#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1j1n s GLU 2 N 0.00 1.20 0.57 1.64 0.41 -1.26 -5.02 118.70 116.23 1j1n s GLU 2 Ca 0.00 -1.26 0.28 0.00 -0.41 0.00 0.00 54.97 53.59 1j1n s GLU 2 Cb 0.00 -1.42 1.70 0.00 -1.78 0.00 0.00 34.13 32.63 1j1n s GLU 2 CO 0.00 0.32 2.20 0.00 -0.49 0.00 0.00 175.26 177.29 1j1n h ALA 3 N 3.79 1.47 -0.01 5.21 0.00 -1.98 -1.95 119.26 125.79 1j1n h ALA 3 Ca -0.45 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.42 1j1n h ALA 3 Cb 1.19 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.97 1j1n h ALA 3 CO 0.43 0.05 -0.03 0.25 0.00 0.00 0.00 179.25 179.94 1j1n n THR 4 N -3.82 0.00 -1.75 0.00 -2.24 -1.26 -4.93 114.28 100.28 1j1n n THR 4 Ca -0.03 -0.22 -0.42 0.00 -2.27 0.00 0.00 64.05 61.11 1j1n n THR 4 Cb 0.13 0.44 -0.01 0.00 -2.10 0.00 0.00 70.33 68.79 1j1n n THR 4 CO 0.00 0.00 0.00 0.79 -0.57 0.00 0.00 175.07 175.29 1j1n n TRP 5 N 0.01 2.83 0.85 4.78 7.02 -0.74 -4.42 117.44 127.78 1j1n n TRP 5 Ca 0.18 0.41 0.09 0.00 -1.02 0.00 0.00 57.50 57.16 1j1n n TRP 5 Cb 0.34 -2.53 -0.07 0.00 -2.42 0.00 0.00 31.31 26.64 1j1n n TRP 5 CO 0.00 0.00 0.00 1.33 -2.02 0.00 0.00 177.69 177.00 1j1n n VAL 6 N 0.90 0.00 -3.71 -0.99 0.24 -0.53 -4.95 118.33 109.28 1j1n n VAL 6 Ca 0.04 -0.15 -0.14 0.00 -2.04 0.00 0.00 64.34 62.05 1j1n n VAL 6 Cb 0.38 1.08 -0.09 0.00 -1.47 0.00 0.00 33.84 33.74 1j1n n VAL 6 CO 0.00 0.00 0.00 0.28 -2.14 0.00 0.00 176.83 174.97 1j1n s THR 7 N -2.51 0.02 0.19 3.34 -1.32 -1.25 -4.90 115.64 109.20 1j1n s THR 7 Ca 0.10 -0.16 -0.01 0.00 -1.21 0.00 0.00 61.69 60.42 1j1n s THR 7 Cb 0.14 -0.66 -0.09 0.00 -1.51 0.00 0.00 72.50 70.38 1j1n s THR 7 CO 0.65 -0.09 1.46 -2.24 -2.21 0.00 0.00 174.62 172.19 1j1n h ASP 8 N 4.64 0.46 -3.28 8.08 2.03 -1.94 -3.43 116.42 122.98 1j1n h ASP 8 Ca -0.28 -0.29 -0.62 0.00 -0.73 0.00 0.00 57.03 55.11 1j1n h ASP 8 Cb 1.17 -0.13 -0.17 0.00 -0.83 0.00 0.00 39.33 39.37 1j1n h ASP 8 CO 0.30 1.01 -0.59 -1.59 -1.03 0.00 0.00 179.24 177.35 1j1n s LYS 9 N -3.67 3.85 0.16 4.15 -2.85 -1.26 -5.06 119.74 115.05 1j1n s LYS 9 Ca -0.05 -0.38 -0.34 0.00 -1.00 0.00 0.00 55.97 54.20 1j1n s LYS 9 Cb 0.11 -3.12 -0.15 0.00 -2.06 0.00 0.00 37.83 32.60 1j1n s LYS 9 CO 0.83 0.30 1.28 -2.30 0.10 0.00 0.00 175.35 175.57 1j1n n PRO 10 N 3.42 1.37 -4.67 1.78 -0.02 -1.26 -4.97 135.00 130.64 1j1n n PRO 10 Ca -0.17 0.49 -0.30 0.00 -2.02 0.00 0.00 63.50 61.50 1j1n n PRO 10 Cb 0.52 -2.07 -0.17 0.00 -0.02 0.00 0.00 33.50 31.76 1j1n n PRO 10 CO 0.00 0.00 0.00 -1.17 1.98 0.00 0.00 175.50 176.31 1j1n s LEU 11 N 0.55 1.89 -0.17 2.45 2.96 -0.70 -5.03 118.68 120.62 1j1n s LEU 11 Ca 0.76 -0.49 -0.05 0.00 -0.22 0.00 0.00 54.13 54.13 1j1n s LEU 11 Cb -0.84 -1.22 -0.03 0.00 0.50 0.00 0.00 46.19 44.60 1j1n s LEU 11 CO 0.49 0.06 -0.01 -0.89 -1.32 0.00 0.00 176.35 174.68 1j1n s THR 12 N 0.79 4.08 -0.00 3.68 2.01 -1.26 -0.27 115.64 124.67 1j1n s THR 12 Ca -0.10 -0.28 0.06 0.00 0.31 0.00 0.00 61.69 61.68 1j1n s THR 12 Cb -0.16 -2.81 -0.03 0.00 0.01 0.00 0.00 72.50 69.51 1j1n s THR 12 CO 0.01 0.47 -0.17 -0.76 -0.69 0.00 0.00 174.62 173.47 1j1n s LEU 13 N 0.54 2.59 -0.03 4.42 1.43 0.30 -4.96 118.68 122.97 1j1n s LEU 13 Ca -0.01 -0.34 -0.25 0.00 -1.03 0.00 0.00 54.13 52.50 1j1n s LEU 13 Cb -0.14 -1.52 -0.04 0.00 0.03 0.00 0.00 46.19 44.53 1j1n s LEU 13 CO 0.02 0.30 0.77 -0.54 0.23 0.00 0.00 176.35 177.13 1j1n s LYS 14 N -1.07 4.47 -0.04 1.70 1.02 -1.26 -0.49 119.74 124.07 1j1n s LYS 14 Ca 0.13 1.02 0.04 0.00 0.02 0.00 0.00 55.97 57.18 1j1n s LYS 14 Cb -0.10 -3.43 -0.00 0.00 -0.52 0.00 0.00 37.83 33.77 1j1n s LYS 14 CO 0.03 0.08 -0.17 -1.50 -0.92 0.00 0.00 175.35 172.86 1j1n s ILE 15 N 0.69 1.44 -0.40 2.17 2.07 0.11 -0.51 121.20 126.77 1j1n s ILE 15 Ca 0.40 -0.73 -0.08 0.00 -1.41 0.00 0.00 60.65 58.84 1j1n s ILE 15 Cb -0.19 -1.23 0.08 0.00 0.13 0.00 0.00 42.46 41.25 1j1n s ILE 15 CO 0.21 0.41 0.22 -2.28 -1.91 0.00 0.00 174.94 171.60 1j1n s HIS 16 N -0.03 3.36 -0.25 3.50 5.65 -0.23 -1.67 115.29 125.62 1j1n s HIS 16 Ca -0.02 -1.66 -0.03 0.00 0.25 0.00 0.00 55.06 53.59 1j1n s HIS 16 Cb -0.11 -2.89 0.08 0.00 -1.18 0.00 0.00 32.58 28.49 1j1n s HIS 16 CO 0.02 -0.85 0.10 1.41 -0.65 0.00 0.00 174.74 174.76 1j1n s MET 17 N 1.37 0.38 -0.14 2.88 0.00 -1.26 -1.73 119.30 120.79 1j1n s MET 17 Ca 0.03 -0.55 0.02 0.00 0.00 0.00 0.00 55.69 55.19 1j1n s MET 17 Cb -0.22 -1.66 0.01 0.00 0.00 0.00 0.00 34.83 32.96 1j1n s MET 17 CO 0.01 -0.88 -0.21 -1.58 0.00 0.00 0.00 175.02 172.36 1j1n s HIS 18 N 1.95 2.65 0.03 4.11 2.46 -1.25 -2.26 115.29 122.99 1j1n s HIS 18 Ca 0.06 -1.37 0.00 0.00 0.47 0.00 0.00 55.06 54.22 1j1n s HIS 18 Cb -0.16 -1.81 -0.03 0.00 -0.13 0.00 0.00 32.58 30.45 1j1n s HIS 18 CO -0.24 -0.64 -0.04 -0.59 -2.47 0.00 0.00 174.74 170.76 1j1n s PHE 19 N 0.91 0.43 -1.20 3.88 -0.12 0.06 -4.62 117.98 117.32 1j1n s PHE 19 Ca -0.05 -0.65 0.00 0.00 -0.05 0.00 0.00 56.93 56.18 1j1n s PHE 19 Cb -0.15 -0.29 0.00 0.00 -0.63 0.00 0.00 43.02 41.95 1j1n s PHE 19 CO -0.04 -0.20 0.00 0.54 -0.05 0.00 0.00 175.22 175.47 1j1n n ARG 20 N 1.18 -2.12 -1.69 1.99 1.74 -1.26 -1.74 116.66 114.76 1j1n n ARG 20 Ca -0.21 0.68 -0.17 0.00 -0.77 0.00 0.00 57.85 57.37 1j1n n ARG 20 Cb 0.56 -5.29 -0.06 0.00 -1.02 0.00 0.00 32.46 26.65 1j1n n ARG 20 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 1j1n n ASP 21 N -1.84 -4.69 0.00 0.55 10.43 -1.26 -4.66 116.55 115.08 1j1n n ASP 21 Ca -0.17 0.36 0.00 0.00 2.57 0.00 0.00 54.79 57.55 1j1n n ASP 21 Cb 0.63 -4.16 0.00 0.00 1.84 0.00 0.00 41.12 39.42 1j1n n ASP 21 CO 0.00 0.00 0.00 1.17 -1.07 0.00 0.00 177.20 177.30 1j1n n LYS 22 N -2.31 1.35 -4.40 -1.24 3.00 -0.88 -4.56 118.16 109.12 1j1n n LYS 22 Ca -0.18 0.00 -0.24 0.00 -0.00 0.00 0.00 58.31 57.89 1j1n n LYS 22 Cb 0.59 -0.25 -0.09 0.00 0.00 0.00 0.00 35.03 35.28 1j1n n LYS 22 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 177.40 175.82 1j1n s TRP 23 N -0.54 2.47 0.04 5.64 0.51 -0.71 -4.99 118.94 121.36 1j1n s TRP 23 Ca 0.00 -0.36 -0.04 0.00 -2.12 0.00 0.00 56.10 53.58 1j1n s TRP 23 Cb 0.00 -1.24 -0.02 0.00 -0.81 0.00 0.00 33.47 31.40 1j1n s TRP 23 CO 0.00 0.61 0.05 0.14 -0.51 0.00 0.00 176.95 177.23 1j1n s VAL 24 N -2.49 0.15 0.33 4.03 -7.23 -1.26 -0.76 120.40 113.17 1j1n s VAL 24 Ca 0.32 -1.23 -0.29 0.00 -1.81 0.00 0.00 61.98 58.98 1j1n s VAL 24 Cb -0.03 -0.94 -0.11 0.00 0.56 0.00 0.00 36.38 35.86 1j1n s VAL 24 CO 0.18 -0.68 1.47 0.86 -0.31 0.00 0.00 175.10 176.62 1j1n s TRP 25 N -2.75 2.77 -0.18 2.82 -0.11 -0.96 -4.98 118.94 115.56 1j1n s TRP 25 Ca -0.04 1.12 0.00 0.00 1.22 0.00 0.00 56.10 58.40 1j1n s TRP 25 Cb -0.00 -3.94 0.04 0.00 -1.50 0.00 0.00 33.47 28.07 1j1n s TRP 25 CO -0.05 -2.85 -0.08 0.34 -4.62 0.00 0.00 176.95 169.69 1j1n s ASP 26 N -0.01 3.03 0.26 5.86 -1.08 -1.26 -4.60 116.67 118.86 1j1n s ASP 26 Ca 0.55 -0.73 0.21 0.00 -0.52 0.00 0.00 52.55 52.06 1j1n s ASP 26 Cb -0.45 -1.07 0.99 0.00 -1.46 0.00 0.00 42.92 40.93 1j1n s ASP 26 CO 0.55 -0.15 1.64 -1.84 0.52 0.00 0.00 175.17 175.89 1j1n n GLU 27 N 4.79 0.15 0.00 4.34 0.28 -1.26 -1.14 120.64 127.80 1j1n n GLU 27 Ca -0.14 0.51 0.13 0.00 -0.16 0.00 0.00 57.16 57.50 1j1n n GLU 27 Cb 0.47 -1.87 0.37 0.00 1.43 0.00 0.00 31.44 31.85 1j1n n GLU 27 CO 0.00 0.00 0.00 0.09 -0.16 0.00 0.00 177.13 177.06 1j1n n ASN 28 N -2.17 1.25 -4.75 -1.84 5.03 -1.26 -4.19 115.26 107.34 1j1n n ASN 28 Ca 0.01 -1.10 -0.40 0.00 0.87 0.00 0.00 54.58 53.96 1j1n n ASN 28 Cb 0.13 0.13 0.01 0.00 -1.02 0.00 0.00 39.78 39.04 1j1n n ASN 28 CO 0.00 0.00 0.00 0.79 -1.83 0.00 0.00 177.26 176.22 1j1n n TRP 29 N -0.37 2.58 -0.29 3.10 8.01 -0.29 -4.84 117.44 125.34 1j1n n TRP 29 Ca 0.13 0.46 -0.00 0.00 -1.31 0.00 0.00 57.50 56.78 1j1n n TRP 29 Cb 0.37 -2.45 0.13 0.00 -2.01 0.00 0.00 31.31 27.34 1j1n n TRP 29 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.69 175.33 1j1n h PRO 30 N 2.34 0.89 -0.05 -0.99 0.11 -1.88 -1.03 132.00 131.38 1j1n h PRO 30 Ca -0.50 -0.05 -0.10 0.00 0.11 0.00 0.00 66.00 65.46 1j1n h PRO 30 Cb 1.27 -0.20 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 1j1n h PRO 30 CO 0.61 0.59 -0.44 0.28 -0.21 0.00 0.00 178.00 178.83 1j1n h VAL 31 N 0.91 1.32 -0.47 3.15 2.07 -1.71 -1.96 116.25 119.56 1j1n h VAL 31 Ca 0.35 -1.56 -0.09 0.00 0.82 0.00 0.00 66.70 66.23 1j1n h VAL 31 Cb 0.15 1.77 -0.02 0.00 -1.52 0.00 0.00 31.29 31.68 1j1n h VAL 31 CO -0.17 0.45 -0.05 0.00 0.02 0.00 0.00 177.57 177.83 1j1n h ALA 32 N 1.45 0.63 -0.50 1.67 0.00 -1.48 0.41 119.26 121.45 1j1n h ALA 32 Ca 0.01 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.58 1j1n h ALA 32 Cb 0.82 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.42 1j1n h ALA 32 CO 0.06 0.47 0.18 0.87 0.00 0.00 0.00 179.25 180.84 1j1n h LYS 33 N 0.70 0.76 -0.42 0.00 1.79 -1.00 -1.66 116.57 116.73 1j1n h LYS 33 Ca 0.13 -0.15 -0.09 0.00 -2.18 0.00 0.00 60.65 58.36 1j1n h LYS 33 Cb 0.57 -0.12 -0.02 0.00 -1.58 0.00 0.00 32.23 31.08 1j1n h LYS 33 CO 0.03 0.69 -0.09 1.49 -1.08 0.00 0.00 179.45 180.50 1j1n h GLU 34 N 0.67 0.74 -0.36 3.15 4.57 -1.20 0.10 114.58 122.25 1j1n h GLU 34 Ca 0.16 -0.23 -0.01 0.00 -1.18 0.00 0.00 59.36 58.10 1j1n h GLU 34 Cb 0.23 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.74 1j1n h GLU 34 CO -0.01 0.81 0.19 1.03 -1.18 0.00 0.00 179.01 179.85 1j1n h SER 35 N 0.68 0.45 -0.56 1.04 0.87 -0.61 -0.87 113.55 114.54 1j1n h SER 35 Ca 0.12 -0.10 -0.03 0.00 -1.23 0.00 0.00 61.79 60.55 1j1n h SER 35 Cb 0.55 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.37 1j1n h SER 35 CO 0.03 0.42 0.22 0.15 -0.53 0.00 0.00 176.83 177.13 1j1n h PHE 36 N 0.45 0.86 -0.96 2.24 3.57 -0.94 -0.00 116.94 122.15 1j1n h PHE 36 Ca 0.12 -0.07 0.04 0.00 3.53 0.00 0.00 57.97 61.60 1j1n h PHE 36 Cb 0.07 -0.26 -0.06 0.00 2.79 0.00 0.00 35.95 38.50 1j1n h PHE 36 CO -0.02 0.70 0.63 -0.09 -2.23 0.00 0.00 178.31 177.29 1j1n h ARG 37 N 0.77 1.17 0.00 1.11 2.43 -0.59 0.20 114.38 119.47 1j1n h ARG 37 Ca 0.19 -0.07 -0.19 0.00 -0.81 0.00 0.00 59.98 59.10 1j1n h ARG 37 Cb 0.20 -0.26 -0.03 0.00 -0.42 0.00 0.00 29.97 29.46 1j1n h ARG 37 CO -0.02 0.78 -1.09 -0.07 -1.51 0.00 0.00 179.97 178.06 1j1n h LEU 38 N 1.21 0.00 0.00 3.80 3.38 -0.88 -3.40 115.31 119.42 1j1n h LEU 38 Ca 0.38 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 58.34 1j1n h LEU 38 Cb 0.01 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1j1n h LEU 38 CO -0.12 0.78 -1.52 0.35 0.09 0.00 0.00 178.44 178.02 1j1n n THR 39 N -3.16 0.05 -1.15 0.22 -2.24 -0.04 -2.34 114.28 105.63 1j1n n THR 39 Ca -0.05 -0.27 -0.05 0.00 -2.27 0.00 0.00 64.05 61.42 1j1n n THR 39 Cb 0.89 0.17 -0.02 0.00 -2.10 0.00 0.00 70.33 69.27 1j1n n THR 39 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1j1n n ASN 40 N -1.92 -3.75 -4.22 3.42 4.05 0.69 -1.45 115.26 112.08 1j1n n ASN 40 Ca -0.03 0.12 -0.32 0.00 0.45 0.00 0.00 54.58 54.80 1j1n n ASN 40 Cb 0.33 -1.70 -0.17 0.00 1.23 0.00 0.00 39.78 39.48 1j1n n ASN 40 CO 0.00 0.00 0.00 -0.69 -3.05 0.00 0.00 177.26 173.52 1j1n s VAL 41 N -2.14 2.15 -0.06 3.44 1.01 -1.26 -1.73 120.40 121.81 1j1n s VAL 41 Ca 0.00 -0.97 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1j1n s VAL 41 Cb 0.00 -1.84 -0.03 0.00 0.00 0.00 0.00 36.38 34.52 1j1n s VAL 41 CO 0.00 0.55 -0.12 -0.75 0.00 0.00 0.00 175.10 174.78 1j1n s LYS 42 N 0.51 2.67 -0.20 2.72 2.20 0.63 -3.91 119.74 124.36 1j1n s LYS 42 Ca -0.14 -0.66 -0.05 0.00 -0.36 0.00 0.00 55.97 54.76 1j1n s LYS 42 Cb -0.17 -2.46 -0.03 0.00 -1.51 0.00 0.00 37.83 33.67 1j1n s LYS 42 CO 0.05 0.58 0.01 -0.51 -0.36 0.00 0.00 175.35 175.12 1j1n s LEU 43 N -0.62 3.31 -0.24 5.43 1.43 -1.26 -0.54 118.68 126.20 1j1n s LEU 43 Ca 0.09 -0.17 -0.07 0.00 -1.03 0.00 0.00 54.13 52.95 1j1n s LEU 43 Cb -0.11 -1.84 -0.03 0.00 0.03 0.00 0.00 46.19 44.24 1j1n s LEU 43 CO 0.01 0.08 0.06 -1.58 0.23 0.00 0.00 176.35 175.15 1j1n s GLN 44 N 0.92 3.65 0.18 1.70 0.74 0.35 -4.40 119.66 122.80 1j1n s GLN 44 Ca 0.01 -0.48 -0.30 0.00 0.05 0.00 0.00 55.36 54.64 1j1n s GLN 44 Cb -0.14 -3.28 -0.08 0.00 1.10 0.00 0.00 33.01 30.60 1j1n s GLN 44 CO 0.02 -0.16 1.16 0.45 -0.55 0.00 0.00 175.29 176.21 1j1n s SER 45 N 1.52 7.14 0.00 6.67 0.15 -1.26 -0.71 113.70 127.22 1j1n s SER 45 Ca 0.06 2.18 0.02 0.00 0.70 0.00 0.00 55.95 58.91 1j1n s SER 45 Cb -0.15 -2.61 0.05 0.00 -1.71 0.00 0.00 66.02 61.60 1j1n s SER 45 CO 0.03 -0.33 0.95 