00 0.23 0.02 0.00 0.00 177.57 178.13 1y3n n MET 454 N -4.53 0.32 -0.89 1.57 2.81 -0.41 -4.51 117.12 111.49 1y3n n MET 454 Ca 0.01 0.01 0.00 0.00 -1.81 0.00 0.00 57.70 55.91 1y3n n MET 454 Cb 0.20 -1.50 0.00 0.00 -0.71 0.00 0.00 33.22 31.21 1y3n n MET 454 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1y3n n GLY 455 N 1.22 0.73 0.14 3.03 0.00 -0.63 -4.91 105.19 104.77 1y3n n GLY 455 Ca 0.12 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.27 1y3n n GLY 455 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1y3n h THR 456 N 0.00 0.00 -3.56 2.61 1.35 -1.62 -3.42 112.91 108.27 1y3n h THR 456 Ca 0.00 -0.38 -0.24 0.00 -0.55 0.00 0.00 66.41 65.24 1y3n h THR 456 Cb 0.00 1.24 -0.30 0.00 -1.73 0.00 0.00 68.15 67.36 1y3n h THR 456 CO 0.00 0.00 -0.68 -0.54 -0.25 0.00 0.00 175.52 174.05 1y3n s LYS 457 N -3.26 0.03 -0.29 4.72 1.02 -1.12 -5.02 119.74 115.82 1y3n s LYS 457 Ca 0.06 0.13 -0.21 0.00 0.02 0.00 0.00 55.97 55.97 1y3n s LYS 457 Cb 0.10 -0.07 -0.01 0.00 -0.52 0.00 0.00 37.83 37.33 1y3n s LYS 457 CO 0.49 -0.07 0.68 0.34 -0.92 0.00 0.00 175.35 175.87 1y3n s ASP 458 N 0.44 6.57 0.39 2.83 3.68 -1.26 -4.08 116.67 125.24 1y3n s ASP 458 Ca -0.04 0.58 0.10 0.00 2.13 0.00 0.00 52.55 55.32 1y3n s ASP 458 Cb -0.05 -2.36 0.89 0.00 -1.45 0.00 0.00 42.92 39.95 1y3n s ASP 458 CO -0.01 -0.49 1.94 1.55 0.13 0.00 0.00 175.17 178.29 1y3n h PRO 459 N 8.08 0.57 -0.03 4.34 0.13 -1.93 -0.74 132.00 142.43 1y3n h PRO 459 Ca -0.26 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.83 1y3n h PRO 459 Cb 1.11 -0.13 -0.00 0.00 0.13 0.00 0.00 31.00 32.11 1y3n h PRO 459 CO 0.82 0.38 -0.00 0.93 -0.23 0.00 0.00 178.00 179.89 1y3n h GLU 460 N 0.59 0.05 0.00 0.86 4.39 -1.93 -1.59 114.58 116.96 1y3n h GLU 460 Ca 0.33 -0.02 -0.09 0.00 0.34 0.00 0.00 59.36 59.93 1y3n h GLU 460 Cb 0.50 -0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.14 1y3n h GLU 460 CO -0.11 0.39 -0.41 0.87 -1.16 0.00 0.00 179.01 178.59 1y3n h LYS 461 N -0.29 0.00 -0.02 2.33 1.57 -1.90 -3.24 116.57 115.02 1y3n h LYS 461 Ca 0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1y3n h LYS 461 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1y3n h LYS 461 CO 0.00 0.41 -0.33 0.25 -0.57 0.00 0.00 179.45 179.21 1y3n n THR 462 N -3.76 0.00 -0.35 -0.16 -2.24 -0.31 -4.58 114.28 102.87 1y3n n THR 462 Ca -0.01 -0.33 0.02 0.00 -2.27 0.00 0.00 64.05 61.46 1y3n n THR 462 Cb 0.48 1.32 0.17 0.00 -2.10 0.00 0.00 70.33 70.20 1y3n n THR 462 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1y3n