1.33 1.20 0.00 0.00 173.24 176.43 1j1n n VAL 46 N 2.49 0.81 -2.02 4.45 0.24 -0.67 -4.89 118.33 118.73 1j1n n VAL 46 Ca 0.04 -0.90 -0.29 0.00 -2.04 0.00 0.00 64.34 61.15 1j1n n VAL 46 Cb 0.45 0.61 0.05 0.00 -1.47 0.00 0.00 33.84 33.48 1j1n n VAL 46 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1j1n s ALA 47 N -0.84 2.98 -0.56 2.33 0.00 -1.26 -4.97 121.76 119.44 1j1n s ALA 47 Ca 0.04 -0.50 -0.18 0.00 0.00 0.00 0.00 51.96 51.32 1j1n s ALA 47 Cb 0.02 -2.89 0.10 0.00 0.00 0.00 0.00 23.12 20.34 1j1n s ALA 47 CO 0.03 -1.13 0.64 1.21 0.00 0.00 0.00 175.76 176.50 1j1n s ASN 48 N -4.38 6.19 0.61 0.00 3.04 -1.26 -4.93 114.94 114.20 1j1n s ASN 48 Ca 0.58 -1.38 0.33 0.00 0.04 0.00 0.00 52.86 52.43 1j1n s ASN 48 Cb -0.11 -2.28 1.94 0.00 -1.54 0.00 0.00 41.25 39.26 1j1n s ASN 48 CO 0.49 -1.00 2.27 0.07 -3.04 0.00 0.00 177.10 175.89 1j1n h LYS 49 N 9.07 0.00 0.00 0.43 2.10 -1.96 -2.05 116.57 124.17 1j1n h LYS 49 Ca -0.29 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.36 1j1n h LYS 49 Cb 1.09 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.42 1j1n h LYS 49 CO 1.05 0.00 -0.26 0.00 -2.00 0.00 0.00 179.45 178.24 1j1n n ALA 50 N -2.27 2.60 -1.77 0.07 0.00 -1.26 -4.90 120.51 112.98 1j1n n ALA 50 Ca -0.03 -0.13 -0.36 0.00 0.00 0.00 0.00 53.44 52.93 1j1n n ALA 50 Cb 0.10 -1.34 0.00 0.00 0.00 0.00 0.00 19.45 18.22 1j1n n ALA 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1j1n s ALA 51 N -3.11 2.75 -0.07 0.00 0.00 -0.77 -4.98 121.76 115.58 1j1n s ALA 51 Ca 0.09 0.86 0.10 0.00 0.00 0.00 0.00 51.96 53.02 1j1n s ALA 51 Cb 0.14 -3.37 0.16 0.00 0.00 0.00 0.00 23.12 20.04 1j1n s ALA 51 CO 0.64 -0.77 1.07 0.25 0.00 0.00 0.00 175.76 176.96 1j1n n THR 52 N -1.14 1.45 -3.65 0.00 -2.24 -1.26 -4.65 114.28 102.79 1j1n n THR 52 Ca 0.11 -1.65 -0.29 0.00 -2.27 0.00 0.00 64.05 59.94 1j1n n THR 52 Cb 0.50 0.11 -0.14 0.00 -2.10 0.00 0.00 70.33 68.70 1j1n n THR 52 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 1j1n s ASN 53 N -2.01 3.61 0.21 3.42 3.04 -1.26 -4.66 114.94 117.29 1j1n s ASN 53 Ca 0.17 -2.07 -0.10 0.00 0.04 0.00 0.00 52.86 50.91 1j1n s ASN 53 Cb 0.15 -0.77 0.23 0.00 -1.54 0.00 0.00 41.25 39.32 1j1n s ASN 53 CO 0.02 -0.34 1.80 0.28 -3.04 0.00 0.00 177.10 175.82 1j1n h SER 54 N 7.41 0.52 -0.44 -4.21 0.02 -1.88 -1.72 113.55 113.25 1j1n h SER 54 Ca -0.05 0.03 -0.09 0.00 -0.84 0.00 0.00 61.79 60.84 1j1n h SER 54 Cb 0.97 -0.07 -0.02 0.00 0.14 0.00 0.00 62.40 63.42 1j1n h SER 54 CO 0.42 0.34 -0.04 1.56 -1.14 0.00 0.00 176.83 177.97 1j1n h GLN 55 N 0.65 0.87 -0.64 3.45 1.08 -1.94 -1.98 115.11 116.61 1j1n h GLN 55 Ca 0.29 -0.26 -0.01 0.00 -1.45 0.00 0.00 58.65 57.21 1j1n h GLN 55 Cb 0.19 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.50 1j1n h GLN 55 CO -0.18 0.89 0.35 1.49 -0.95 0.00 0.00 178.83 180.43 1j1n h GLU 56 N 0.79 0.89 -0.45 1.46 4.81 -1.87 -1.98 114.58 118.24 1j1n h GLU 56 Ca 0.14 -0.10 -0.07 0.00 -0.13 0.00 0.00 59.36 59.20 1j1n h GLU 56 Cb 0.53 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.72 1j1n h GLU 56 CO 0.03 0.67 -0.01 1.96 -0.73 0.00 0.00 179.01 180.92 1j1n h GLN 57 N 0.87 0.74 -0.27 1.92 1.08 -1.02 -1.19 115.11 117.24 1j1n h GLN 57 Ca 0.22 -0.20 -0.01 0.00 -1.45 0.00 0.00 58.65 57.22 1j1n h GLN 57 Cb 0.03 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.36 1j1n h GLN 57 CO -0.04 0.76 0.12 0.35 -0.95 0.00 0.00 178.83 179.07 1j1n h PHE 58 N 0.69 0.40 -0.56 2.96 3.04 -0.97 -0.86 116.94 121.64 1j1n h PHE 58 Ca 0.14 -0.02 0.02 0.00 3.98 0.00 0.00 57.97 62.08 1j1n h PHE 58 Cb 0.44 -0.12 -0.03 0.00 2.56 0.00 0.00 35.95 38.80 1j1n h PHE 58 CO 0.02 0.39 0.35 -0.91 -2.02 0.00 0.00 178.31 176.14 1j1n h ASN 59 N 0.30 0.59 -0.40 0.41 2.35 -1.01 -1.00 115.58 116.81 1j1n h ASN 59 Ca 0.09 -0.00 -0.03 0.00 -0.55 0.00 0.00 56.30 55.81 1j1n h ASN 59 Cb 0.15 -0.13 -0.02 0.00 0.05 0.00 0.00 38.32 38.37 1j1n h ASN 59 CO -0.01 0.42 0.13 -0.07 -1.65 0.00 0.00 177.43 176.24 1j1n h LEU 60 N 0.71 0.58 -0.86 1.61 3.38 -1.05 -2.94 115.31 116.74 1j1n h LEU 60 Ca 0.22 -0.20 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 1j1n h LEU 60 Cb -0.01 -0.15 -0.04 0.00 0.09 0.00 0.00 40.66 40.54 1j1n h LEU 60 CO -0.08 0.63 0.50 -0.03 0.09 0.00 0.00 178.44 179.55 1j1n h MET 61 N 0.50 1.17 0.00 1.13 4.05 -0.87 -1.93 114.93 118.99 1j1n h MET 61 Ca 0.13 -0.11 -0.02 0.00 -0.28 0.00 0.00 59.70 59.41 1j1n h MET 61 Cb 0.25 -0.24 -0.00 0.00 -0.80 0.00 0.00 31.60 30.81 1j1n h MET 61 CO -0.00 0.83 -0.10 1.98 0.23 0.00 0.00 176.91 179.85 1j1n h MET 62 N 1.18 0.00 -0.58 0.39 1.85 -1.04 -2.01 114.93 114.72 1j1n h MET 62 Ca 0.31 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 59.40 1j1n h MET 62 Cb -0.03 0.00 0.00 0.00 0.43 0.00 0.00 31.60 32.00 1j1n h MET 62 CO -0.06 0.10 0.00 0.00 -0.40 0.00 0.00 176.91 176.56 1j1n n ALA 63 N -2.25 2.29 0.19 0.39 0.00 -0.85 -4.51 120.51 115.77 1j1n n ALA 63 Ca -0.02 -1.24 0.05 0.00 0.00 0.00 0.00 53.44 52.23 1j1n n ALA 63 Cb 0.23 -0.73 0.35 0.00 0.00 0.00 0.00 19.45 19.30 1j1n n ALA 63 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 1j1n h SER 64 N 3.39 0.00 0.00 0.00 4.64 -0.62 -3.47 113.55 117.49 1j1n h SER 64 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1j1n h SER 64 Cb 0.89 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.98 1j1n h SER 64 CO 0.00 0.39 0.00 0.61 -0.87 0.00 0.00 176.83 176.96 1j1n n GLY 65 N 0.06 0.56 2.37 -0.77 0.00 -1.26 -4.93 105.19 101.21 1j1n n GLY 65 Ca -0.01 -0.09 -0.18 0.00 0.00 0.00 0.00 46.02 45.75 1j1n n GLY 65 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1j1n n ASP 66 N 0.16 -0.67 -4.76 1.61 4.64 -1.26 -5.13 116.55 111.14 1j1n n ASP 66 Ca 0.00 -2.96 -0.40 0.00 -1.38 0.00 0.00 54.79 50.05 1j1n n ASP 66 Cb 0.00 0.15 0.02 0.00 -1.04 0.00 0.00 41.12 40.26 1j1n n ASP 66 CO 0.00 0.00 0.00 -0.76 -0.82 0.00 0.00 177.20 175.62 1j1n s LEU 67 N -1.32 4.05 0.00 -2.67 1.43 -1.26 -5.02 118.68 113.88 1j1n s LEU 67 Ca 0.34 2.91 0.00 0.00 -1.03 0.00 0.00 54.13 56.35 1j1n s LEU 67 Cb 0.22 -4.01 0.00 0.00 0.03 0.00 0.00 46.19 42.42 1j1n s LEU 67 CO -0.14 -1.29 0.00 -0.81 0.23 0.00 0.00 176.35 174.34 1j1n n PRO 68 N -0.41 0.26 -0.05 1.29 -0.04 -1.26 -4.93 135.00 129.86 1j1n n PRO 68 Ca 0.06 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.42 1j1n n PRO 68 Cb 0.42 0.00 -0.15 0.00 -0.04 0.00 0.00 33.50 33.74 1j1n n PRO 68 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1j1n n ASP 69 N -2.00 0.74 -3.96 3.54 10.43 0.34 -4.51 116.55 121.14 1j1n n ASP 69 Ca 0.00 0.25 -0.12 0.00 2.57 0.00 0.00 54.79 57.48 1j1n n ASP 69 Cb 0.00 0.20 -0.13 0.00 1.84 0.00 0.00 41.12 43.03 1j1n n ASP 69 CO 0.00 0.00 0.00 -0.69 -1.07 0.00 0.00 177.20 175.44 1j1n s VAL 70 N -2.56 0.23 -0.07 2.53 1.01 -0.49 -2.16 120.40 118.89 1j1n s VAL 70 Ca -0.09 -0.48 0.02 0.00 0.00 0.00 0.00 61.98 61.43 1j1n s VAL 70 Cb 0.07 -0.27 0.02 0.00 0.00 0.00 0.00 36.38 36.20 1j1n s VAL 70 CO 0.81 -0.16 -0.11 -0.69 0.00 0.00 0.00 175.10 174.95 1j1n s VAL 71 N -0.64 1.08 0.13 2.92 1.01 -0.81 -1.06 120.40 123.03 1j1n s VAL 71 Ca -0.05 -0.43 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 1j1n s VAL 71 Cb -0.05 -1.01 -0.04 0.00 0.00 0.00 0.00 36.38 35.28 1j1n s VAL 71 CO -0.00 0.35 0.05 -0.83 0.00 0.00 0.00 175.10 174.67 1j1n s GLY 72 N 0.82 1.01 0.00 4.51 0.00 -0.71 -0.71 107.32 112.25 1j1n s GLY 72 Ca -0.12 -1.48 0.00 0.00 0.00 0.00 0.00 44.72 43.12 1j1n s GLY 72 CO 0.02 -1.38 0.00 0.61 0.00 0.00 0.00 173.10 172.35 1j1n n GLY 73 N -0.11 1.22 3.87 0.20 0.00 -0.44 -3.83 105.19 106.10 1j1n n GLY 73 Ca -0.06 -1.49 -0.31 0.00 0.00 0.00 0.00 46.02 44.16 1j1n n GLY 73 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1j1n s ASP 74 N 0.00 6.63 -1.40 1.61 -4.77 -1.26 -1.90 116.67 115.58 1j1n s ASP 74 Ca 0.00 1.15 -0.05 0.00 -3.30 0.00 0.00 52.55 50.35 1j1n s ASP 74 Cb 0.00 -2.32 0.03 0.00 -1.09 0.00 0.00 42.92 39.54 1j1n s ASP 74 CO 0.00 -0.27 0.74 0.59 0.70 0.00 0.00 175.17 176.92 1j1n n ASN 75 N -0.77 -2.15 -0.15 2.11 3.02 -0.68 -4.89 115.26 111.75 1j1n n ASN 75 Ca 0.02 -0.85 0.02 0.00 -0.03 0.00 0.00 54.58 53.74 1j1n n ASN 75 Cb 0.53 -3.79 0.02 0.00 -0.61 0.00 0.00 39.78 35.93 1j1n n ASN 75 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1j1n n LEU 76 N -4.42 1.50 -0.07 3.41 4.77 0.02 -4.78 117.00 117.42 1j1n n LEU 76 Ca -0.19 -1.22 -0.08 0.00 -0.03 0.00 0.00 56.01 54.49 1j1n n LEU 76 Cb 0.63 -0.02 -0.02 0.00 -2.33 0.00 0.00 43.42 41.68 1j1n n LEU 76 CO 0.72 0.35 0.66 0.50 -1.33 0.00 0.00 177.39 178.29 1j1n h LYS 77 N 0.65 -0.27 -0.74 3.23 3.64 -1.76 0.32 116.57 121.64 1j1n h LYS 77 Ca 0.00 0.02 0.02 0.00 -1.27 0.00 0.00 60.65 59.42 1j1n h LYS 77 Cb 0.23 0.06 -0.04 0.00 -0.41 0.00 0.00 32.23 32.08 1j1n h LYS 77 CO 0.00 -0.18 0.49 -0.44 -2.27 0.00 0.00 179.45 177.04 1j1n h ASP 78 N -0.28 0.81 0.19 4.20 3.45 -1.88 -1.18 116.42 121.72 1j1n h ASP 78 Ca 0.15 -0.01 -0.21 0.00 0.43 0.00 0.00 57.03 57.38 1j1n h ASP 78 Cb 0.52 -0.19 0.00 0.00 -0.56 0.00 0.00 39.33 39.10 1j1n h ASP 78 CO -0.46 0.57 -0.83 0.11 -1.57 0.00 0.00 179.24 177.06 1j1n h LYS 79 N 0.94 0.50 -0.60 3.56 1.57 -1.59 -0.75 116.57 120.21 1j1n h LYS 79 Ca 0.28 -0.46 -0.04 0.00 -1.87 0.00 0.00 60.65 58.57 1j1n h LYS 79 Cb -0.02 0.11 -0.03 0.00 0.08 0.00 0.00 32.23 32.37 1j1n h LYS 79 CO -0.07 1.09 0.24 0.74 -0.57 0.00 0.00 179.45 180.88 1j1n h PHE 80 N 0.32 0.92 -0.00 -1.35 0.05 0.08 0.59 116.94 117.55 1j1n h PHE 80 Ca -0.06 -0.07 -0.00 0.00 3.82 0.00 0.00 57.97 61.66 1j1n h PHE 80 Cb 1.44 -0.28 -0.00 0.00 2.00 0.00 0.00 35.95 39.11 1j1n h PHE 80 CO 0.06 0.74 -0.00 0.82 -0.18 0.00 0.00 178.31 179.75 1j1n h ILE 81 N 0.84 1.30 0.05 -0.55 2.04 -1.19 0.14 117.51 120.13 1j1n h ILE 81 Ca 0.20 -0.88 -0.00 0.00 1.00 0.00 0.00 64.86 65.18 1j1n h ILE 81 Cb 0.21 1.89 0.00 0.00 -0.74 0.00 0.00 36.82 38.18 1j1n h ILE 81 CO -0.02 0.23 -0.02 -0.61 0.00 0.00 0.00 178.15 177.73 1j1n h GLN 82 N -0.37 -0.07 0.00 2.37 4.15 -1.05 -1.95 115.11 118.20 1j1n h GLN 82 Ca 0.00 0.00 -0.06 0.00 0.77 0.00 0.00 58.65 59.37 1j1n h GLN 82 Cb 0.38 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.07 1j1n h GLN 82 CO 0.00 0.18 -0.28 1.88 -1.93 0.00 0.00 178.83 178.69 1j1n h TYR 83 N -0.31 0.00 -0.08 3.99 0.05 -0.97 -2.02 116.97 117.62 1j1n h TYR 83 Ca -0.01 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 1j1n h TYR 83 Cb 0.28 0.00 -0.00 0.00 1.01 0.00 0.00 36.73 38.01 1j1n h TYR 83 CO 0.01 0.28 -0.01 0.78 -1.05 0.00 0.00 178.16 178.17 1j1n h GLY 84 N 2.14 0.16 2.00 3.88 0.00 -0.60 0.82 103.07 111.47 1j1n h GLY 84 Ca -0.00 -0.12 -0.04 0.00 0.00 0.00 0.00 47.33 47.17 1j1n h GLY 84 CO 0.04 0.11 -0.18 1.46 0.00 0.00 0.00 176.54 177.97 1j1n h GLN 85 N -0.15 0.00 -0.00 4.80 4.20 -1.19 -1.78 115.11 120.99 1j1n h GLN 85 Ca 0.02 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.73 1j1n h GLN 85 Cb 0.37 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.15 1j1n h GLN 85 CO 0.01 0.18 -0.05 0.39 -0.67 0.00 0.00 178.83 178.69 1j1n n GLU 86 N -4.24 0.70 0.00 1.46 1.02 -0.78 -4.93 120.64 113.87 1j1n n GLU 86 Ca -0.02 -0.13 0.00 0.00 -0.02 0.00 0.00 57.16 56.98 1j1n n GLU 86 Cb 0.25 -1.50 0.00 0.00 -0.02 0.00 0.00 31.44 30.17 1j1n n GLU 86 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j1n n GLY 87 N 1.22 1.09 0.08 0.62 0.00 -0.67 -5.01 105.19 102.52 1j1n n GLY 87 Ca 0.16 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.10 1j1n n GLY 87 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1n n ALA 88 N -1.78 1.53 -2.46 4.61 0.00 0.20 -4.75 120.51 117.86 1j1n n ALA 88 Ca 0.00 -0.82 -0.26 0.00 0.00 0.00 0.00 53.44 52.36 1j1n n ALA 88 Cb 0.00 -0.78 -0.13 0.00 0.00 0.00 0.00 19.45 18.53 1j1n n ALA 88 CO 0.00 0.00 0.00 -0.06 0.00 0.00 0.00 177.50 177.44 1j1n s PHE 89 N -2.61 1.97 0.25 0.00 0.08 -1.25 -1.72 117.98 114.70 1j1n s PHE 89 Ca -0.05 -0.39 -0.17 0.00 0.12 0.00 0.00 56.93 56.44 1j1n s PHE 89 Cb 0.08 -1.12 -0.08 0.00 -0.57 0.00 0.00 43.02 41.32 1j1n s PHE 89 CO 0.83 0.18 0.70 0.14 -0.10 0.00 0.00 175.22 176.96 1j1n s VAL 90 N -0.96 4.66 0.45 -0.44 -7.23 -0.42 -4.73 120.40 111.73 1j1n s VAL 90 Ca 0.09 1.06 -0.23 0.00 -1.81 0.00 0.00 61.98 61.08 1j1n s VAL 90 Cb -0.10 -3.74 -0.07 0.00 0.56 0.00 0.00 36.38 33.03 1j1n s VAL 90 CO 0.03 0.05 1.18 -2.16 -0.31 0.00 0.00 175.10 173.89 1j1n s PRO 91 N -2.40 3.77 0.00 4.82 0.04 -1.26 -4.69 135.00 135.28 1j1n s PRO 91 Ca 0.47 1.82 0.15 0.00 0.04 0.00 0.00 61.00 63.47 1j1n s PRO 91 Cb -0.14 -2.45 0.06 0.00 0.04 0.00 0.00 34.50 32.02 1j1n s PRO 91 CO 0.19 -0.55 0.89 1.28 0.04 0.00 0.00 177.00 178.85 1j1n n LEU 92 N -0.42 1.91 -0.08 -3.56 4.77 0.11 -4.76 117.00 114.97 1j1n n LEU 92 Ca 0.07 -0.90 -0.13 0.00 -0.03 0.00 0.00 56.01 55.02 1j1n n LEU 92 Cb 0.48 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.49 1j1n n LEU 92 CO 0.49 0.35 0.53 0.78 -1.33 0.00 0.00 177.39 178.21 1j1n h ASN 93 N 2.32 -1.64 -0.14 -1.43 -0.26 -1.93 -0.01 115.58 112.49 1j1n h ASN 93 Ca 0.00 0.22 -0.15 0.00 -0.56 0.00 0.00 56.30 55.81 1j1n h ASN 93 Cb 0.56 0.67 -0.01 0.00 -1.06 0.00 0.00 38.32 38.48 1j1n h ASN 93 CO 0.00 -0.42 -0.44 0.50 -1.06 0.00 0.00 177.43 176.01 1j1n h LYS 94 N -0.45 0.69 -0.85 0.81 3.64 -1.98 -2.37 116.57 116.05 1j1n h LYS 94 Ca 0.08 -0.37 0.03 0.00 -1.27 0.00 0.00 60.65 59.11 1j1n h LYS 94 Cb 0.63 0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 32.42 1j1n h LYS 94 CO -0.52 0.99 0.55 -0.07 -2.27 0.00 0.00 179.45 178.13 1j1n h LEU 95 N 0.55 0.93 -0.01 5.20 3.38 -1.77 -1.64 115.31 121.95 1j1n h LEU 95 Ca 0.04 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.00 1j1n h LEU 95 Cb 0.98 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.51 1j1n h LEU 95 CO 0.09 0.65 0.00 0.40 0.09 0.00 0.00 178.44 179.67 1j1n h ILE 96 N 1.09 1.19 -0.84 1.22 2.04 -0.88 0.12 117.51 121.45 1j1n h ILE 96 Ca 0.33 -0.57 0.10 0.00 1.00 0.00 0.00 64.86 65.72 1j1n h ILE 96 Cb -0.03 1.56 -0.06 0.00 -0.74 0.00 0.00 36.82 37.55 1j1n h ILE 96 CO -0.10 0.15 0.55 0.44 0.00 0.00 0.00 178.15 179.18 1j1n h ASP 97 N -0.22 0.73 0.29 1.72 5.19 -1.12 -1.47 116.42 121.54 1j1n h ASP 97 Ca 0.00 0.02 -0.33 0.00 -0.62 0.00 0.00 57.03 56.10 1j1n h ASP 97 Cb 0.24 -0.13 -0.04 0.00 0.18 0.00 0.00 39.33 39.57 1j1n h ASP 97 CO 0.00 0.43 -1.92 1.67 -3.12 0.00 0.00 179.24 176.30 1j1n n GLN 98 N -4.52 0.68 0.00 3.56 7.27 -0.65 -4.72 117.38 119.01 1j1n n GLN 98 Ca 0.14 0.25 0.00 0.00 0.07 0.00 0.00 57.00 57.46 1j1n n GLN 98 Cb 0.31 -1.72 0.00 0.00 2.41 0.00 0.00 30.24 31.24 1j1n n GLN 98 CO 0.00 0.00 0.00 0.66 0.07 0.00 0.00 177.06 177.79 1j1n n TYR 99 N -3.17 0.00 -3.59 3.69 4.02 0.42 -4.90 117.16 113.63 1j1n n TYR 99 Ca -0.25 0.00 -0.27 0.00 -0.01 0.00 0.00 57.90 57.37 1j1n n TYR 99 Cb 1.06 0.00 -0.10 0.00 -0.02 0.00 0.00 39.34 40.28 1j1n n TYR 99 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1j1n n ALA 100 N -0.20 3.58 -0.19 -0.72 0.00 -0.56 -4.54 120.51 117.88 1j1n n ALA 100 Ca 0.00 -4.43 0.04 0.00 0.00 0.00 0.00 53.44 49.06 1j1n n ALA 100 Cb 0.05 -0.93 0.32 0.00 0.00 0.00 0.00 19.45 18.89 1j1n n ALA 100 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1j1n h PRO 101 N 4.75 0.81 -0.26 0.00 0.13 -1.91 0.07 132.00 135.59 1j1n h PRO 101 Ca 0.17 -0.05 -0.11 0.00 -0.87 0.00 0.00 66.00 65.15 1j1n h PRO 101 Cb 0.74 -0.18 -0.00 0.00 0.13 0.00 0.00 31.00 31.68 1j1n h PRO 101 CO 0.72 0.54 -0.26 0.45 -0.23 0.00 0.00 178.00 179.22 1j1n h HIS 102 N 0.84 0.77 -0.42 1.56 3.86 -1.90 -0.19 115.15 119.66 1j1n h HIS 102 Ca 0.30 -0.23 -0.11 0.00 -1.16 0.00 0.00 60.37 59.16 1j1n h HIS 102 Cb 0.12 -0.16 -0.01 0.00 1.06 0.00 0.00 27.41 28.42 1j1n h HIS 102 CO -0.00 0.95 -0.17 0.82 0.86 0.00 0.00 177.93 180.39 1j1n h ILE 103 N 0.37 1.28 -0.32 2.45 2.04 -1.78 -0.66 117.51 120.88 1j1n h ILE 103 Ca 0.04 -1.31 0.02 0.00 1.00 0.00 0.00 64.86 64.62 1j1n h ILE 103 Cb 0.82 1.22 -0.03 0.00 -0.74 0.00 0.00 36.82 38.10 1j1n h ILE 103 CO 0.06 0.44 0.15 0.50 0.00 0.00 0.00 178.15 179.31 1j1n h LYS 104 N 0.68 0.31 -0.68 2.37 3.64 -0.91 -0.16 116.57 121.82 1j1n h LYS 104 Ca 0.10 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.41 1j1n h LYS 104 Cb 0.73 -0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.45 1j1n h LYS 104 CO 0.06 0.21 0.22 0.00 -2.27 0.00 0.00 179.45 177.66 1j1n h ALA 105 N 1.17 1.09 -0.29 5.00 0.00 -0.90 -1.86 119.26 123.48 1j1n h ALA 105 Ca 0.13 -0.21 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1j1n h ALA 105 Cb 0.06 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 1j1n h ALA 105 CO -0.10 0.62 0.11 0.35 0.00 0.00 0.00 179.25 180.23 1j1n h PHE 106 N 1.01 0.45 0.00 0.00 3.57 -0.48 -2.38 116.94 119.11 1j1n h PHE 106 Ca 0.22 -0.04 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 1j1n h PHE 106 Cb 0.28 -0.13 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 1j1n h PHE 106 CO 0.02 0.45 -0.29 0.74 -2.23 0.00 0.00 178.31 177.00 1j1n h PHE 107 N 0.31 0.00 -0.37 0.41 0.05 -0.86 0.66 116.94 117.14 1j1n h PHE 107 Ca 0.10 0.00 -0.12 0.00 3.82 0.00 0.00 57.97 61.77 1j1n h PHE 107 Cb 0.20 0.00 -0.01 0.00 2.00 0.00 0.00 35.95 38.13 1j1n h PHE 107 CO -0.00 0.29 -0.25 -0.22 -0.18 0.00 0.00 178.31 177.94 1j1n h LYS 108 N 0.00 0.76 0.00 1.51 1.63 -1.05 -2.01 116.57 117.42 1j1n h LYS 108 Ca -0.00 -0.32 0.00 0.00 -0.85 0.00 0.00 60.65 59.48 1j1n h LYS 108 Cb 0.54 -0.03 0.00 0.00 -0.60 0.00 0.00 32.23 32.14 1j1n h LYS 108 CO 0.04 0.94 -0.54 -1.13 -3.45 0.00 0.00 179.45 175.31 1j1n n SER 109 N -4.10 0.53 -3.02 4.20 3.41 -0.92 -4.22 113.62 109.49 1j1n n SER 109 Ca -0.00 -0.14 -0.21 0.00 -0.26 0.00 0.00 58.87 58.25 1j1n n SER 109 Cb 0.45 0.23 -0.03 0.00 -0.26 0.00 0.00 64.21 64.60 1j1n n SER 109 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 1j1n n HIS 110 N -1.65 1.92 0.10 7.33 8.25 0.19 -4.94 115.22 126.43 1j1n n HIS 110 Ca 0.05 -3.79 0.17 0.00 -0.26 0.00 0.00 57.72 53.88 1j1n n HIS 110 Cb 0.36 -0.43 0.71 0.00 1.12 0.00 0.00 29.99 31.75 1j1n n HIS 110 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1j1n h PRO 111 N 2.97 0.00 -0.38 -0.41 0.13 -1.54 -1.35 132.00 131.42 1j1n h PRO 111 Ca 0.11 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 65.14 1j1n h PRO 111 Cb 0.80 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 1j1n h PRO 111 CO 0.64 0.00 -0.17 0.93 -0.23 0.00 0.00 178.00 179.18 1j1n h GLU 112 N 0.00 0.71 -0.32 0.86 3.07 -1.92 -1.81 114.58 115.17 1j1n h GLU 112 Ca 0.16 -0.25 -0.09 0.00 -0.50 0.00 0.00 59.36 58.68 1j1n h GLU 112 Cb 0.68 -0.05 -0.01 0.00 -0.84 0.00 0.00 28.75 28.53 1j1n h GLU 112 CO -0.00 0.84 -0.13 0.28 -1.40 0.00 0.00 179.01 178.59 1j1n h VAL 113 N 0.64 1.29 -0.61 3.13 2.07 -1.61 -1.89 116.25 119.27 1j1n h VAL 113 Ca 0.10 -1.22 -0.00 0.00 0.82 0.00 0.00 66.70 66.40 1j1n h VAL 113 Cb 0.64 1.40 -0.03 0.00 -1.52 0.00 0.00 31.29 31.78 1j1n h VAL 113 CO 0.04 0.40 0.37 -0.08 0.02 0.00 0.00 177.57 178.32 1j1n h GLU 114 N 0.43 0.82 -0.30 1.57 4.81 -1.32 -2.40 114.58 118.19 1j1n h GLU 114 Ca 0.08 -0.07 -0.09 0.00 -0.13 0.00 0.00 59.36 59.15 1j1n h GLU 114 Cb 0.65 -0.17 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 1j1n h GLU 114 CO 0.04 0.58 -0.18 -0.09 -0.73 0.00 0.00 179.01 178.63 1j1n h ARG 115 N 0.82 0.54 -0.12 1.92 2.43 -1.28 -2.84 114.38 115.86 1j1n h ARG 115 Ca 0.22 -0.18 -0.07 0.00 -0.81 0.00 0.00 59.98 59.14 1j1n h ARG 115 Cb -0.03 -0.04 -0.01 0.00 -0.42 0.00 0.00 29.97 29.46 1j1n h ARG 115 CO -0.04 0.70 -0.24 0.00 -1.51 0.00 0.00 179.97 178.88 1j1n h ALA 116 N 1.32 1.38 0.00 2.80 0.00 -0.86 -3.04 119.26 120.85 1j1n h ALA 116 Ca 0.08 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1j1n h ALA 116 Cb 0.59 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1j1n h ALA 116 CO 0.04 0.43 -0.68 0.44 0.00 0.00 0.00 179.25 179.48 1j1n n ILE 117 N -4.18 0.09 -2.26 0.00 -5.35 -0.98 -4.95 119.36 101.73 1j1n n ILE 117 Ca -0.01 -0.09 -0.37 0.00 -0.27 0.00 0.00 62.75 62.00 1j1n n ILE 117 Cb 0.34 0.26 -0.01 0.00 -1.74 0.00 0.00 39.64 38.49 1j1n n ILE 117 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1j1n s LYS 118 N -3.07 3.79 0.61 6.28 1.02 -1.09 -4.62 119.74 122.67 1j1n s LYS 118 Ca 0.08 1.78 -0.06 0.00 0.02 0.00 0.00 55.97 57.79 1j1n s LYS 118 Cb 0.16 -2.43 0.02 0.00 -0.52 0.00 0.00 37.83 35.06 1j1n s LYS 118 CO 0.74 -0.53 0.92 0.00 -0.92 0.00 0.00 175.35 175.56 1j1n s ALA 119 N -1.54 3.30 0.54 5.17 0.00 -0.44 -4.93 121.76 123.86 1j1n s ALA 119 Ca 0.63 -0.78 0.25 0.00 0.00 0.00 0.00 51.96 52.06 1j1n s ALA 119 Cb -0.29 -2.57 1.42 0.00 0.00 0.00 0.00 23.12 21.69 1j1n s ALA 119 CO 0.35 -0.90 2.01 -1.35 0.00 0.00 0.00 175.76 175.87 1j1n h PRO 120 N -0.24 0.00 -0.02 0.00 0.11 -1.90 0.12 132.00 130.07 1j1n h PRO 120 Ca -0.45 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.66 1j1n h PRO 120 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1j1n h PRO 120 CO 0.60 0.00 0.00 -0.40 -0.21 0.00 0.00 178.00 177.99 1j1n n ASP 121 N -4.28 0.13 0.00 -2.05 5.68 -1.26 -4.70 116.55 110.08 1j1n n ASP 121 Ca 0.08 -1.62 0.00 0.00 -0.50 0.00 0.00 54.79 52.75 1j1n n ASP 121 Cb 0.54 -0.01 0.00 0.00 -1.14 0.00 0.00 41.12 40.51 1j1n n ASP 121 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1j1n n GLY 122 N 0.73 1.20 3.87 6.12 0.00 0.40 -5.03 105.19 112.48 1j1n n GLY 122 Ca 0.10 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.79 1j1n n GLY 122 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1j1n s ASN 123 N -3.12 6.67 -0.34 1.61 0.01 -1.26 -4.76 114.94 113.75 1j1n s ASN 123 Ca 0.00 0.96 -0.15 0.00 -0.71 0.00 0.00 52.86 52.96 1j1n s ASN 123 Cb 0.00 -2.24 -0.01 0.00 0.41 0.00 0.00 41.25 39.41 1j1n s ASN 123 CO 0.00 -0.04 0.33 -0.63 -1.51 0.00 0.00 177.10 175.24 1j1n s ILE 124 N -1.76 5.20 -1.83 0.60 1.01 -1.26 -1.33 121.20 121.83 1j1n s ILE 124 Ca 0.46 -0.02 0.20 0.00 0.00 0.00 0.00 60.65 61.28 1j1n s ILE 124 Cb -0.12 -3.79 -0.01 0.00 0.01 0.00 0.00 42.46 38.55 1j1n s ILE 124 CO 0.21 -0.07 1.00 -1.22 0.00 0.00 0.00 174.94 174.86 1j1n n TYR 125 N 5.31 0.00 -3.57 3.97 4.02 -1.26 0.06 117.16 125.69 1j1n n TYR 125 Ca -0.10 0.00 -0.13 0.00 -0.01 0.00 0.00 57.90 57.66 1j1n n TYR 125 Cb 0.49 0.00 -0.05 0.00 -0.02 0.00 0.00 39.34 39.77 1j1n n TYR 125 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 176.86 175.26 1j1n s PHE 126 N -2.25 -0.38 -0.24 -0.72 -0.71 -1.26 -4.43 117.98 107.97 1j1n s PHE 126 Ca 0.16 0.28 -0.10 0.00 -1.04 0.00 0.00 56.93 56.24 1j1n s PHE 126 Cb 0.16 0.35 -0.05 0.00 -1.21 0.00 0.00 43.02 42.28 1j1n s PHE 126 CO 0.51 -0.69 0.15 0.42 -1.34 0.00 0.00 175.22 174.27 1j1n s ILE 127 N -3.04 5.21 0.56 -4.49 -1.09 -0.49 -4.95 121.20 112.91 1j1n s ILE 127 Ca -0.02 0.13 -0.06 0.00 -2.23 0.00 0.00 60.65 58.47 1j1n s ILE 127 Cb -0.00 -3.44 -0.01 0.00 -1.58 0.00 0.00 42.46 37.43 1j1n s ILE 127 CO -0.06 0.33 0.88 -2.16 -1.23 0.00 0.00 174.94 172.70 1j1n s PRO 128 N 1.21 3.21 -0.31 2.79 0.04 -1.26 -2.00 135.00 138.67 1j1n s PRO 128 Ca 0.07 0.16 -0.25 0.00 0.04 0.00 0.00 61.00 61.02 1j1n s PRO 128 Cb -0.14 -2.28 0.01 0.00 0.04 0.00 0.00 34.50 32.12 1j1n s PRO 128 CO 0.06 -0.52 0.87 -0.47 0.04 0.00 0.00 177.00 176.97 1j1n s TYR 129 N -2.93 3.18 -0.40 0.56 5.04 -0.58 -2.70 117.35 119.52 1j1n s TYR 129 Ca 0.52 0.90 -0.12 0.00 -2.44 0.00 0.00 57.07 55.93 1j1n s TYR 129 Cb -0.10 -3.36 0.05 0.00 0.35 0.00 0.00 41.96 38.89 1j1n s TYR 129 CO 0.46 -0.64 0.26 0.08 -1.34 0.00 0.00 175.55 174.37 1j1n s VAL 130 N 3.16 4.66 0.75 3.14 1.01 -0.42 -2.02 120.40 130.68 1j1n s VAL 130 Ca 0.36 -1.00 -0.11 0.00 0.00 0.00 0.00 61.98 61.24 1j1n s VAL 130 Cb -0.13 -3.69 0.04 0.00 0.00 0.00 0.00 36.38 32.60 1j1n s VAL 130 CO 0.14 -0.36 1.08 -2.84 0.00 0.00 0.00 175.10 173.12 1j1n s PRO 131 N 1.55 2.44 -0.11 2.72 0.02 -1.26 -0.78 135.00 139.58 1j1n s PRO 131 Ca 0.03 1.11 -0.01 0.00 0.02 0.00 0.00 61.00 62.15 1j1n s PRO 131 Cb -0.21 -1.92 0.03 0.00 0.02 0.00 0.00 34.50 32.42 1j1n s PRO 131 CO 0.06 -1.49 -0.06 0.34 -0.33 0.00 0.00 177.00 175.52 1j1n s ASP 132 N -3.51 2.12 0.00 2.53 3.68 -1.26 -4.77 116.67 115.46 1j1n s ASP 132 Ca 0.60 -0.30 0.00 0.00 2.13 0.00 0.00 52.55 54.99 1j1n s ASP 132 Cb -0.16 -0.76 0.00 0.00 -1.45 0.00 0.00 42.92 40.55 1j1n s ASP 132 CO 0.56 -0.14 0.00 0.61 0.13 0.00 0.00 175.17 176.32 1j1n n GLY 133 N 4.98 -2.47 1.09 2.66 0.00 -1.26 -4.38 105.19 105.81 1j1n n GLY 133 Ca -0.11 -1.37 0.00 0.00 0.00 0.00 0.00 46.02 44.54 1j1n n GLY 133 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1j1n n VAL 134 N 0.09 1.05 -3.30 1.61 0.31 -1.26 -4.83 118.33 112.00 1j1n n VAL 134 Ca 0.00 0.35 -0.20 0.00 -0.01 0.00 0.00 64.34 64.48 1j1n n VAL 134 Cb 0.00 -1.53 0.00 0.00 -0.91 0.00 0.00 33.84 31.40 1j1n n VAL 134 CO 0.00 0.00 0.00 0.68 -1.32 0.00 0.00 176.83 176.19 1j1n s VAL 135 N -2.00 4.00 0.00 2.52 -7.23 -1.26 -2.05 120.40 114.38 1j1n s VAL 135 Ca 0.00 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1j1n s VAL 135 Cb 0.00 -3.41 0.00 0.00 0.56 0.00 0.00 36.38 33.53 1j1n s VAL 135 CO 0.00 -0.20 0.00 0.00 -0.31 0.00 0.00 175.10 174.59 1j1n n ALA 136 N -1.79 0.46 -2.21 1.32 0.00 -1.26 -4.28 120.51 112.74 1j1n n ALA 136 Ca 0.01 0.00 -0.27 0.00 0.00 0.00 0.00 53.44 53.18 1j1n n ALA 136 Cb 0.58 0.00 0.01 0.00 0.00 0.00 0.00 19.45 20.04 1j1n n ALA 136 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1j1n s ARG 137 N 0.54 3.28 0.29 0.00 0.52 -1.26 -3.27 118.95 119.05 1j1n s ARG 137 Ca 0.00 0.07 -0.14 0.00 -0.52 0.00 0.00 55.73 55.14 1j1n s ARG 137 Cb 0.00 -2.35 0.01 0.00 0.52 0.00 0.00 34.95 33.13 1j1n s ARG 137 CO 0.00 -0.38 0.59 0.20 0.02 0.00 0.00 175.30 175.73 1j1n s GLY 138 N -4.19 0.45 -0.03 -3.53 0.00 -0.04 -4.85 107.32 95.14 1j1n s GLY 138 Ca 0.50 -0.78 -0.16 0.00 0.00 0.00 0.00 44.72 44.28 1j1n s GLY 138 CO 0.44 -0.48 0.43 -0.19 0.00 0.00 0.00 173.10 173.30 1j1n s TYR 139 N -3.63 3.68 -0.01 1.90 1.51 -1.26 -1.96 117.35 117.57 1j1n s TYR 139 Ca 0.19 0.97 0.04 0.00 -1.01 0.00 0.00 57.07 57.26 1j1n s TYR 139 Cb -0.03 -2.36 -0.01 0.00 -0.11 0.00 0.00 41.96 39.46 1j1n s TYR 139 CO 0.10 0.53 -0.12 -0.06 -1.11 0.00 0.00 175.55 174.89 1j1n s PHE 140 N -0.66 1.08 0.05 2.71 0.40 -0.56 -1.34 117.98 119.66 1j1n s PHE 140 Ca 0.24 -0.22 0.01 0.00 -0.60 0.00 0.00 56.93 56.36 1j1n s PHE 140 Cb -0.16 -0.71 -0.03 0.00 0.51 0.00 0.00 43.02 42.63 1j1n s PHE 140 CO 0.13 -0.04 -0.06 -1.50 0.70 0.00 0.00 175.22 174.44 1j1n s ILE 141 N -0.18 0.47 -0.61 0.64 2.07 -0.74 -1.76 121.20 121.08 1j1n s ILE 141 Ca 0.03 -1.31 -0.27 0.00 -1.41 0.00 0.00 60.65 57.69 1j1n s ILE 141 Cb -0.06 -0.87 -0.00 0.00 0.13 0.00 0.00 42.46 41.66 1j1n s ILE 141 CO -0.00 -0.57 1.65 -0.13 -1.91 0.00 0.00 174.94 173.98 1j1n s ARG 142 N -2.27 2.91 0.29 3.50 1.81 -0.65 -1.28 118.95 123.26 1j1n s ARG 142 Ca -0.05 0.45 0.08 0.00 -1.72 0.00 0.00 55.73 54.49 1j1n s ARG 142 Cb -0.05 -4.29 0.43 0.00 -0.45 0.00 0.00 34.95 30.59 1j1n s ARG 142 CO -0.02 -2.42 1.67 1.49 -0.68 0.00 0.00 175.30 175.34 1j1n h GLU 143 N 13.10 0.16 -0.31 3.54 4.81 -0.81 -2.17 114.58 132.89 1j1n h GLU 143 Ca -0.27 -0.09 -0.06 0.00 -0.13 0.00 0.00 59.36 58.81 1j1n h GLU 143 Cb 1.13 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.49 1j1n h GLU 143 CO 1.21 0.61 -0.07 0.38 -0.73 0.00 0.00 179.01 180.42 1j1n h ASP 144 N 0.13 0.48 0.09 1.04 -0.00 -1.81 -0.69 116.42 115.67 1j1n h ASP 144 Ca 0.00 -0.11 -0.17 0.00 -0.00 0.00 0.00 57.03 56.75 1j1n h ASP 144 Cb 0.91 -0.13 -0.00 0.00 -0.00 0.00 0.00 39.33 40.11 1j1n h ASP 144 CO 0.07 0.60 -0.63 -0.50 -0.00 0.00 0.00 179.24 178.78 1j1n h TRP 145 N 0.48 0.67 -0.75 4.15 4.06 -1.80 -1.93 115.95 120.83 1j1n h TRP 145 Ca 0.10 -0.26 -0.06 0.00 2.06 0.00 0.00 58.89 60.72 1j1n h TRP 145 Cb 0.41 -0.12 -0.03 0.00 -1.00 0.00 0.00 29.16 28.42 1j1n h TRP 145 CO 0.01 1.01 0.23 -0.07 -3.56 0.00 0.00 178.44 176.06 1j1n h LEU 146 N 0.38 1.09 -0.22 -4.49 3.38 -0.86 -1.86 115.31 112.73 1j1n h LEU 146 Ca -0.01 -0.21 -0.04 0.00 0.09 0.00 0.00 57.88 57.71 1j1n h LEU 146 Cb 1.19 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.65 1j1n h LEU 146 CO 0.12 1.02 -0.00 0.50 0.09 0.00 0.00 178.44 180.16 1j1n h LYS 147 N 1.12 0.38 -0.90 1.13 3.64 -1.01 0.13 116.57 121.06 1j1n h LYS 147 Ca 0.24 -0.12 0.03 0.00 -1.27 0.00 0.00 60.65 59.53 1j1n h LYS 147 Cb 0.32 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 32.05 1j1n h LYS 147 CO -0.01 0.58 0.59 0.87 -2.27 0.00 0.00 179.45 179.21 1j1n h LYS 148 N 0.15 1.12 -0.19 1.90 1.57 -1.19 -2.05 116.57 117.87 1j1n h LYS 148 Ca 0.06 -0.07 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1j1n h LYS 148 Cb 0.40 -0.25 0.00 0.00 0.08 0.00 0.00 32.23 32.46 1j1n h LYS 148 CO 0.01 0.74 0.00 1.28 -0.57 0.00 0.00 179.45 180.91 1j1n n LEU 149 N -4.43 2.03 -3.75 2.94 4.77 -0.71 -4.95 117.00 112.90 1j1n n LEU 149 Ca 0.12 -0.84 -0.26 0.00 -0.03 0.00 0.00 56.01 55.00 1j1n n LEU 149 Cb 0.08 -0.12 0.05 0.00 -2.33 0.00 0.00 43.42 41.10 1j1n n LEU 149 CO 0.35 0.42 0.13 0.59 -1.33 0.00 0.00 177.39 177.55 1j1n n ASN 150 N 0.57 -4.64 -4.60 -1.43 3.02 -0.43 -4.99 115.26 102.76 1j1n n ASN 150 Ca 0.17 -0.70 -0.28 0.00 -0.03 0.00 0.00 54.58 53.74 1j1n n ASN 150 Cb 0.39 -4.37 -0.09 0.00 -0.61 0.00 0.00 39.78 35.10 1j1n n ASN 150 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1j1n s LEU 151 N -7.15 3.10 0.24 3.41 1.43 0.32 -5.03 118.68 114.99 1j1n s LEU 151 Ca 0.50 -0.43 0.01 0.00 -1.03 0.00 0.00 54.13 53.18 1j1n s LEU 151 Cb -0.24 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.11 1j1n s LEU 151 CO 0.79 0.14 0.41 -0.54 0.23 0.00 0.00 176.35 177.38 1j1n s LYS 152 N -2.53 3.49 0.29 1.70 1.02 -1.26 -4.50 119.74 117.95 1j1n s LYS 152 Ca 0.24 -0.45 -0.30 0.00 0.02 0.00 0.00 55.97 55.48 1j1n s LYS 152 Cb -0.10 -2.82 -0.12 0.00 -0.52 0.00 0.00 37.83 34.27 1j1n s LYS 152 CO 0.15 0.36 1.52 -2.30 -0.92 0.00 0.00 175.35 174.17 1j1n n PRO 153 N -1.05 2.50 -1.96 -1.68 -0.02 -1.26 -4.88 135.00 126.65 1j1n n PRO 153 Ca -0.06 0.89 -0.42 0.00 -2.02 0.00 0.00 63.50 61.89 1j1n n PRO 153 Cb 0.55 -2.62 -0.03 0.00 -0.02 0.00 0.00 33.50 31.38 1j1n n PRO 153 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 1j1n s PRO 154 N -0.72 4.22 0.04 0.52 0.04 -1.26 -4.92 135.00 132.91 1j1n s PRO 154 Ca 0.63 2.32 0.23 0.00 0.04 0.00 0.00 61.00 64.22 1j1n s PRO 154 Cb -0.53 -3.32 -0.04 0.00 0.04 0.00 0.00 34.50 30.65 1j1n s PRO 154 CO 0.51 -0.63 0.94 1.04 0.04 0.00 0.00 177.00 178.90 1j1n n GLN 155 N 4.53 0.30 -4.01 4.56 1.13 -1.26 -4.62 117.38 118.01 1j1n n GLN 155 Ca 0.14 -0.03 -0.11 0.00 -1.94 0.00 0.00 57.00 55.07 1j1n n GLN 155 Cb 0.40 -1.57 -0.04 0.00 0.11 0.00 0.00 30.24 29.13 1j1n n GLN 155 CO 0.00 0.00 0.00 0.54 -1.44 0.00 0.00 177.06 176.16 1j1n s ASN 156 N -3.89 0.20 0.48 1.08 2.20 -1.26 -1.63 114.94 112.12 1j1n s ASN 156 Ca 0.03 -1.11 0.14 0.00 -0.94 0.00 0.00 52.86 50.98 1j1n s ASN 156 Cb 0.14 0.63 1.12 0.00 -2.00 0.00 0.00 41.25 41.15 1j1n s ASN 156 CO 0.82 -1.24 2.08 -0.29 -2.94 0.00 0.00 177.10 175.54 1j1n h ILE 157 N 2.19 1.06 -0.22 0.54 6.09 -1.20 0.10 117.51 126.07 1j1n h ILE 157 Ca -0.27 -0.25 -0.04 0.00 -1.37 0.00 0.00 64.86 62.93 1j1n h ILE 157 Cb 1.25 1.06 -0.01 0.00 0.47 0.00 0.00 36.82 39.59 1j1n h ILE 157 CO 0.37 0.08 -0.00 0.44 -3.07 0.00 0.00 178.15 175.97 1j1n h ASP 158 N 0.07 0.38 -0.04 2.19 3.45 -1.96 -2.01 116.42 118.51 1j1n h ASP 158 Ca 0.02 -0.31 -0.10 0.00 0.43 0.00 0.00 57.03 57.06 1j1n h ASP 158 Cb 0.11 -0.10 -0.01 0.00 -0.56 0.00 0.00 39.33 38.77 1j1n h ASP 158 CO 0.01 0.60 -0.29 -0.33 -1.57 0.00 0.00 179.24 177.66 1j1n h GLU 159 N 0.16 0.48 -0.46 3.56 5.08 -1.81 -2.52 114.58 119.06 1j1n h GLU 159 Ca 0.06 -0.19 -0.02 0.00 -1.00 0.00 0.00 59.36 58.20 1j1n h GLU 159 Cb 0.41 -0.02 -0.02 0.00 0.50 0.00 0.00 28.75 29.61 1j1n h GLU 159 CO 0.01 0.72 0.20 1.25 -1.00 0.00 0.00 179.01 180.19 1j1n h LEU 160 N 0.42 0.62 -0.35 1.33 5.85 -0.84 -0.32 115.31 122.02 1j1n h LEU 160 Ca 0.06 -0.16 0.02 0.00 0.84 0.00 0.00 57.88 58.64 1j1n h LEU 160 Cb 0.72 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.56 1j1n h LEU 160 CO 0.05 0.61 0.20 0.22 -0.34 0.00 0.00 178.44 179.18 1j1n h TYR 161 N 0.60 0.37 -0.62 1.25 5.03 -1.21 0.04 116.97 122.42 1j1n h TYR 161 Ca 0.15 0.01 0.03 0.00 2.58 0.00 0.00 58.73 61.51 1j1n h TYR 161 Cb 0.17 -0.12 -0.04 0.00 1.55 0.00 0.00 36.73 38.29 1j1n h TYR 161 CO -0.00 0.21 0.38 1.15 -1.32 0.00 0.00 178.16 178.58 1j1n h THR 162 N 0.40 1.07 -0.28 1.81 2.02 -1.10 -0.64 112.91 116.18 1j1n h THR 162 Ca 0.14 -0.26 -0.05 0.00 0.77 0.00 0.00 66.41 67.01 1j1n h THR 162 Cb 0.02 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.68 1j1n h THR 162 CO -0.07 0.14 -0.02 0.58 0.37 0.00 0.00 175.52 176.51 1j1n h VAL 163 N 0.74 1.27 -0.30 3.16 2.07 -0.65 -1.98 116.25 120.56 1j1n h VAL 163 Ca 0.25 -0.99 -0.06 0.00 0.82 0.00 0.00 66.70 66.72 1j1n h VAL 163 Cb 0.02 1.34 -0.02 0.00 -1.52 0.00 0.00 31.29 31.12 1j1n h VAL 163 CO -0.10 0.32 -0.08 -0.07 0.02 0.00 0.00 177.57 177.65 1j1n h LEU 164 N 0.30 0.47 -0.87 2.57 3.38 -0.79 -0.76 115.31 119.60 1j1n h LEU 164 Ca 0.08 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 1j1n h LEU 164 Cb 0.47 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.08 1j1n h LEU 164 CO 0.02 0.59 -0.20 0.11 0.09 0.00 0.00 178.44 179.05 1j1n h LYS 165 N 0.46 0.60 -0.46 1.13 1.79 -0.99 -1.54 116.57 117.56 1j1n h LYS 165 Ca 0.09 -0.22 -0.12 0.00 -2.18 0.00 0.00 60.65 58.22 1j1n h LYS 165 Cb 0.43 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 31.02 1j1n h LYS 165 CO 0.02 0.77 -0.20 0.00 -1.08 0.00 0.00 179.45 178.96 1j1n h ALA 166 N 1.24 0.77 -0.74 3.86 0.00 -0.56 0.08 119.26 123.91 1j1n h ALA 166 Ca 0.08 -0.38 -0.04 0.00 0.00 0.00 0.00 54.91 54.57 1j1n h ALA 166 Cb 0.65 -0.17 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1j1n h ALA 166 CO 0.05 0.66 0.31 0.74 0.00 0.00 0.00 179.25 181.00 1j1n h PHE 167 N 0.81 1.10 -0.31 0.00 0.04 -0.83 0.16 116.94 117.91 1j1n h PHE 167 Ca 0.11 -0.07 -0.15 0.00 2.80 0.00 0.00 57.97 60.66 1j1n h PHE 167 Cb 0.76 -0.33 -0.00 0.00 2.20 0.00 0.00 35.95 38.57 1j1n h PHE 167 CO 0.05 0.83 -0.40 -0.22 -0.60 0.00 0.00 178.31 177.96 1j1n h LYS 168 N 1.07 0.82 0.00 1.51 1.63 -0.92 -3.38 116.57 117.30 1j1n h LYS 168 Ca 0.25 -0.47 0.00 0.00 -0.85 0.00 0.00 60.65 59.58 1j1n h LYS 168 Cb 0.18 0.03 0.00 0.00 -0.60 0.00 0.00 32.23 31.85 1j1n h LYS 168 CO -0.02 1.10 -1.26 0.39 -3.45 0.00 0.00 179.45 176.21 1j1n n GLU 169 N -4.13 0.88 -0.67 1.90 1.02 -0.02 -4.63 120.64 114.99 1j1n n GLU 169 Ca -0.04 -0.07 0.08 0.00 -0.02 0.00 0.00 57.16 57.11 1j1n n GLU 169 Cb 0.55 -1.38 0.35 0.00 -0.02 0.00 0.00 31.44 30.94 1j1n n GLU 169 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1j1n n LYS 170 N -1.72 4.01 -3.87 3.49 5.02 0.55 -5.00 118.16 120.64 1j1n n LYS 170 Ca 0.01 -2.95 -0.34 0.00 -2.02 0.00 0.00 58.31 53.01 1j1n n LYS 170 Cb 0.36 -2.00 0.02 0.00 -0.02 0.00 0.00 35.03 33.39 1j1n n LYS 170 CO 0.00 0.00 0.00 -3.47 -0.52 0.00 0.00 177.40 173.41 1j1n n ASP 171 N 0.62 -3.50 0.23 4.39 4.64 -1.26 -4.88 116.55 116.79 1j1n n ASP 171 Ca 0.25 -1.09 0.08 0.00 -1.38 0.00 0.00 54.79 52.65 1j1n n ASP 171 Cb 0.99 -2.81 0.57 0.00 -1.04 0.00 0.00 41.12 38.82 1j1n n ASP 171 CO 0.00 0.00 0.00 1.55 -0.82 0.00 0.00 177.20 177.93 1j1n h PRO 172 N -2.05 0.00 0.00 -0.67 0.13 -1.86 -1.96 132.00 125.59 1j1n h PRO 172 Ca -0.67 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.46 1j1n h PRO 172 Cb 1.38 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.51 1j1n h PRO 172 CO 0.54 0.20 0.00 0.27 -0.23 0.00 0.00 178.00 178.77 1j1n n ASN 173 N -3.94 0.00 -1.00 1.44 0.23 -1.26 -4.93 115.26 105.79 1j1n n ASN 173 Ca -0.02 0.32 -0.11 0.00 -0.53 0.00 0.00 54.58 54.23 1j1n n ASN 173 Cb 0.28 -0.43 -0.03 0.00 -2.08 0.00 0.00 39.78 37.51 1j1n n ASN 173 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1j1n n GLY 174 N 1.15 0.82 1.77 4.83 0.00 -0.74 -4.93 105.19 108.10 1j1n n GLY 174 Ca 0.08 -0.48 0.07 0.00 0.00 0.00 0.00 46.02 45.70 1j1n n GLY 174 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1j1n n ASN 175 N 0.07 5.33 -1.79 1.61 2.04 -1.26 -4.93 115.26 116.34 1j1n n ASN 175 Ca -0.12 -2.77 -0.21 0.00 -0.44 0.00 0.00 54.58 51.04 1j1n n ASN 175 Cb 0.44 -0.65 -0.07 0.00 -2.53 0.00 0.00 39.78 36.97 1j1n n ASN 175 CO 0.00 0.00 0.00 0.61 -0.44 0.00 0.00 177.26 177.43 1j1n n GLY 176 N 0.75 1.43 3.11 4.83 0.00 -1.26 -4.98 105.19 109.07 1j1n n GLY 176 Ca 0.26 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 46.14 1j1n n GLY 176 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1n s LYS 177 N -4.06 0.65 -1.26 1.61 1.02 -1.26 -5.06 119.74 111.38 1j1n s LYS 177 Ca 0.00 -0.87 -0.10 0.00 0.02 0.00 0.00 55.97 55.02 1j1n s LYS 177 Cb 0.00 -0.46 0.18 0.00 -0.52 0.00 0.00 37.83 37.03 1j1n s LYS 177 CO 0.00 0.09 1.77 0.00 -0.92 0.00 0.00 175.35 176.29 1j1n n ALA 178 N 1.28 5.09 0.50 5.17 0.00 -1.26 -4.54 120.51 126.74 1j1n n ALA 178 Ca -0.21 -4.33 0.05 0.00 0.00 0.00 0.00 53.44 48.95 1j1n n ALA 178 Cb 0.55 -2.96 -0.03 0.00 0.00 0.00 0.00 19.45 17.01 1j1n n ALA 178 