h TRP 463 N 3.02 1.14 -0.30 4.78 2.91 -1.31 -0.18 115.95 126.01 1y3n h TRP 463 Ca 0.00 0.03 -0.05 0.00 1.13 0.00 0.00 58.89 60.00 1y3n h TRP 463 Cb 0.81 -0.37 -0.01 0.00 -0.51 0.00 0.00 29.16 29.07 1y3n h TRP 463 CO 0.00 0.58 -0.02 -0.91 -1.03 0.00 0.00 178.44 177.06 1y3n h ASN 464 N 1.11 0.53 -0.92 2.65 2.35 -1.82 -0.71 115.58 118.78 1y3n h ASN 464 Ca 0.42 -0.32 -0.00 0.00 -0.55 0.00 0.00 56.30 55.85 1y3n h ASN 464 Cb 0.19 -0.14 -0.04 0.00 0.05 0.00 0.00 38.32 38.37 1y3n h ASN 464 CO -0.18 0.73 0.56 -0.78 -1.65 0.00 0.00 177.43 176.11 1y3n h ASP 465 N 0.33 1.09 0.03 5.81 3.58 -1.78 -1.42 116.42 124.06 1y3n h ASP 465 Ca 0.08 -0.06 -0.00 0.00 0.42 0.00 0.00 57.03 57.47 1y3n h ASP 465 Cb 0.46 -0.28 0.00 0.00 1.72 0.00 0.00 39.33 41.24 1y3n h ASP 465 CO 0.02 0.83 -0.02 0.22 -2.88 0.00 0.00 179.24 177.42 1y3n h TYR 466 N 1.26 -0.04 -0.66 0.28 3.20 -0.77 0.38 116.97 120.61 1y3n h TYR 466 Ca 0.33 -0.00 -0.02 0.00 3.14 0.00 0.00 58.73 62.18 1y3n h TYR 466 Cb -0.07 0.01 -0.03 0.00 1.54 0.00 0.00 36.73 38.18 1y3n h TYR 466 CO 0.00 -0.02 0.34 1.96 -1.64 0.00 0.00 178.16 178.80 1y3n h GLN 467 N -0.05 0.93 -0.44 1.82 1.08 -0.89 0.72 115.11 118.27 1y3n h GLN 467 Ca -0.00 -0.11 -0.05 0.00 -1.45 0.00 0.00 58.65 57.03 1y3n h GLN 467 Cb 0.04 -0.18 -0.02 0.00 -0.05 0.00 0.00 27.48 27.27 1y3n h GLN 467 CO 0.01 0.70 0.08 0.37 -0.95 0.00 0.00 178.83 179.04 1y3n h GLN 468 N 0.93 0.73 -0.53 1.46 4.15 -0.90 -2.00 115.11 118.94 1y3n h GLN 468 Ca 0.23 -0.19 -0.07 0.00 0.77 0.00 0.00 58.65 59.39 1y3n h GLN 468 Cb 0.06 -0.09 -0.02 0.00 0.21 0.00 0.00 27.48 27.64 1y3n h GLN 468 CO -0.03 0.75 0.04 1.96 -1.93 0.00 0.00 178.83 179.62 1y3n h GLN 469 N 0.59 0.87 -0.76 1.69 1.08 -0.28 -0.94 115.11 117.36 1y3n h GLN 469 Ca 0.13 -0.23 -0.00 0.00 -1.45 0.00 0.00 58.65 57.11 1y3n h GLN 469 Cb 0.37 -0.11 -0.04 0.00 -0.05 0.00 0.00 27.48 27.66 1y3n h GLN 469 CO 0.01 0.84 0.47 -0.07 -0.95 0.00 0.00 178.83 179.13 1y3n h LEU 470 N 0.82 0.89 -0.28 1.46 3.38 -0.58 0.72 115.31 121.72 1y3n h LEU 470 Ca 0.16 -0.05 -0.05 0.00 0.09 0.00 0.00 57.88 58.03 1y3n h LEU 470 Cb 0.43 -0.22 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 1y3n h LEU 470 CO 0.01 0.68 -0.03 0.50 0.09 0.00 0.00 178.44 179.69 1y3n h LYS 471 N 1.03 0.52 0.00 1.13 3.64 -0.96 0.11 116.57 122.03 1y3n h LYS 471 Ca 0.27 -0.18 -0.05 0.00 -1.27 0.00 0.00 60.65 59.42 1y3n h LYS 471 Cb -0.06 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 31.71 1y3n h LYS 471 CO -0.05 0.70 -0.26 -0.91 -2.27 0.00 0.00 179.45 