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1j1n n ASP 179 N 4.05 0.95 -4.77 0.00 3.85 -1.26 -5.02 116.55 114.35 1j1n n ASP 179 Ca 0.38 -0.97 -0.41 0.00 -0.71 0.00 0.00 54.79 53.08 1j1n n ASP 179 Cb 0.37 0.70 -0.01 0.00 -1.35 0.00 0.00 41.12 40.83 1j1n n ASP 179 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1j1n s GLU 180 N -1.70 4.19 -0.38 0.11 8.01 -1.26 -4.88 118.70 122.79 1j1n s GLU 180 Ca 0.07 2.45 0.04 0.00 0.01 0.00 0.00 54.97 57.54 1j1n s GLU 180 Cb 0.09 -3.01 0.11 0.00 -4.31 0.00 0.00 34.13 27.00 1j1n s GLU 180 CO 0.35 -0.43 0.10 0.08 0.01 0.00 0.00 175.26 175.37 1j1n s VAL 181 N -0.99 2.30 0.07 2.63 1.01 0.71 -4.75 120.40 121.37 1j1n s VAL 181 Ca 0.53 -2.53 -0.15 0.00 0.00 0.00 0.00 61.98 59.83 1j1n s VAL 181 Cb -0.44 -2.68 -0.04 0.00 0.00 0.00 0.00 36.38 33.22 1j1n s VAL 181 CO 0.58 -0.65 1.25 -0.65 0.00 0.00 0.00 175.10 175.64 1j1n h PRO 182 N 7.38 -0.05 -5.26 2.72 0.11 -1.77 -3.14 132.00 131.99 1j1n h PRO 182 Ca -0.05 0.00 -0.63 0.00 0.11 0.00 0.00 66.00 65.43 1j1n h PRO 182 Cb 0.99 0.01 -0.19 0.00 0.11 0.00 0.00 31.00 31.92 1j1n h PRO 182 CO 0.55 -0.04 -0.62 0.12 -0.21 0.00 0.00 178.00 177.81 1j1n s PHE 183 N -4.19 3.13 0.08 0.65 2.19 -0.02 -0.10 117.98 119.72 1j1n s PHE 183 Ca -0.06 -0.14 0.01 0.00 0.33 0.00 0.00 56.93 57.07 1j1n s PHE 183 Cb 0.05 -2.03 -0.04 0.00 -1.31 0.00 0.00 43.02 39.69 1j1n s PHE 183 CO 0.29 0.02 -0.06 0.96 1.83 0.00 0.00 175.22 178.26 1j1n s ILE 184 N 0.46 0.59 -0.28 3.12 -5.25 -0.81 -1.63 121.20 117.39 1j1n s ILE 184 Ca -0.00 -1.80 -0.21 0.00 -0.99 0.00 0.00 60.65 57.65 1j1n s ILE 184 Cb -0.13 -1.50 0.11 0.00 2.95 0.00 0.00 42.46 43.88 1j1n s ILE 184 CO 0.02 -0.83 0.89 -0.62 -1.79 0.00 0.00 174.94 172.60 1j1n s ASP 185 N -2.82 -0.62 0.33 4.36 -1.08 -1.26 -4.35 116.67 111.22 1j1n s ASP 185 Ca 0.08 1.11 0.26 0.00 -0.52 0.00 0.00 52.55 53.48 1j1n s ASP 185 Cb 0.04 1.18 1.01 0.00 -1.46 0.00 0.00 42.92 43.68 1j1n s ASP 185 CO -0.05 -0.18 1.78 0.08 0.52 0.00 0.00 175.17 177.32 1j1n h ARG 186 N 5.30 0.00 -4.63 4.34 0.11 -1.91 -3.39 114.38 114.20 1j1n h ARG 186 Ca -0.29 0.00 -0.70 0.00 0.10 0.00 0.00 59.98 59.09 1j1n h ARG 186 Cb 1.19 0.00 -0.29 0.00 1.11 0.00 0.00 29.97 31.98 1j1n h ARG 186 CO 0.12 0.00 -0.58 -1.01 0.10 0.00 0.00 179.97 178.60 1j1n s HIS 187 N -3.36 3.28 0.37 4.08 3.76 -1.26 -3.63 115.29 118.53 1j1n s HIS 187 Ca 0.05 -1.49 0.14 0.00 -0.15 0.00 0.00 55.06 53.61 1j1n s HIS 187 Cb 0.09 -2.42 0.99 0.00 1.11 0.00 0.00 32.58 32.35 1j1n s HIS 187 CO 0.48 -0.76 1.79 -1.35 -0.85 0.00 0.00 174.74 174.05 1j1n h PRO 188 N 8.24 0.49 -0.06 8.40 0.11 -1.76 -1.24 132.00 146.19 1j1n h PRO 188 Ca -0.23 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.87 1j1n h PRO 188 Cb 1.08 -0.11 -0.00 0.00 0.11 0.00 0.00 31.00 32.08 1j1n h PRO 188 CO 0.63 0.33 0.16 -0.44 -0.21 0.00 0.00 178.00 178.47 1j1n h ASP 189 N 0.51 0.00 0.65 -2.05 5.19 -1.93 -0.90 116.42 117.88 1j1n h ASP 189 Ca 0.56 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.97 1j1n h ASP 189 Cb 1.24 0.00 0.00 0.00 0.18 0.00 0.00 39.33 40.75 1j1n h ASP 189 CO -0.29 0.00 0.00 -0.33 -3.12 0.00 0.00 179.24 175.50 1j1n h GLU 190 N 0.00 0.00 -0.13 3.56 4.39 -1.62 -2.04 114.58 118.74 1j1n h GLU 190 Ca 0.03 0.00 -0.08 0.00 0.34 0.00 0.00 59.36 59.65 1j1n h GLU 190 Cb 0.35 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1j1n h GLU 190 CO -0.00 0.00 -0.26 -0.24 -1.16 0.00 0.00 179.01 177.35 1j1n h VAL 191 N 0.00 1.24 0.00 3.13 3.04 -1.35 -2.32 116.25 119.98 1j1n h VAL 191 Ca 0.00 -1.12 -0.17 0.00 -1.01 0.00 0.00 66.70 64.40 1j1n h VAL 191 Cb 0.32 1.44 -0.02 0.00 -2.01 0.00 0.00 31.29 31.01 1j1n h VAL 191 CO 0.00 0.34 -0.79 -0.26 -1.01 0.00 0.00 177.57 175.85 1j1n h PHE 192 N 0.21 0.00 0.00 3.17 -1.00 -1.56 -2.92 116.94 114.84 1j1n h PHE 192 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 1j1n h PHE 192 Cb 0.58 0.00 0.00 0.00 3.61 0.00 0.00 35.95 40.14 1j1n h PHE 192 CO 0.01 0.79 0.00 -2.13 -1.61 0.00 0.00 178.31 175.37 1j1n n ARG 193 N -3.48 0.06 0.20 1.51 0.63 -0.89 -1.67 116.66 113.02 1j1n n ARG 193 Ca -0.00 0.40 0.14 0.00 -0.92 0.00 0.00 57.85 57.47 1j1n n ARG 193 Cb 0.79 -1.65 0.64 0.00 0.45 0.00 0.00 32.46 32.70 1j1n n ARG 193 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1j1n h LEU 194 N 0.00 0.00 -1.32 6.15 3.38 -1.38 -2.12 115.31 120.02 1j1n h LEU 194 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1j1n h LEU 194 Cb 0.19 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.94 1j1n h LEU 194 CO 0.00 0.00 0.00 -0.37 0.09 0.00 0.00 178.44 178.16 1j1n h VAL 195 N 0.00 0.00 -0.26 1.22 -1.51 -1.54 -1.86 116.25 112.30 1j1n h VAL 195 Ca 0.00 -0.17 0.04 0.00 -1.23 0.00 0.00 66.70 65.35 1j1n h VAL 195 Cb 0.29 0.88 -0.01 0.00 -2.13 0.00 0.00 31.29 30.32 1j1n h VAL 195 CO 0.00 0.00 0.18 0.78 -1.23 0.00 0.00 177.57 177.30 1j1n h ASN 196 N 0.00 0.14 0.35 4.19 2.35 -1.14 -0.53 115.58 120.94 1j1n h ASN 196 Ca 0.00 -0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.75 1j1n h ASN 196 Cb 0.22 -0.03 0.00 0.00 0.05 0.00 0.00 38.32 38.56 1j1n h ASN 196 CO 0.00 0.09 0.00 0.49 -1.65 0.00 0.00 177.43 176.36 1j1n n PHE 197 N -4.49 0.00 -1.52 1.19 3.72 -0.70 -1.80 117.46 113.86 1j1n n PHE 197 Ca 0.02 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.49 1j1n n PHE 197 Cb 0.22 -0.42 0.17 0.00 -0.94 0.00 0.00 39.48 38.52 1j1n n PHE 197 CO 0.00 0.00 0.00 0.91 -0.05 0.00 0.00 176.76 177.62 1j1n n TRP 198 N -1.42 0.00 -1.15 1.38 8.01 -0.25 -0.99 117.44 123.02 1j1n n TRP 198 Ca 0.04 -1.26 -0.05 0.00 -1.31 0.00 0.00 57.50 54.92 1j1n n TRP 198 Cb 0.13 -0.21 -0.02 0.00 -2.01 0.00 0.00 31.31 29.19 1j1n n TRP 198 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 1j1n n GLY 199 N -1.08 0.78 3.48 6.99 0.00 -0.74 -4.81 105.19 109.81 1j1n n GLY 199 Ca 0.17 -0.59 -0.33 0.00 0.00 0.00 0.00 46.02 45.27 1j1n n GLY 199 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1n s ALA 200 N -2.13 2.74 0.52 4.61 0.00 -0.95 -5.00 121.76 121.55 1j1n s ALA 200 Ca 0.00 -0.93 -0.17 0.00 0.00 0.00 0.00 51.96 50.86 1j1n s ALA 200 Cb 0.00 -1.11 -0.07 0.00 0.00 0.00 0.00 23.12 21.94 1j1n s ALA 200 CO 0.00 0.47 1.00 1.03 0.00 0.00 0.00 175.76 178.26 1j1n s ARG 201 N -0.44 3.83 -0.00 0.00 1.81 -1.26 -2.64 118.95 120.25 1j1n s ARG 201 Ca 0.06 1.05 0.02 0.00 -1.72 0.00 0.00 55.73 55.13 1j1n s ARG 201 Cb -0.12 -2.12 -0.03 0.00 -0.45 0.00 0.00 34.95 32.23 1j1n s ARG 201 CO 0.02 -0.37 0.05 -1.13 -0.68 0.00 0.00 175.30 173.18 1j1n n SER 202 N -1.55 4.08 -3.54 0.23 3.41 -1.26 -4.67 113.62 110.31 1j1n n SER 202 Ca 0.07 -0.06 -0.11 0.00 -0.26 0.00 0.00 58.87 58.51 1j1n n SER 202 Cb 0.54 1.08 -0.04 0.00 -0.26 0.00 0.00 64.21 65.52 1j1n n SER 202 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1j1n s SER 203 N -2.11 -0.42 0.00 4.04 0.15 -1.26 -3.83 113.70 110.27 1j1n s SER 203 Ca -0.01 0.33 0.28 0.00 0.70 0.00 0.00 55.95 57.25 1j1n s SER 203 Cb 0.01 0.37 0.99 0.00 -1.71 0.00 0.00 66.02 65.68 1j1n s SER 203 CO 0.08 -0.48 1.71 0.61 1.20 0.00 0.00 173.24 176.36 1j1n n GLY 204 N 0.46 -0.39 0.00 9.45 0.00 -0.66 -4.87 105.19 109.18 1j1n n GLY 204 Ca -0.11 -0.40 0.00 0.00 0.00 0.00 0.00 46.02 45.51 1j1n n GLY 204 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1j1n n SER 205 N -0.33 0.00 0.03 1.61 3.41 -1.26 -0.06 113.62 117.02 1j1n n SER 205 Ca 0.16 -0.97 0.09 0.00 -0.26 0.00 0.00 58.87 57.89 1j1n n SER 205 Cb 0.33 0.00 0.37 0.00 -0.26 0.00 0.00 64.21 64.66 1j1n n SER 205 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 1j1n n ASP 206 N -1.15 0.15 -4.67 4.04 4.64 -1.26 -4.49 116.55 113.81 1j1n n ASP 206 Ca 0.00 0.53 -0.39 0.00 -1.38 0.00 0.00 54.79 53.55 1j1n n ASP 206 Cb 0.00 -0.57 -0.06 0.00 -1.04 0.00 0.00 41.12 39.45 1j1n n ASP 206 CO 0.00 0.00 0.00 0.20 -0.82 0.00 0.00 177.20 176.58 1j1n s ASN 207 N -3.28 6.63 0.50 1.67 -0.87 -1.26 -5.02 114.94 113.32 1j1n s ASN 207 Ca 0.07 0.76 -0.23 0.00 -1.57 0.00 0.00 52.86 51.89 1j1n s ASN 207 Cb 0.10 -2.31 -0.06 0.00 -0.02 0.00 0.00 41.25 38.96 1j1n s ASN 207 CO 0.32 -0.17 1.33 -0.31 -2.57 0.00 0.00 177.10 175.70 1j1n s TYR 208 N 1.49 2.47 -1.46 2.20 1.51 -1.26 -3.16 117.35 119.14 1j1n s TYR 208 Ca 0.26 1.39 -0.08 0.00 -1.01 0.00 0.00 57.07 57.63 1j1n s TYR 208 Cb -0.16 -3.73 0.02 0.00 -0.11 0.00 0.00 41.96 37.98 1j1n s TYR 208 CO 0.10 -2.58 0.91 -1.33 -1.11 0.00 0.00 175.55 171.55 1j1n n MET 209 N -0.68 -6.40 -3.06 -0.62 2.81 -1.25 -4.99 117.12 102.93 1j1n n MET 209 Ca 0.08 0.84 -0.27 0.00 -1.81 0.00 0.00 57.70 56.54 1j1n n MET 209 Cb 0.45 -5.80 -0.02 0.00 -0.71 0.00 0.00 33.22 27.15 1j1n n MET 209 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 1j1n s ASP 210 N -3.04 6.36 0.85 7.83 3.68 -1.19 -4.94 116.67 126.22 1j1n s ASP 210 Ca 0.47 0.77 -0.12 0.00 2.13 0.00 0.00 52.55 55.81 1j1n s ASP 210 Cb -0.21 -2.17 0.10 0.00 -1.45 0.00 0.00 42.92 39.19 1j1n s ASP 210 CO 0.58 -0.37 1.10 -0.36 0.13 0.00 0.00 175.17 176.25 1j1n s PHE 211 N -2.39 2.60 0.17 -5.34 0.40 -1.26 -1.65 117.98 110.51 1j1n s PHE 211 Ca 0.45 1.13 -0.07 0.00 -0.60 0.00 0.00 56.93 57.84 1j1n s PHE 211 Cb -0.10 -3.18 -0.02 0.00 0.51 0.00 0.00 43.02 40.24 1j1n s PHE 211 CO 0.36 -2.09 0.26 1.52 0.70 0.00 0.00 175.22 175.98 1j1n s TYR 212 N -3.10 0.54 -0.12 0.36 1.13 -0.58 -3.21 117.35 112.37 1j1n s TYR 212 Ca 0.62 -0.89 -0.01 0.00 -1.41 0.00 0.00 57.07 55.38 1j1n s TYR 212 Cb -0.16 -0.14 -0.02 0.00 -1.10 0.00 0.00 41.96 40.54 1j1n s TYR 212 CO 0.55 -0.72 -0.09 0.42 -2.51 0.00 0.00 175.55 173.20 1j1n s ILE 213 N -4.01 3.45 -0.31 -3.49 -1.09 -1.26 -1.18 121.20 113.31 1j1n s ILE 213 Ca 0.21 -0.53 0.01 0.00 -2.23 0.00 0.00 60.65 58.11 1j1n s ILE 213 Cb 0.04 -2.46 0.10 0.00 -1.58 0.00 0.00 42.46 38.55 1j1n s ILE 213 CO 0.03 0.53 0.07 -0.62 -1.23 0.00 0.00 174.94 173.72 1j1n s ASP 214 N 0.07 4.22 -1.30 3.58 2.15 -0.32 -4.82 116.67 120.25 1j1n s ASP 214 Ca -0.03 -1.74 -0.00 0.00 0.43 0.00 0.00 52.55 51.21 1j1n s ASP 214 Cb -0.14 -1.13 -0.00 0.00 -0.30 0.00 0.00 42.92 41.34 1j1n s ASP 214 CO 0.04 -0.38 0.70 0.59 -0.17 0.00 0.00 175.17 175.95 1j1n n ASN 215 N 4.64 -1.21 0.00 -0.34 5.03 -1.26 -2.13 115.26 119.99 1j1n n ASN 215 Ca -0.01 -0.82 0.00 0.00 0.87 0.00 0.00 54.58 54.62 1j1n n ASN 215 Cb 0.42 -4.08 0.00 0.00 -1.02 0.00 0.00 39.78 35.11 1j1n n ASN 215 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1j1n n GLY 216 N -1.56 0.70 3.31 7.41 0.00 -1.26 -5.03 105.19 108.75 1j1n n GLY 216 Ca -0.30 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.39 1j1n n GLY 216 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1j1n s ARG 217 N -0.05 3.30 0.04 1.61 1.81 -0.91 -4.97 118.95 119.78 1j1n s ARG 217 Ca 0.00 -0.71 -0.30 0.00 -1.72 0.00 0.00 55.73 53.00 1j1n s ARG 217 Cb 0.00 -2.68 -0.05 0.00 -0.45 0.00 0.00 34.95 31.77 1j1n s ARG 217 CO 0.00 0.05 1.11 0.08 -0.68 0.00 0.00 175.30 175.86 1j1n s VAL 218 N 0.76 4.36 0.06 3.52 1.01 -1.26 -1.17 120.40 127.67 1j1n s VAL 218 Ca -0.05 1.70 -0.00 0.00 0.00 0.00 0.00 61.98 63.62 1j1n s VAL 218 Cb -0.15 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.10 1j1n s VAL 218 CO 0.01 0.13 -0.04 -0.54 0.00 0.00 0.00 175.10 174.66 1j1n s LYS 219 N 1.05 0.65 -0.18 2.72 1.02 -0.33 -4.97 119.74 119.70 1j1n s LYS 219 Ca 0.56 -1.22 -0.02 0.00 0.02 0.00 0.00 55.97 55.31 1j1n s LYS 219 Cb -0.26 0.11 -0.01 0.00 -0.52 0.00 0.00 37.83 37.15 1j1n s LYS 219 CO 0.29 -0.09 -0.09 -1.58 -0.92 0.00 0.00 175.35 172.96 1j1n s HIS 220 N -3.74 2.88 0.32 3.18 5.65 -1.26 -1.53 115.29 120.80 1j1n s HIS 220 Ca 0.07 -0.90 0.09 0.00 0.25 0.00 0.00 55.06 54.57 1j1n s HIS 220 Cb 0.07 -1.98 0.83 0.00 -1.18 0.00 0.00 32.58 30.31 1j1n s HIS 220 CO -0.08 -0.44 1.77 -1.35 -0.65 0.00 0.00 174.74 173.99 1j1n h PRO 221 N 7.53 0.65 0.00 2.88 0.11 -1.87 -1.57 132.00 139.72 1j1n h PRO 221 Ca -0.36 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.71 1j1n h PRO 221 Cb 1.18 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 32.14 1j1n h PRO 221 CO 0.59 0.43 0.00 0.91 -0.21 0.00 0.00 178.00 179.72 1j1n n TRP 222 N -4.77 0.00 1.01 0.65 7.02 -1.26 -2.79 117.44 117.30 1j1n n TRP 222 Ca 0.24 0.00 0.11 0.00 -1.02 0.00 0.00 57.50 56.83 1j1n n TRP 222 Cb 0.65 -0.32 -0.04 0.00 -2.42 0.00 0.00 31.31 29.17 1j1n n TRP 222 CO 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 177.69 175.67 1j1n n ALA 223 N -1.32 