176.66 1y3n h ASN 472 N 0.29 0.00 -0.00 4.20 4.21 -0.88 -2.29 115.58 121.11 1y3n h ASN 472 Ca 0.08 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.59 1y3n h ASN 472 Cb 0.49 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 37.69 1y3n h ASN 472 CO 0.02 0.26 -0.00 0.54 -1.29 0.00 0.00 177.43 176.95 1y3n n ARG 473 N -4.23 1.38 -0.58 0.81 1.74 0.22 -4.93 116.66 111.08 1y3n n ARG 473 Ca -0.02 -0.57 0.00 0.00 -0.77 0.00 0.00 57.85 56.49 1y3n n ARG 473 Cb 0.31 -1.49 0.00 0.00 -1.02 0.00 0.00 32.46 30.26 1y3n n ARG 473 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1y3n n GLY 474 N 1.11 0.69 0.13 -0.13 0.00 -0.86 -4.78 105.19 101.35 1y3n n GLY 474 Ca 0.21 -0.16 -0.08 0.00 0.00 0.00 0.00 46.02 45.98 1y3n n GLY 474 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1y3n h PHE 475 N 0.00 0.21 0.00 1.61 3.04 -0.99 -2.33 116.94 118.47 1y3n h PHE 475 Ca 0.00 0.01 -0.01 0.00 3.98 0.00 0.00 57.97 61.95 1y3n h PHE 475 Cb 0.00 -0.05 -0.00 0.00 2.56 0.00 0.00 35.95 38.46 1y3n h PHE 475 CO 0.00 0.11 -0.06 1.88 -2.02 0.00 0.00 178.31 178.22 1y3n h TYR 476 N 0.25 0.00 -0.25 0.41 -1.99 -1.85 -0.68 116.97 112.87 1y3n h TYR 476 Ca 0.12 0.00 -0.18 0.00 2.00 0.00 0.00 58.73 60.67 1y3n h TYR 476 Cb 0.07 0.00 -0.00 0.00 2.00 0.00 0.00 36.73 38.80 1y3n h TYR 476 CO -0.12 0.06 -0.57 1.96 -0.00 0.00 0.00 178.16 179.49 1y3n h GLN 477 N 0.00 0.78 -0.21 4.88 4.20 -1.79 -1.61 115.11 121.37 1y3n h GLN 477 Ca -0.00 -0.51 -0.03 0.00 0.06 0.00 0.00 58.65 58.17 1y3n h GLN 477 Cb 0.53 0.06 -0.01 0.00 0.30 0.00 0.00 27.48 28.36 1y3n h GLN 477 CO 0.01 1.13 0.02 0.28 -0.67 0.00 0.00 178.83 179.60 1y3n h VAL 478 N 0.59 1.24 -0.92 -0.54 2.07 -0.89 -2.76 116.25 115.05 1y3n h VAL 478 Ca 0.01 -0.79 0.07 0.00 0.82 0.00 0.00 66.70 66.80 1y3n h VAL 478 Cb 1.16 1.36 -0.06 0.00 -1.52 0.00 0.00 31.29 32.24 1y3n h VAL 478 CO 0.12 0.24 0.60 0.24 0.02 0.00 0.00 177.57 178.79 1y3n h MET 479 N 0.13 1.01 -0.26 1.57 2.86 -1.05 -0.85 114.93 118.33 1y3n h MET 479 Ca 0.06 -0.06 -0.01 0.00 -2.06 0.00 0.00 59.70 57.63 1y3n h MET 479 Cb 0.35 -0.23 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 1y3n h MET 479 CO 0.01 0.67 0.12 0.82 1.06 0.00 0.00 176.91 179.58 1y3n h ILE 480 N 1.04 1.15 -0.21 -1.22 2.04 -1.10 -1.13 117.51 118.07 1y3n h ILE 480 Ca 0.40 -0.43 -0.13 0.00 1.00 0.00 0.00 64.86 65.70 1y3n h ILE 480 Cb 0.21 0.96 -0.01 0.00 -0.74 0.00 0.00 36.82 37.24 1y3n h ILE 480 CO -0.15 0.15 -0.42 -0.37 0.00 0.00 0.00 178.15 177.36 1y3n h VAL 481 N 0.28 1.31 -0.74 1.67 -1.51 -1.18 -1.84 116.25 114.25 1y3n h VAL 481 Ca 0.09 -1.59 0.00 0.00 -1.23 0.00 0.00 66.70 63.97 1y3n h VAL 481 Cb 0.12 1.60 -0.04 0.00 -2.13 0.00 0.00 31.29 30.85 1y3n h VAL 481 CO -0.01 0.50 0.46 0.24 -1.23 0.00 0.00 177.57 177.53 1y3n h MET 482 N 0.41 0.99 -0.47 5.19 2.86 -0.97 -0.39 114.93 122.56 1y3n h MET 482 Ca 0.03 -0.08 -0.13 0.00 -2.06 0.00 0.00 59.70 57.47 1y3n h MET 482 Cb 0.91 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 32.34 1y3n h MET 482 CO 0.08 0.68 -0.21 0.37 1.06 0.00 0.00 176.91 178.89 1y3n h GLN 483 N 1.00 0.97 -0.38 1.72 5.75 -0.98 -1.75 115.11 121.44 1y3n h GLN 483 Ca 0.27 -0.42 -0.01 0.00 -0.15 0.00 0.00 58.65 58.34 1y3n h GLN 483 Cb -0.07 -0.03 -0.02 0.00 1.07 0.00 0.00 27.48 28.44 1y3n h GLN 483 CO -0.05 1.09 0.20 0.87 -2.65 0.00 0.00 178.83 178.28 1y3n h LYS 484 N 0.81 0.53 -0.48 1.69 1.57 -0.93 -0.49 116.57 119.28 1y3n h LYS 484 Ca 0.11 -0.07 -0.03 0.00 -1.87 0.00 0.00 60.65 58.79 1y3n h LYS 484 Cb 0.79 -0.10 -0.02 0.00 0.08 0.00 0.00 32.23 32.97 1y3n h LYS 484 CO 0.07 0.44 0.16 0.00 -0.57 0.00 0.00 179.45 179.55 1y3n h ALA 485 N 1.06 1.39 -0.31 3.86 0.00 -1.01 -2.42 119.26 121.83 1y3n h ALA 485 Ca 0.13 -0.15 -0.05 0.00 0.00 0.00 0.00 54.91 54.84 1y3n h ALA 485 Cb 0.07 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.65 1y3n h ALA 485 CO -0.02 0.45 -0.01 -0.92 0.00 0.00 0.00 179.25 178.75 1y3n h TYR 486 N 0.69 0.61 0.00 0.00 3.20 -0.75 -2.83 116.97 117.89 1y3n h TYR 486 Ca 0.16 -0.11 -0.02 0.00 3.14 0.00 0.00 58.73 61.90 1y3n h TYR 486 Cb 0.18 -0.16 -0.00 0.00 1.54 0.00 0.00 36.73 38.29 1y3n h TYR 486 CO 0.01 0.69 -0.12 -0.44 -1.64 0.00 0.00 178.16 176.67 1y3n h ASP 487 N 0.36 0.00 -0.06 -2.11 3.32 -0.75 -2.18 116.42 114.99 1y3n h ASP 487 Ca 0.09 0.00 -0.01 0.00 0.02 0.00 0.00 57.03 57.13 1y3n h ASP 487 Cb 0.45 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.00 1y3n h ASP 487 CO 0.02 0.12 0.01 0.03 -1.72 0.00 0.00 179.24 177.69 1y3n h ARG 488 N 0.00 0.10 0.20 3.56 3.08 -1.19 -3.26 114.38 116.87 1y3n h ARG 488 Ca -0.00 -0.03 -0.01 0.00 0.07 0.00 0.00 59.98 60.01 1y3n h ARG 488 Cb 0.26 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.30 1y3n h ARG 488 CO 0.02 0.32 -0.10 1.96 -1.07 0.00 0.00 179.97 181.10 1y3n h GLN 489 N -0.14 -0.26 -0.02 0.04 4.20 -1.44 -3.52 115.11 113.98 1y3n h GLN 489 Ca 0.02 0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.75 1y3n h GLN 489 Cb 0.27 0.06 0.00 0.00 0.30 0.00 0.00 27.48 28.11 1y3n h GLN 489 CO 0.00 0.02 0.00 0.66 -0.67 0.00 0.00 178.83 178.84