4.33 -2.21 6.99 0.00 -0.59 -4.91 120.51 122.80 1j1n n ALA 223 Ca 0.09 -0.58 -0.33 0.00 0.00 0.00 0.00 53.44 52.62 1j1n n ALA 223 Cb 0.18 -0.82 -0.06 0.00 0.00 0.00 0.00 19.45 18.75 1j1n n ALA 223 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1j1n s GLU 224 N -2.87 4.00 0.53 0.00 0.41 -1.12 -4.98 118.70 114.67 1j1n s GLU 224 Ca 0.11 0.61 0.17 0.00 -0.41 0.00 0.00 54.97 55.45 1j1n s GLU 224 Cb 0.17 -2.59 1.32 0.00 -1.78 0.00 0.00 34.13 31.25 1j1n s GLU 224 CO 0.78 0.25 2.16 1.79 -0.49 0.00 0.00 175.26 179.75 1j1n h THR 225 N 2.16 0.96 -0.46 3.63 1.35 -1.94 -0.49 112.91 118.12 1j1n h THR 225 Ca -0.48 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.39 1j1n h THR 225 Cb 1.18 1.00 -0.02 0.00 -1.73 0.00 0.00 68.15 68.57 1j1n h THR 225 CO 0.66 0.00 0.31 0.00 -0.25 0.00 0.00 175.52 176.24 1j1n h ALA 226 N 1.99 1.69 -0.44 6.62 0.00 -1.93 -1.43 119.26 125.76 1j1n h ALA 226 Ca 0.00 -0.03 -0.15 0.00 0.00 0.00 0.00 54.91 54.74 1j1n h ALA 226 Cb 0.02 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1j1n h ALA 226 CO -0.00 0.28 -0.30 0.35 0.00 0.00 0.00 179.25 179.58 1j1n h PHE 227 N 0.61 1.15 -0.03 0.00 3.04 -1.32 -0.64 116.94 119.75 1j1n h PHE 227 Ca 0.17 -0.31 0.02 0.00 3.98 0.00 0.00 57.97 61.83 1j1n h PHE 227 Cb -0.04 -0.25 -0.02 0.00 2.56 0.00 0.00 35.95 38.19 1j1n h PHE 227 CO -0.00 1.14 -0.09 -0.09 -2.02 0.00 0.00 178.31 177.26 1j1n h ARG 228 N 0.82 -0.13 -0.67 1.11 2.43 -1.18 0.78 114.38 117.55 1j1n h ARG 228 Ca 0.09 0.01 -0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1j1n h ARG 228 Cb 0.89 0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 30.44 1j1n h ARG 228 CO 0.08 -0.09 0.11 -0.44 -1.51 0.00 0.00 179.97 178.12 1j1n h ASP 229 N -0.13 1.06 -0.64 -3.80 3.32 -1.26 -2.73 116.42 112.23 1j1n h ASP 229 Ca 0.05 -0.25 -0.07 0.00 0.02 0.00 0.00 57.03 56.77 1j1n h ASP 229 Cb 0.20 -0.28 -0.03 0.00 0.22 0.00 0.00 39.33 39.44 1j1n h ASP 229 CO -0.11 1.05 0.12 1.23 -1.72 0.00 0.00 179.24 179.81 1j1n h GLY 230 N 1.05 1.14 2.00 2.75 0.00 -0.82 -2.78 103.07 106.41 1j1n h GLY 230 Ca 0.20 -0.74 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 1j1n h GLY 230 CO 0.01 0.68 -0.19 -0.33 0.00 0.00 0.00 176.54 176.72 1j1n h MET 231 N 1.00 0.00 -0.64 4.80 2.86 -0.60 -1.76 114.93 120.59 1j1n h MET 231 Ca 0.20 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.78 1j1n h MET 231 Cb 0.41 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.04 1j1n h MET 231 CO 0.01 0.19 0.14 0.87 1.06 0.00 0.00 176.91 179.17 1j1n h LYS 232 N 0.00 1.03 -0.30 1.72 1.57 -1.20 -0.01 116.57 119.38 1j1n h LYS 232 Ca -0.00 -0.24 -0.08 0.00 -1.87 0.00 0.00 60.65 58.45 1j1n h LYS 232 Cb 0.40 -0.14 -0.01 0.00 0.08 0.00 0.00 32.23 32.56 1j1n h LYS 232 CO 0.02 0.92 -0.14 0.45 -0.57 0.00 0.00 179.45 180.13 1j1n h HIS 233 N 0.97 0.72 -0.84 -1.35 3.86 -1.35 -1.89 115.15 115.27 1j1n h HIS 233 Ca 0.20 -0.18 -0.03 0.00 -1.16 0.00 0.00 60.37 59.21 1j1n h HIS 233 Cb 0.37 -0.17 -0.04 0.00 1.06 0.00 0.00 27.41 28.64 1j1n h HIS 233 CO 0.03 0.85 0.41 0.28 0.86 0.00 0.00 177.93 180.36 1j1n h VAL 234 N 0.37 1.26 -0.83 2.45 2.07 -1.16 -0.83 116.25 119.58 1j1n h VAL 234 Ca 0.07 -0.71 -0.02 0.00 0.82 0.00 0.00 66.70 66.85 1j1n h VAL 234 Cb 0.66 0.18 -0.04 0.00 -1.52 0.00 0.00 31.29 30.58 1j1n h VAL 234 CO 0.04 0.31 0.44 0.00 0.02 0.00 0.00 177.57 178.38 1j1n h ALA 235 N 1.22 1.07 -0.59 1.67 0.00 -0.90 -1.24 119.26 120.49 1j1n h ALA 235 Ca 0.29 -0.14 -0.05 0.00 0.00 0.00 0.00 54.91 55.01 1j1n h ALA 235 Cb 0.11 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 17.54 1j1n h ALA 235 CO -0.04 0.60 0.15 0.37 0.00 0.00 0.00 179.25 180.33 1j1n h GLN 236 N 1.17 0.93 -0.71 0.00 5.75 -0.70 -0.89 115.11 120.66 1j1n h GLN 236 Ca 0.29 -0.22 -0.03 0.00 -0.15 0.00 0.00 58.65 58.55 1j1n h GLN 236 Cb 0.06 -0.13 -0.03 0.00 1.07 0.00 0.00 27.48 28.45 1j1n h GLN 236 CO -0.04 0.85 0.33 -1.49 -2.65 0.00 0.00 178.83 175.83 1j1n h TRP 237 N 0.84 1.00 -0.43 3.99 4.06 -0.72 -0.96 115.95 123.74 1j1n h TRP 237 Ca 0.19 -0.04 -0.13 0.00 2.06 0.00 0.00 58.89 60.96 1j1n h TRP 237 Cb 0.33 -0.31 -0.01 0.00 -1.00 0.00 0.00 29.16 28.17 1j1n h TRP 237 CO 0.02 0.73 -0.24 -0.92 -3.56 0.00 0.00 178.44 174.48 1j1n h TYR 238 N 1.00 1.06 -0.67 0.49 5.03 -0.88 -0.50 116.97 122.50 1j1n h TYR 238 Ca 0.24 -0.27 -0.01 0.00 2.58 0.00 0.00 58.73 61.27 1j1n h TYR 238 Cb 0.11 -0.24 -0.03 0.00 1.55 0.00 0.00 36.73 38.12 1j1n h TYR 238 CO 0.01 1.08 0.36 -0.22 -1.32 0.00 0.00 178.16 178.06 1j1n h LYS 239 N 0.74 0.92 -0.01 1.82 3.64 -0.66 -1.36 116.57 121.66 1j1n h LYS 239 Ca 0.09 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.37 1j1n h LYS 239 Cb 0.81 -0.18 0.00 0.00 -0.41 0.00 0.00 32.23 32.45 1j1n h LYS 239 CO 0.07 0.69 0.00 0.39 -2.27 0.00 0.00 179.45 178.32 1j1n n GLU 240 N -4.37 1.14 -1.06 1.90 1.02 -0.41 -4.91 120.64 113.95 1j1n n GLU 240 Ca 0.06 -0.20 -0.02 0.00 -0.02 0.00 0.00 57.16 56.98 1j1n n GLU 240 Cb 0.10 -1.47 -0.01 0.00 -0.02 0.00 0.00 31.44 30.05 1j1n n GLU 240 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1j1n n GLY 241 N 1.01 0.56 0.15 0.62 0.00 -0.51 -4.90 105.19 102.12 1j1n n GLY 241 Ca 0.22 -0.46 0.13 0.00 0.00 0.00 0.00 46.02 45.91 1j1n n GLY 241 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1j1n h LEU 242 N 0.00 0.00 -8.71 0.99 3.38 -1.32 -3.41 115.31 106.24 1j1n h LEU 242 Ca -0.05 0.00 -0.68 0.00 0.09 0.00 0.00 57.88 57.25 1j1n h LEU 242 Cb 0.24 0.00 -0.26 0.00 0.09 0.00 0.00 40.66 40.73 1j1n h LEU 242 CO 0.07 0.00 -0.79 -0.63 0.09 0.00 0.00 178.44 177.18 1j1n s ILE 243 N -3.21 2.89 -0.40 1.22 1.01 -1.23 -0.84 121.20 120.63 1j1n s ILE 243 Ca 0.08 -0.75 -0.44 0.00 0.00 0.00 0.00 60.65 59.54 1j1n s ILE 243 Cb 0.10 -2.16 -0.18 0.00 0.01 0.00 0.00 42.46 40.23 1j1n s ILE 243 CO 0.57 0.56 1.66 -0.67 0.00 0.00 0.00 174.94 177.06 1j1n n ASP 244 N 2.96 1.72 -0.02 3.58 4.64 -0.65 -4.81 116.55 123.98 1j1n n ASP 244 Ca -0.18 1.14 0.15 0.00 -1.38 0.00 0.00 54.79 54.53 1j1n n ASP 244 Cb 0.52 -0.99 0.59 0.00 -1.04 0.00 0.00 41.12 40.20 1j1n n ASP 244 CO 0.00 0.00 0.00 0.50 -0.82 0.00 0.00 177.20 176.88 1j1n h LYS 245 N 5.97 0.19 -0.74 -0.67 3.64 -1.92 -1.01 116.57 122.03 1j1n h LYS 245 Ca -0.45 -0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 58.73 1j1n h LYS 245 Cb 1.35 -0.04 -0.11 0.00 -0.41 0.00 0.00 32.23 33.01 1j1n h LYS 245 CO 0.97 0.13 0.24 0.39 -2.27 0.00 0.00 179.45 178.91 1j1n n GLU 246 N -4.44 3.90 -0.24 1.90 1.02 -1.26 -4.64 120.64 116.89 1j1n n GLU 246 Ca 0.09 -3.08 0.22 0.00 -0.02 0.00 0.00 57.16 54.37 1j1n n GLU 246 Cb 0.46 -2.23 0.57 0.00 -0.02 0.00 0.00 31.44 30.21 1j1n n GLU 246 CO 0.00 0.00 0.00 0.97 1.18 0.00 0.00 177.13 179.28 1j1n h ILE 247 N 2.86 0.62 0.00 -3.67 6.09 -1.54 0.72 117.51 122.60 1j1n h ILE 247 Ca 0.24 -0.10 0.00 0.00 -1.37 0.00 0.00 64.86 63.62 1j1n h ILE 247 Cb 2.31 0.30 0.00 0.00 0.47 0.00 0.00 36.82 39.90 1j1n h ILE 247 CO 0.72 0.05 -0.17 0.49 -3.07 0.00 0.00 178.15 176.18 1j1n n PHE 248 N -4.46 0.58 0.00 2.19 3.01 -1.26 -4.22 117.46 113.30 1j1n n PHE 248 Ca 0.20 0.17 0.00 0.00 1.01 0.00 0.00 57.45 58.83 1j1n n PHE 248 Cb 0.79 -0.74 0.00 0.00 -0.01 0.00 0.00 39.48 39.53 1j1n n PHE 248 CO 0.00 0.00 0.00 0.25 1.01 0.00 0.00 176.76 178.02 1j1n n THR 249 N -2.01 0.00 0.37 4.37 -2.24 -0.42 -4.82 114.28 109.54 1j1n n THR 249 Ca 0.05 -0.09 -0.17 0.00 -2.27 0.00 0.00 64.05 61.57 1j1n n THR 249 Cb 0.41 0.56 -0.08 0.00 -2.10 0.00 0.00 70.33 69.11 1j1n n THR 249 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 1j1n h ARG 250 N 0.00 -0.90 0.00 -0.78 2.43 -1.10 -3.47 114.38 110.56 1j1n h ARG 250 Ca 0.00 0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.23 1j1n h ARG 250 Cb 0.00 0.20 0.00 0.00 -0.42 0.00 0.00 29.97 29.75 1j1n h ARG 250 CO 0.00 -0.57 0.00 1.63 -1.51 0.00 0.00 179.97 179.52 1j1n n LYS 251 N -5.44 0.00 -0.13 0.20 5.02 -1.26 -4.44 118.16 112.10 1j1n n LYS 251 Ca -0.13 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.14 1j1n n LYS 251 Cb 0.39 0.00 -0.00 0.00 -0.02 0.00 0.00 35.03 35.39 1j1n n LYS 251 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j1n n ALA 252 N 9.89 -0.10 -1.26 7.82 0.00 -1.24 -0.83 120.51 134.78 1j1n n ALA 252 Ca 0.00 0.31 -0.22 0.00 0.00 0.00 0.00 53.44 53.53 1j1n n ALA 252 Cb 0.00 -0.11 0.18 0.00 0.00 0.00 0.00 19.45 19.52 1j1n n ALA 252 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 1j1n n LYS 253 N -4.46 2.21 -0.26 0.00 5.02 -1.26 -4.62 118.16 114.80 1j1n n LYS 253 Ca 0.02 -3.04 0.05 0.00 -2.02 0.00 0.00 58.31 53.32 1j1n n LYS 253 Cb 0.11 -2.14 0.29 0.00 -0.02 0.00 0.00 35.03 33.27 1j1n n LYS 253 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1j1n h ALA 254 N 1.02 1.59 -0.11 7.82 0.00 -1.25 -0.41 119.26 127.93 1j1n h ALA 254 Ca 0.59 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 55.44 1j1n h ALA 254 Cb 2.68 -0.24 -0.00 0.00 0.00 0.00 0.00 17.79 20.24 1j1n h ALA 254 CO 1.03 0.27 -0.06 0.00 0.00 0.00 0.00 179.25 180.49 1j1n h ARG 255 N 0.91 0.23 -0.73 0.00 3.08 -1.83 0.19 114.38 116.23 1j1n h ARG 255 Ca 0.36 -0.11 0.03 0.00 0.07 0.00 0.00 59.98 60.34 1j1n h ARG 255 Cb 0.24 -0.00 -0.05 0.00 0.08 0.00 0.00 29.97 30.24 1j1n h ARG 255 CO -0.13 0.60 0.46 0.93 -1.07 0.00 0.00 179.97 180.75 1j1n h GLU 256 N -0.14 0.87 0.25 0.04 3.07 -1.81 0.62 114.58 117.48 1j1n h GLU 256 Ca 0.02 -0.05 -0.01 0.00 -0.50 0.00 0.00 59.36 58.82 1j1n h GLU 256 Cb 0.53 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.25 1j1n h GLU 256 CO 0.02 0.58 -0.12 1.96 -1.40 0.00 0.00 179.01 180.05 1j1n h GLN 257 N 0.90 -0.32 0.05 2.33 4.20 -1.03 -2.01 115.11 119.23 1j1n h GLN 257 Ca 0.29 0.02 -0.25 0.00 0.06 0.00 0.00 58.65 58.77 1j1n h GLN 257 Cb 0.02 0.07 0.01 0.00 0.30 0.00 0.00 27.48 27.88 1j1n h GLN 257 CO -0.11 0.04 -1.06 0.52 -0.67 0.00 0.00 178.83 177.55 1j1n h MET 258 N -0.90 0.43 0.25 1.46 2.86 -0.62 -1.22 114.93 117.20 1j1n h MET 258 Ca -0.03 -0.53 -0.34 0.00 -2.06 0.00 0.00 59.70 56.73 1j1n h MET 258 Cb 0.50 0.17 0.04 0.00 0.06 0.00 0.00 31.60 32.37 1j1n h MET 258 CO 0.06 1.19 -1.50 0.74 1.06 0.00 0.00 176.91 178.45 1j1n h PHE 259 N 0.21 0.98 -0.07 -0.22 0.05 -1.02 0.11 116.94 116.98 1j1n h PHE 259 Ca -0.11 -0.71 -0.03 0.00 3.82 0.00 0.00 57.97 60.93 1j1n h PHE 259 Cb 1.73 -0.04 -0.01 0.00 2.00 0.00 0.00 35.95 39.63 1j1n h PHE 259 CO 0.07 1.57 -0.11 0.78 -0.18 0.00 0.00 178.31 180.45 1j1n h GLY 260 N 0.20 0.11 -1.64 -1.45 0.00 -1.27 -1.41 103.07 97.61 1j1n h GLY 260 Ca -0.26 -0.06 0.00 0.00 0.00 0.00 0.00 47.33 47.01 1j1n h GLY 260 CO 0.27 0.06 0.00 0.61 0.00 0.00 0.00 176.54 177.48 1j1n n GLY 261 N -1.10 1.10 3.76 4.60 0.00 -0.46 -4.82 105.19 108.28 1j1n n GLY 261 Ca -0.02 -0.51 -0.25 0.00 0.00 0.00 0.00 46.02 45.24 1j1n n GLY 261 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1j1n n ASN 262 N 0.84 -3.50 -0.05 1.61 5.15 -0.53 -4.91 115.26 113.87 1j1n n ASN 262 Ca 0.16 -0.75 -0.06 0.00 -0.60 0.00 0.00 54.58 53.33 1j1n n ASN 262 Cb 0.40 -4.18 -0.05 0.00 -0.53 0.00 0.00 39.78 35.42 1j1n n ASN 262 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1j1n n LEU 263 N -4.54 1.90 -4.77 1.20 4.77 0.27 -4.80 117.00 111.02 1j1n n LEU 263 Ca -0.11 -0.04 -0.39 0.00 -0.03 0.00 0.00 56.01 55.45 1j1n n LEU 263 Cb 0.60 -0.16 -0.06 0.00 -2.33 0.00 0.00 43.42 41.47 1j1n n LEU 263 CO 0.71 0.50 0.54 -0.83 -1.33 0.00 0.00 177.39 176.98 1j1n s GLY 264 N -4.63 2.94 0.00 -0.72 0.00 -0.54 -0.21 107.32 104.16 1j1n s GLY 264 Ca -0.10 0.44 0.00 0.00 0.00 0.00 0.00 44.72 45.05 1j1n s GLY 264 CO 0.27 0.94 0.11 0.61 0.00 0.00 0.00 173.10 175.03 1j1n n GLY 265 N 1.37 0.45 3.59 0.20 0.00 -0.75 -4.82 105.19 105.22 1j1n n GLY 265 Ca -0.03 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.84 1j1n n GLY 265 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1j1n s PHE 266 N -0.65 -0.75 0.24 1.61 5.99 0.85 -1.64 117.98 123.64 1j1n s PHE 266 Ca 0.00 1.79 -0.18 0.00 0.00 0.00 0.00 56.93 58.54 1j1n s PHE 266 Cb 0.00 0.27 0.02 0.00 0.00 0.00 0.00 43.02 43.31 1j1n s PHE 266 CO 0.00 -0.38 0.59 -0.08 -0.00 0.00 0.00 175.22 175.35 1j1n s THR 267 N 0.25 0.01 -0.26 0.12 -1.32 -0.72 -1.93 115.64 111.79 1j1n s THR 267 Ca -0.01 -0.97 0.01 0.00 -1.21 0.00 0.00 61.69 59.52 1j1n s THR 267 Cb -0.04 -1.85 0.07 0.00 -1.51 0.00 0.00 72.50 69.17 1j1n s THR 267 CO 0.02 -0.04 -0.02 -2.28 -2.21 0.00 0.00 174.62 170.08 1j1n s HIS 268 N -3.92 2.58 0.37 9.09 2.46 -1.26 -1.50 115.29 123.12 1j1n s HIS 268 Ca 0.13 -1.99 -0.07 0.00 0.47 0.00 0.00 55.06 53.59 1j1n s HIS 268 Cb -0.03 -1.84 0.03 0.00 -0.13 0.00 0.00 32.58 30.61 1j1n s HIS 268 CO 0.03 -0.82 0.62 0.34 -2.47 0.00 0.00 174.74 172.44 1j1n s ASP 269 N 1.33 0.60 0.34 9.88 -1.08 -0.83 -4.86 116.67 122.05 1j1n s ASP 269 Ca -0.01 -1.39 -0.29 0.00 -0.52 0.00 0.00 52.55 50.34 1j1n s ASP 269 Cb -0.19 0.76 -0.10 0.00 -1.46 0.00 0.00 42.92 41.93 1j1n s ASP 269 CO -0.09 -1.50 1.32 0.26 0.52 0.00 0.00 175.17 175.69 1j1n s TRP 270 N -2.60 2.99 0.10 -5.34 0.52 -1.26 -0.86 118.94 112.50 1j1n s TRP 270 Ca 0.24 1.39 -0.25 0.00 0.02 0.00 0.00 56.10 57.50 1j1n s TRP 270 Cb -0.03 -3.71 -0.10 0.00 -1.15 0.00 0.00 33.47 28.48 1j1n s TRP 270 CO 0.17 -1.98 1.67 0.74 0.02 0.00 0.00 176.95 177.58 1j1n h PHE 271 N 3.32 -0.43 0.99 -1.98 0.04 -1.90 -2.04 116.94 114.94 1j1n h PHE 271 Ca -0.49 0.01 -0.05 0.00 2.80 0.00 0.00 57.97 60.24 1j1n h PHE 271 Cb 1.23 0.17 0.01 0.00 2.20 0.00 0.00 35.95 39.56 1j1n h PHE 271 CO 0.55 -0.25 -0.49 0.00 -0.60 0.00 0.00 178.31 177.53 1j1n h ALA 272 N 0.51 -1.36 -0.36 2.45 0.00 -1.92 -2.72 119.26 115.86 1j1n h ALA 272 Ca 0.02 -0.29 -0.12 0.00 0.00 0.00 0.00 54.91 54.52 1j1n h ALA 272 Cb 0.34 0.54 -0.01 0.00 0.00 0.00 0.00 17.79 18.66 1j1n h ALA 272 CO -0.08 -1.27 -0.25 0.66 0.00 0.00 0.00 179.25 178.31 1j1n h SER 273 N -1.35 0.76 -0.32 0.00 4.64 -1.92 -3.14 113.55 112.23 1j1n h SER 273 Ca -0.14 -0.28 -0.05 0.00 -0.47 0.00 0.00 61.79 60.85 1j1n h SER 273 Cb 1.04 -0.21 -0.02 0.00 -0.31 0.00 0.00 62.40 62.90 1j1n h SER 273 CO 0.21 0.98 0.04 0.74 -0.87 0.00 0.00 176.83 177.93 1j1n h THR 274 N 0.64 1.21 0.00 2.95 2.02 -1.41 -2.20 112.91 116.11 1j1n h THR 274 Ca 0.08 -0.81 0.00 0.00 0.77 0.00 0.00 66.41 66.45 1j1n h THR 274 Cb 0.76 0.86 0.00 0.00 -1.74 0.00 0.00 68.15 68.03 1j1n h THR 274 CO 0.06 0.29 0.00 0.23 0.37 0.00 0.00 175.52 176.47 1j1n n MET 275 N -4.27 0.24 0.29 6.66 2.81 -1.02 -3.16 117.12 118.66 1j1n n MET 275 Ca 0.02 0.33 0.17 0.00 -1.81 0.00 0.00 57.70 56.41 1j1n n MET 275 Cb 0.24 -1.85 0.83 0.00 -0.71 0.00 0.00 33.22 31.73 1j1n n MET 275 CO 0.00 0.00 0.00 1.79 1.51 0.00 0.00 175.97 179.27 1j1n h THR 276 N 0.00 0.19 0.00 2.03 1.35 -1.37 -2.84 112.91 112.27 1j1n h THR 276 Ca 0.00 -0.42 0.00 0.00 -0.55 0.00 0.00 66.41 65.44 1j1n h THR 276 Cb 0.55 1.34 0.00 0.00 -1.73 0.00 0.00 68.15 68.31 1j1n h THR 276 CO 0.00 0.05 0.00 -0.26 -0.25 0.00 0.00 175.52 175.06 1j1n h PHE 277 N 0.00 0.00 -0.49 4.73 0.04 -1.69 -0.80 116.94 118.73 1j1n h PHE 277 Ca -0.00 0.00 -0.09 0.00 2.80 0.00 0.00 57.97 60.68 1j1n h PHE 277 Cb 0.34 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.47 1j1n h PHE 277 CO 0.00 0.00 -0.04 -0.91 -0.60 0.00 0.00 178.31 176.76 1j1n h ASN 278 N 0.00 0.88 0.21 2.17 2.35 -1.75 -0.58 115.58 118.86 1j1n h ASN 278 Ca 0.00 -0.32 -0.34 0.00 -0.55 0.00 0.00 56.30 55.09 1j1n h ASN 278 Cb 0.36 -0.24 0.02 0.00 0.05 0.00 0.00 38.32 38.51 1j1n h ASN 278 CO 0.00 1.00 -1.60 -0.08 -1.65 0.00 0.00 177.43 175.10 1j1n h GLU 279 N 0.75 0.44 -0.16 0.81 4.57 -1.72 -3.13 114.58 116.14 1j1n h GLU 279 Ca 0.13 -0.74 -0.01 0.00 -1.18 0.00 0.00 59.36 57.56 1j1n h GLU 279 Cb 0.57 0.28 -0.01 0.00 -0.16 0.00 0.00 28.75 29.42 1j1n h GLU 279 CO 0.03 1.36 0.04 0.78 -1.18 0.00 0.00 179.01 180.04 1j1n h GLY 280 N 0.39 0.23 -1.73 1.92 0.00 -1.11 -2.74 103.07 100.03 1j1n h GLY 280 Ca -0.30 -0.10 0.00 0.00 0.00 0.00 0.00 47.33 46.93 1j1n h GLY 280 CO 0.20 0.10 0.00 1.04 0.00 0.00 0.00 176.54 177.88 1j1n n LEU 281 N -4.45 3.08 -0.34 3.11 4.77 -0.23 -4.64 117.00 118.30 1j1n n LEU 281 Ca -0.01 -1.71 0.15 0.00 -0.03 0.00 0.00 56.01 54.42 1j1n n LEU 281 Cb 0.13 -0.24 0.36 0.00 -2.33 0.00 0.00 43.42 41.33 1j1n n LEU 281 CO 0.35 0.72 1.19 0.00 -1.33 0.00 0.00 177.39 178.33 1j1n h ALA 282 N 3.08 1.77 0.04 -1.18 0.00 -1.42 0.20 119.26 121.75 1j1n h ALA 282 Ca 0.00 0.08 -0.18 0.00 0.00 0.00 0.00 54.91 54.81 1j1n h ALA 282 Cb 0.80 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1j1n h ALA 282 CO 0.00 -0.16 -0.97 -0.22 0.00 0.00 0.00 179.25 177.90 1j1n h LYS 283 N 0.68 0.10 0.00 0.00 3.64 -1.82 -3.35 116.57 115.81 1j1n h LYS 283 Ca 0.59 -0.16 -0.09 0.00 -1.27 0.00 0.00 60.65 59.72 1j1n h LYS 283 Cb 1.03 0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.90 1j1n h LYS 283 CO -0.39 1.08 -0.42 1.79 -2.27 0.00 0.00 179.45 179.25 1j1n h THR 284 N -0.73 0.97 -2.71 1.00 1.35 -1.81 -3.36 112.91 107.60 1j1n h THR 284 Ca -0.23 -1.64 -0.60 0.00 -0.55 0.00 0.00 66.41 63.39 1j1n h THR 284 Cb 1.40 1.98 -0.40 0.00 -1.73 0.00 0.00 68.15 69.40 1j1n h THR 284 CO -0.05 0.41 -0.79 -0.69 -0.25 0.00 0.00 175.52 174.15 1j1n s VAL 285 N -3.59 1.46 -0.11 6.82 1.01 0.69 -5.03 120.40 121.65 1j1n s VAL 285 Ca -0.00 -3.28 -0.38 0.00 0.00 0.00 0.00 61.98 58.32 1j1n s VAL 285 Cb 0.11 -1.98 -0.15 0.00 0.00 0.00 0.00 36.38 34.36 1j1n s VAL 285 CO 0.70 -1.11 1.61 -2.65 0.00 0.00 0.00 175.10 173.65 1j1n n PRO 286 N 2.58 1.33 0.00 2.72 -0.02 -1.26 -1.40 135.00 138.95 1j1n n PRO 286 Ca 0.24 0.48 0.00 0.00 -2.02 0.00 0.00 63.50 62.20 1j1n n PRO 286 Cb 0.41 -2.18 0.00 0.00 -0.02 0.00 0.00 33.50 31.72 1j1n n PRO 286 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1j1n n GLY 287 N 3.60 1.67 3.65 -1.23 0.00 -1.26 -5.01 105.19 106.62 1j1n n GLY 287 Ca 0.23 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.71 1j1n n GLY 287 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 1j1n n PHE 288 N -2.00 1.84 -3.28 1.61 -0.00 -0.49 -4.60 117.46 110.53 1j1n n PHE 288 Ca 0.00 0.54 -0.05 0.00 -0.00 0.00 0.00 57.45 57.94 1j1n n PHE 288 Cb 0.00 -2.42 -0.06 0.00 -0.00 0.00 0.00 39.48 37.01 1j1n n PHE 288 CO 0.00 0.00 0.00 0.21 -0.00 0.00 0.00 176.76 176.97 1j1n s LYS 289 N 2.12 0.42 -0.01 -4.13 2.20 -1.26 -4.81 119.74 114.28 1j1n s LYS 289 Ca 0.91 0.65 -0.11 0.00 -0.36 0.00 0.00 55.97 57.07 1j1n s LYS 289 Cb -0.99 -0.14 -0.05 0.00 -1.51 0.00 0.00 37.83 35.14 1j1n s LYS 289 CO 0.56 -0.67 0.33 -0.51 -0.36 0.00 0.00 175.35 174.70 1j1n s LEU 290 N 2.65 4.41 0.06 5.43 1.43 -1.26 -0.06 118.68 131.34 1j1n s LEU 290 Ca 0.15 0.75 0.05 0.00 -1.03 0.00 0.00 54.13 54.05 1j1n s LEU 290 Cb -0.15 -2.59 -0.03 0.00 0.03 0.00 0.00 46.19 43.46 1j1n s LEU 290 CO -0.18 0.30 -0.14 0.27 0.23 0.00 0.00 176.35 176.82 1j1n s ILE 291 N -1.18 1.14 0.34 -0.59 -4.36 -0.40 -4.87 121.20 111.28 1j1n s ILE 291 Ca 0.25 -1.19 -0.25 0.00 -0.26 0.00 0.00 60.65 59.19 1j1n s ILE 291 Cb -0.14 -1.07 -0.10 0.00 1.25 0.00 0.00 42.46 42.39 1j1n s ILE 291 CO 0.13 -0.12 0.94 -2.16 0.24 0.00 0.00 174.94 173.96 1j1n s PRO 292 N -1.51 4.50 0.03 0.37 0.04 -1.26 -1.79 135.00 135.38 1j1n s PRO 292 Ca -0.00 1.27 0.03 0.00 0.04 0.00 0.00 61.00 62.33 1j1n s PRO 292 Cb -0.09 -2.68 -0.02 0.00 0.04 0.00 0.00 34.50 31.75 1j1n s PRO 292 CO 0.02 0.22 -0.08 0.96 0.04 0.00 0.00 177.00 178.16 1j1n s ILE 293 N -1.73 0.64 0.59 0.56 -4.36 -0.45 -4.94 121.20 111.51 1j1n s ILE 293 Ca 0.52 -0.78 -0.20 0.00 -0.26 0.00 0.00 60.65 59.93 1j1n s ILE 293 Cb -0.17 -0.62 -0.03 0.00 1.25 0.00 0.00 42.46 42.89 1j1n s ILE 293 CO 0.21 -0.12 1.33 0.00 0.24 0.00 0.00 174.94 176.60 1j1n n ALA 294 N 2.06 1.38 -1.68 2.27 0.00 -1.26 -4.20 120.51 119.08 1j1n n ALA 294 Ca -0.18 0.07 -0.46 0.00 0.00 0.00 0.00 53.44 52.87 1j1n n ALA 294 Cb 0.56 -2.34 -0.04 0.00 0.00 0.00 0.00 19.45 17.63 1j1n n ALA 294 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 177.50 175.20 1j1n n PRO 295 N -1.41 2.40 -1.72 0.00 -0.02 -1.26 -4.87 135.00 128.12 1j1n n PRO 295 Ca 0.13 0.87 -0.43 0.00 -2.02 0.00 0.00 63.50 62.06 1j1n n PRO 295 Cb 0.46 -2.72 -0.01 0.00 -0.02 0.00 0.00 33.50 31.20 1j1n n PRO 295 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1j1n n PRO 296 N 5.62 2.37 -1.65 0.52 -0.02 -1.26 -4.62 135.00 135.96 1j1n n PRO 296 Ca 0.20 0.84 -0.48 0.00 -2.02 0.00 0.00 63.50 62.04 1j1n n PRO 296 Cb 0.32 -2.53 -0.05 0.00 -0.02 0.00 0.00 33.50 31.23 1j1n n PRO 296 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1j1n n THR 297 N 1.40 0.03 -1.41 3.45 -1.04 -0.65 -4.53 114.28 111.53 1j1n n THR 297 Ca 0.07 -0.01 -0.30 0.00 -2.04 0.00 0.00 64.05 61.78 1j1n n THR 297 Cb 0.35 -1.35 0.20 0.00 -1.82 0.00 0.00 70.33 67.71 1j1n n THR 297 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1j1n s ASN 298 N 0.98 2.09 0.58 8.00 2.20 0.33 -0.79 114.94 128.34 1j1n s ASN 298 Ca 0.81 0.62 0.39 0.00 -0.94 0.00 0.00 52.86 53.74 1j1n s ASN 298 Cb -0.76 -0.88 2.08 0.00 -2.00 0.00 0.00 41.25 39.69 1j1n s ASN 298 CO 0.41 -3.40 2.19 0.77 -2.94 0.00 0.00 177.10 174.14 1j1n h SER 299 N -2.09 0.00 0.23 3.54 4.64 -1.37 -1.45 113.55 117.05 1j1n h SER 299 Ca -0.46 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.86 1j1n h SER 299 Cb 1.29 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 1j1n h SER 299 CO 0.42 0.00 -0.62 0.29 -0.87 0.00 0.00 176.83 176.04 1j1n n LYS 300 N -2.90 0.28 0.00 4.77 4.76 -1.26 -4.97 118.16 118.84 1j1n n LYS 300 Ca -0.02 -0.20 0.00 0.00 -2.87 0.00 0.00 58.31 55.22 1j1n n LYS 300 Cb 0.08 -1.50 0.00 0.00 -1.84 0.00 0.00 35.03 31.78 1j1n n LYS 300 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1j1n n GLY 301 N 1.46 1.06 3.26 0.72 0.00 -0.55 -5.11 105.19 106.03 1j1n n GLY 301 Ca 0.07 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.82 1j1n n GLY 301 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1j1n s GLN 302 N -0.36 1.51 -0.27 1.61 -0.21 -1.26 -4.85 119.66 115.82 1j1n s GLN 302 Ca 0.00 -0.92 -0.16 0.00 0.02 0.00 0.00 55.36 54.30 1j1n s GLN 302 Cb 0.00 -1.59 -0.03 0.00 1.00 0.00 0.00 33.01 32.39 1j1n s GLN 302 CO 0.00 0.41 0.42 1.03 -2.12 0.00 0.00 175.29 175.03 1j1n s ARG 303 N -1.03 4.01 -0.09 2.91 0.52 -1.26 -0.51 118.95 123.49 1j1n s ARG 303 Ca 0.08 0.10 0.04 0.00 -0.52 0.00 0.00 55.73 55.43 1j1n s ARG 303 Cb -0.09 -3.66 -0.01 0.00 0.52 0.00 0.00 34.95 31.71 1j1n s ARG 303 CO 0.01 -0.32 -0.21 -1.58 0.02 0.00 0.00 175.30 173.22 1j1n s TRP 304 N 2.15 2.60 -0.32 -0.53 0.52 -1.26 -4.82 118.94 117.27 1j1n s TRP 304 Ca 0.17 -0.81 0.02 0.00 0.02 0.00 0.00 56.10 55.50 1j1n s TRP 304 Cb -0.16 -1.71 0.10 0.00 -1.15 0.00 0.00 33.47 30.55 1j1n s TRP 304 CO 0.10 -0.28 0.05 -2.00 0.02 0.00 0.00 176.95 174.85 1j1n s GLU 305 N 0.13 1.26 0.30 4.98 2.56 -0.87 -4.78 118.70 122.28 1j1n s GLU 305 Ca -0.11 -1.53 0.14 0.00 0.00 0.00 0.00 54.97 53.47 1j1n s GLU 305 Cb -0.16 -2.75 0.40 0.00 2.00 0.00 0.00 34.13 33.62 1j1n s GLU 305 CO 0.06 -0.92 1.61 1.49 -0.56 0.00 0.00 175.26 176.94 1j1n h GLU 306 N 7.80 0.00 -6.96 4.30 4.81 -1.92 -0.33 114.58 122.27 1j1n h GLU 306 Ca -0.09 0.00 -0.46 0.00 -0.13 0.00 0.00 59.36 58.68 1j1n h GLU 306 Cb 1.02 0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.39 1j1n h GLU 306 CO 0.49 0.55 0.26 0.34 -0.73 0.00 0.00 179.01 179.92 1j1n s ASP 307 N -6.62 6.83 0.12 1.04 3.68 -1.26 -4.62 116.67 115.83 1j1n s ASP 307 Ca 0.00 1.52 -0.22 0.00 2.13 0.00 0.00 52.55 55.98 1j1n s ASP 307 Cb 0.11 -2.47 0.06 0.00 -1.45 0.00 0.00 42.92 39.17 1j1n s ASP 307 CO 0.74 -0.34 0.55 -0.94 0.13 0.00 0.00 175.17 175.31 1j1n s SER 308 N -2.36 -0.49 0.03 -0.34 1.04 -1.26 -4.58 113.70 105.74 1j1n s SER 308 Ca 0.59 0.01 -0.30 0.00 0.48 0.00 0.00 55.95 56.72 1j1n s SER 308 Cb -0.10 0.56 -0.05 0.00 0.10 0.00 0.00 66.02 66.53 1j1n s SER 308 CO 0.17 -0.89 1.24 -0.60 0.98 0.00 0.00 173.24 174.15 1j1n s ARG 309 N -3.40 4.38 0.47 4.02 6.06 -0.87 -4.39 118.95 125.23 1j1n s ARG 309 Ca -0.00 1.80 -0.21 0.00 -2.50 0.00 0.00 55.73 54.82 1j1n s ARG 309 Cb -0.00 -3.42 -0.09 0.00 0.06 0.00 0.00 34.95 31.50 1j1n s ARG 309 CO -0.10 -0.36 1.04 -0.65 -2.50 0.00 0.00 175.30 172.73 1j1n s GLN 310 N 1.52 3.88 0.30 5.12 -0.21 -1.26 -4.90 119.66 124.10 1j1n s GLN 310 Ca 0.59 1.38 0.11 0.00 0.02 0.00 0.00 55.36 57.46 1j1n s GLN 310 Cb -0.29 -2.18 0.44 0.00 1.00 0.00 0.00 33.01 31.98 1j1n s GLN 310 CO 0.27 -0.37 1.66 0.87 -2.12 0.00 0.00 175.29 175.61 1j1n h LYS 311 N 1.74 0.01 -2.15 2.91 1.57 -1.94 -3.39 116.57 115.31 1j1n h LYS 311 Ca -0.49 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.24 1j1n h LYS 311 Cb 1.22 0.00 -0.22 0.00 0.08 0.00 0.00 32.23 33.31 1j1n h LYS 311 CO 0.60 0.56 0.02 0.54 -0.57 0.00 0.00 179.45 180.60 1j1n s VAL 312 N -3.76 -0.00 0.33 0.50 0.11 -1.26 -4.26 120.40 112.06 1j1n s VAL 312 Ca -0.02 0.01 0.02 0.00 -2.93 0.00 0.00 61.98 59.06 1j1n s VAL 312 Cb 0.13 -0.91 -0.03 0.00 -1.53 0.00 0.00 36.38 34.04 1j1n s VAL 312 CO 0.75 0.00 0.51 -0.13 -3.33 0.00 0.00 175.10 172.91 1j1n s ARG 313 N 0.76 3.45 -0.03 1.54 0.52 -0.86 -4.97 118.95 119.37 1j1n s ARG 313 Ca -0.03 -0.45 -0.01 0.00 -0.52 0.00 0.00 55.73 54.72 1j1n s ARG 313 Cb -0.05 -2.71 -0.03 0.00 0.52 0.00 0.00 34.95 32.68 1j1n s ARG 313 CO -0.05 0.19 2.28 -0.35 0.02 0.00 0.00 175.30 177.38 1j1n n PRO 314 N -1.71 1.23 -4.41 3.54 -0.04 -1.26 -4.41 135.00 127.94 1j1n n PRO 314 Ca -0.05 -0.29 -0.21 0.00 -0.04 0.00 0.00 63.50 62.91 1j1n n PRO 314 Cb 0.56 -1.22 -0.10 0.00 -0.04 0.00 0.00 33.50 32.71 1j1n n PRO 314 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1j1n s ASP 315 N 1.86 2.82 0.00 3.54 1.01 -1.26 -0.80 116.67 123.84 1j1n s ASP 315 Ca 0.14 -1.11 0.00 0.00 0.71 0.00 0.00 52.55 52.29 1j1n s ASP 315 Cb 0.07 -0.18 0.00 0.00 1.01 0.00 0.00 42.92 43.83 1j1n s ASP 315 CO -0.00 -0.23 0.00 0.61 0.21 0.00 0.00 175.17 175.76 1j1n n GLY 316 N -0.52 0.32 3.08 0.21 0.00 -0.80 -1.52 105.19 105.96 1j1n n GLY 316 Ca -0.06 -1.54 -0.08 0.00 0.00 0.00 0.00 46.02 44.34 1j1n n GLY 316 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 173.32 173.98 1j1n s TRP 317 N -3.01 0.36 0.20 1.61 -2.14 -0.85 -1.33 118.94 113.79 1j1n s TRP 317 Ca 0.00 -0.79 0.03 0.00 2.66 0.00 0.00 56.10 58.00 1j1n s TRP 317 Cb 0.00 -0.26 -0.05 0.00 -3.10 0.00 0.00 33.47 30.06 1j1n s TRP 317 CO 0.00 -0.35 -0.01 0.00 -2.66 0.00 0.00 176.95 173.93 1j1n s ALA 318 N -3.09 1.58 -0.25 2.67 0.00 0.11 -1.40 121.76 121.38 1j1n s ALA 318 Ca -0.01 -1.67 -0.09 0.00 0.00 0.00 0.00 51.96 50.19 1j1n s ALA 318 Cb 0.02 0.50 -0.04 0.00 0.00 0.00 0.00 23.12 23.59 1j1n s ALA 318 CO -0.07 -0.27 0.12 0.42 0.00 0.00 0.00 175.76 175.96 1j1n s ILE 319 N -3.53 4.84 0.77 0.00 1.01 -1.26 -1.93 121.20 121.11 1j1n s ILE 319 Ca 0.26 0.01 -0.11 0.00 0.00 0.00 0.00 60.65 60.80 1j1n s ILE 319 Cb 0.06 -3.27 0.05 0.00 0.01 0.00 0.00 42.46 39.31 1j1n s ILE 319 CO 0.06 0.32 1.09 0.42 0.00 0.00 0.00 174.94 176.83 1j1n s THR 320 N 1.44 3.31 -0.35 2.92 -4.23 -0.92 -1.30 115.64 116.51 1j1n s THR 320 Ca 0.06 0.43 0.27 0.00 -1.18 0.00 0.00 61.69 61.26 1j1n s THR 320 Cb -0.15 -3.20 0.29 0.00 1.34 0.00 0.00 72.50 70.79 1j1n s THR 320 CO 0.06 -0.56 1.79 -0.37 -0.54 0.00 0.00 174.62 175.00 1j1n h VAL 321 N -0.97 0.00 -0.00 2.29 -1.51 -1.63 -2.74 116.25 111.70 1j1n h VAL 321 Ca -0.46 -0.36 0.00 0.00 -1.23 0.00 0.00 66.70 64.65 1j1n h VAL 321 Cb 1.25 1.19 0.00 0.00 -2.13 0.00 0.00 31.29 31.61 1j1n h VAL 321 CO 0.59 0.00 -0.26 0.29 -1.23 0.00 0.00 177.57 176.97 1j1n n LYS 322 N -2.50 0.02 -2.07 5.19 4.76 -1.26 -4.80 118.16 117.50 1j1n n LYS 322 Ca 0.02 -0.01 -0.43 0.00 -2.87 0.00 0.00 58.31 55.03 1j1n n LYS 322 Cb 0.28 -1.50 -0.03 0.00 -1.84 0.00 0.00 35.03 31.94 1j1n n LYS 322 CO 0.00 0.00 0.00 1.21 -1.37 0.00 0.00 177.40 177.24 1j1n s ASN 323 N -2.99 6.33 0.00 4.39 3.84 -1.03 -4.87 114.94 120.61 1j1n s ASN 323 Ca 0.13 1.66 0.31 0.00 0.21 0.00 0.00 52.86 55.17 1j1n s ASN 323 Cb 0.18 -2.53 1.69 0.00 -0.55 0.00 0.00 41.25 40.05 1j1n s ASN 323 CO 0.61 -1.29 2.12 0.29 -2.79 0.00 0.00 177.10 176.04 1j1n n LYS 324 N 7.73 0.83 -3.05 0.43 5.02 -1.26 -4.11 118.16 123.76 1j1n n LYS 324 Ca 0.19 -0.07 -0.23 0.00 -2.02 0.00 0.00 58.31 56.18 1j1n n LYS 324 Cb 0.45 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.93 1j1n n LYS 324 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1j1n n ASN 325 N -1.02 2.97 -0.09 4.39 3.02 -1.26 -4.93 115.26 118.33 1j1n n ASN 325 Ca 0.20 -3.40 0.02 0.00 -0.03 0.00 0.00 54.58 51.37 1j1n n ASN 325 Cb 0.18 -0.59 0.33 0.00 -0.61 0.00 0.00 39.78 39.09 1j1n n ASN 325 CO 0.00 0.00 0.00 1.55 -2.62 0.00 0.00 177.26 176.19 1j1n h PRO 326 N 3.01 0.74 0.02 3.52 0.13 -1.97 -1.29 132.00 136.17 1j1n h PRO 326 Ca 0.12 -0.06 -0.00 0.00 -0.87 0.00 0.00 66.00 65.19 1j1n h PRO 326 Cb 0.70 -0.16 0.00 0.00 0.13 0.00 0.00 31.00 31.67 1j1n h PRO 326 CO 0.69 0.52 -0.01 0.28 -0.23 0.00 0.00 178.00 179.24 1j1n h VAL 327 N 0.75 1.24 -0.38 1.56 2.07 -1.96 -1.09 116.25 118.45 1j1n h VAL 327 Ca 0.20 -0.83 -0.03 0.00 0.82 0.00 0.00 66.70 66.85 1j1n h VAL 327 Cb -0.03 1.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1j1n h VAL 327 CO -0.04 0.21 0.09 -0.33 0.02 0.00 0.00 177.57 177.53 1j1n h GLU 328 N -0.39 0.55 -0.39 1.57 3.07 -1.88 -2.31 114.58 114.80 1j1n h GLU 328 Ca -0.00 -0.09 -0.13 0.00 -0.50 0.00 0.00 59.36 58.64 1j1n h GLU 328 Cb 0.37 -0.10 -0.01 0.00 -0.84 0.00 0.00 28.75 28.18 1j1n h GLU 328 CO 0.01 0.51 -0.25 1.15 -1.40 0.00 0.00 179.01 179.02 1j1n h THR 329 N 0.54 1.28 -0.09 1.13 2.02 -1.07 -1.33 112.91 115.39 1j1n h THR 329 Ca 0.13 -1.41 -0.10 0.00 0.77 0.00 0.00 66.41 65.80 1j1n h THR 329 Cb 0.21 1.32 -0.01 0.00 -1.74 0.00 0.00 68.15 67.93 1j1n h THR 329 CO -0.00 0.47 -0.40 -0.29 0.37 0.00 0.00 175.52 175.67 1j1n h ILE 330 N 0.68 1.30 -0.44 3.11 6.09 -0.97 -0.03 117.51 127.24 1j1n h ILE 330 Ca 0.08 -1.47 -0.11 0.00 -1.37 0.00 0.00 64.86 62.00 1j1n h ILE 330 Cb 0.82 1.68 -0.02 0.00 0.47 0.00 0.00 36.82 39.77 1j1n h ILE 330 CO 0.07 0.43 -0.15 0.11 -3.07 0.00 0.00 178.15 175.54 1j1n h LYS 331 N 0.16 0.84 -0.45 2.19 1.57 -1.27 0.45 116.57 120.06 1j1n h LYS 331 Ca 0.02 -0.31 -0.04 0.00 -1.87 0.00 0.00 60.65 58.45 1j1n h LYS 331 Cb 0.78 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.01 1j1n h LYS 331 CO 0.06 0.93 0.12 0.35 -0.57 0.00 0.00 179.45 180.35 1j1n h PHE 332 N 0.74 0.73 -0.82 -1.35 3.04 -0.64 -2.45 116.94 116.20 1j1n h PHE 332 Ca 0.11 -0.08 -0.03 0.00 3.98 0.00 0.00 57.97 61.96 1j1n h PHE 332 Cb 0.66 -0.21 -0.04 0.00 2.56 0.00 0.00 35.95 38.93 1j1n h PHE 332 CO 0.04 0.67 0.40 0.74 -2.02 0.00 0.00 178.31 178.14 1j1n h PHE 333 N 0.59 1.17 -0.30 0.41 0.05 -0.67 -2.57 116.94 115.62 1j1n h PHE 333 Ca 0.14 -0.05 0.00 0.00 3.82 0.00 0.00 57.97 61.88 1j1n h PHE 333 Cb 0.30 -0.37 -0.01 0.00 2.00 0.00 0.00 35.95 37.87 1j1n h PHE 333 CO 0.02 0.84 0.19 0.22 -0.18 0.00 0.00 178.31 179.39 1j1n h ASP 334 N 1.17 0.34 -0.89 2.17 -0.00 -0.47 -2.28 116.42 116.46 1j1n h ASP 334 Ca 0.28 -0.01 0.18 0.00 -0.00 0.00 0.00 57.03 57.48 1j1n h ASP 334 Cb 0.10 -0.09 -0.07 0.00 -0.00 0.00 0.00 39.33 39.28 1j1n h ASP 334 CO -0.04 0.26 0.58 0.15 -0.00 0.00 0.00 179.24 180.19 1j1n h PHE 335 N 0.40 0.66 0.00 0.28 3.57 -1.03 -0.84 116.94 119.98 1j1n h PHE 335 Ca 0.11 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1j1n h PHE 335 Cb -0.03 -0.20 0.00 0.00 2.79 0.00 0.00 35.95 38.50 1j1n h PHE 335 CO 0.00 0.20 0.00 0.66 -2.23 0.00 0.00 178.31 176.94 1j1n n TYR 336 N -4.54 0.00 -0.00 0.41 4.02 -0.86 -1.94 117.16 114.25 1j1n n TYR 336 Ca 0.18 0.00 0.01 0.00 -0.01 0.00 0.00 57.90 58.08 1j1n n TYR 336 Cb 0.60 0.00 0.02 0.00 -0.02 0.00 0.00 39.34 39.93 1j1n n TYR 336 CO 0.00 0.00 0.00 1.19 -1.01 0.00 0.00 176.86 177.04 1j1n n PHE 337 N -0.92 0.05 -4.01 -0.72 3.01 -0.33 -2.62 117.46 111.92 1j1n n PHE 337 Ca 0.16 -0.37 -0.23 0.00 1.01 0.00 0.00 57.45 58.02 1j1n n PHE 337 Cb 0.07 -0.04 -0.03 0.00 -0.01 0.00 0.00 39.48 39.48 1j1n n PHE 337 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1j1n s SER 338 N -0.78 6.04 0.21 4.37 1.04 -0.82 -4.79 113.70 118.98 1j1n s SER 338 Ca 0.03 -0.01 -0.08 0.00 0.48 0.00 0.00 55.95 56.36 1j1n s SER 338 Cb 0.02 -1.71 0.27 0.00 0.10 0.00 0.00 66.02 64.70 1j1n s SER 338 CO 0.02 -0.02 1.79 -0.09 0.98 0.00 0.00 173.24 175.92 1j1n h ARG 339 N 1.59 0.62 -0.96 4.02 9.65 -1.95 0.11 114.38 127.46 1j1n h ARG 339 Ca -0.50 -0.04 0.00 0.00 -1.10 0.00 0.00 59.98 58.35 1j1n h ARG 339 Cb 1.22 -0.14 -0.05 0.00 -1.39 0.00 0.00 29.97 29.61 1j1n h ARG 339 CO 0.63 0.41 0.61 -1.35 2.80 0.00 0.00 179.97 183.06 1j1n h PRO 340 N 0.64 1.29 -0.05 0.20 0.11 -1.96 -1.00 132.00 131.23 1j1n h PRO 340 Ca 0.32 -0.10 -0.21 0.00 0.11 0.00 0.00 66.00 66.12 1j1n h PRO 340 Cb 0.26 -0.28 0.00 0.00 0.11 0.00 0.00 31.00 31.09 1j1n h PRO 340 CO -0.22 0.88 -0.84 0.78 -0.21 0.00 0.00 178.00 178.39 1j1n h GLY 341 N 1.32 0.50 1.90 -0.55 0.00 -1.34 -3.04 103.07 101.86 1j1n h GLY 341 Ca 0.35 -0.79 -0.07 0.00 0.00 0.00 0.00 47.33 46.82 1j1n h GLY 341 CO -0.07 0.70 -0.30 3.21 0.00 0.00 0.00 176.54 180.08 1j1n h ARG 342 N 0.29 0.12 0.38 4.80 3.08 -0.53 -1.91 114.38 120.61 1j1n h ARG 342 Ca -0.06 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.93 1j1n h ARG 342 Cb 1.45 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.49 1j1n h ARG 342 CO 0.15 0.42 -0.18 -0.44 -1.07 0.00 0.00 179.97 178.84 1j1n h ASP 343 N 0.11 -0.43 0.13 7.04 3.32 -1.07 -1.90 116.42 123.62 1j1n h ASP 343 Ca 0.01 -0.01 -0.19 0.00 0.02 0.00 0.00 57.03 56.86 1j1n h ASP 343 Cb 0.60 0.11 -0.00 0.00 0.22 0.00 0.00 39.33 40.26 1j1n h ASP 343 CO 0.04 -0.27 -0.72 0.16 -1.72 0.00 0.00 179.24 176.73 1j1n h ILE 344 N -0.56 1.35 0.00 0.35 3.07 -1.50 0.14 117.51 120.35 1j1n h ILE 344 Ca -0.05 -2.06 0.00 0.00 1.55 0.00 0.00 64.86 64.29 1j1n h ILE 344 Cb 0.42 2.04 0.00 0.00 -0.27 0.00 0.00 36.82 39.01 1j1n h ILE 344 CO 0.09 0.63 0.00 0.77 -1.05 0.00 0.00 178.15 178.59 1j1n h SER 345 N 0.36 0.00 0.00 2.16 4.64 -1.38 -1.38 113.55 117.95 1j1n h SER 345 Ca -0.03 0.00 -0.23 0.00 -0.47 0.00 0.00 61.79 61.06 1j1n h SER 345 Cb 1.31 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 63.35 1j1n h SER 345 CO 0.13 0.00 -1.87 0.59 -0.87 0.00 0.00 176.83 174.81 1j1n n ASN 346 N -2.51 2.09 -0.00 4.97 3.02 -0.71 -1.39 115.26 120.73 1j1n n ASN 346 Ca 0.02 -0.02 0.03 0.00 -0.03 0.00 0.00 54.58 54.58 1j1n n ASN 346 Cb 0.28 0.58 -0.03 0.00 -0.61 0.00 0.00 39.78 40.00 1j1n n ASN 346 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1j1n n PHE 347 N -2.58 0.00 0.00 3.10 3.01 0.47 -4.74 117.46 116.72 1j1n n PHE 347 Ca -0.22 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.24 1j1n n PHE 347 Cb 0.89 -0.03 0.00 0.00 -0.01 0.00 0.00 39.48 40.32 1j1n n PHE 347 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 1j1n n GLY 348 N 1.40 0.66 3.11 1.37 0.00 -0.52 -4.45 105.19 106.74 1j1n n GLY 348 Ca 0.00 -1.33 -0.26 0.00 0.00 0.00 0.00 46.02 44.43 1j1n n GLY 348 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1j1n s VAL 349 N 0.00 1.41 0.33 1.61 1.01 -1.26 -4.32 120.40 119.18 1j1n s VAL 349 Ca 0.00 -0.67 -0.29 0.00 0.00 0.00 0.00 61.98 61.02 1j1n s VAL 349 Cb 0.00 -1.23 -0.11 0.00 0.00 0.00 0.00 36.38 35.04 1j1n s VAL 349 CO 0.00 0.41 1.49 -2.16 0.00 0.00 0.00 175.10 174.84 1j1n s PRO 350 N 0.28 4.16 0.00 2.72 0.04 -1.26 -1.18 135.00 139.76 1j1n s PRO 350 Ca -0.09 2.50 0.00 0.00 0.04 0.00 0.00 61.00 63.45 1j1n s PRO 350 Cb -0.14 -3.01 0.00 0.00 0.04 0.00 0.00 34.50 31.39 1j1n s PRO 350 CO 0.04 -0.51 0.00 0.41 0.04 0.00 0.00 177.00 176.97 1j1n n GLY 351 N 1.23 2.08 0.92 0.56 0.00 0.50 -4.77 105.19 105.71 1j1n n GLY 351 Ca 0.04 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.04 1j1n n GLY 351 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1j1n n VAL 352 N -2.00 0.82 -0.01 1.61 0.31 -0.64 -4.91 118.33 113.52 1j1n n VAL 352 Ca 0.00 0.20 0.02 0.00 -0.01 0.00 0.00 64.34 64.55 1j1n n VAL 352 Cb 0.00 -1.63 -0.06 0.00 -0.91 0.00 0.00 33.84 31.24 1j1n n VAL 352 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1j1n n THR 353 N -3.42 0.13 -3.99 2.52 -2.24 -0.33 -4.93 114.28 102.02 1j1n n THR 353 Ca -0.04 -0.21 -0.09 0.00 -2.27 0.00 0.00 64.05 61.44 1j1n n THR 353 Cb 0.26 0.03 -0.06 0.00 -2.10 0.00 0.00 70.33 68.47 1j1n n THR 353 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 1j1n s TYR 354 N -2.45 0.38 0.02 4.78 1.13 -1.18 -1.34 117.35 118.69 1j1n s TYR 354 Ca -0.03 -0.73 -0.02 0.00 -1.41 0.00 0.00 57.07 54.88 1j1n s TYR 354 Cb 0.04 0.13 -0.02 0.00 -1.10 0.00 0.00 41.96 41.01 1j1n s TYR 354 CO 0.32 -0.93 0.00 -0.51 -2.51 0.00 0.00 175.55 171.92 1j1n s ASP 355 N -3.01 0.23 -0.27 -0.18 1.01 -0.52 -0.37 116.67 113.56 1j1n s ASP 355 Ca 0.22 -0.51 -0.23 0.00 0.71 0.00 0.00 52.55 52.74 1j1n s ASP 355 Cb 0.00 0.13 -0.00 0.00 1.01 0.00 0.00 42.92 44.06 1j1n s ASP 355 CO 0.07 -0.35 0.79 -0.63 0.21 0.00 0.00 175.17 175.25 1j1n s ILE 356 N -1.77 4.83 -0.03 0.77 -1.09 -1.26 -0.97 121.20 121.68 1j1n s ILE 356 Ca -0.13 1.34 0.03 0.00 -2.23 0.00 0.00 60.65 59.65 1j1n s ILE 356 Cb -0.07 -4.11 0.01 0.00 -1.58 0.00 0.00 42.46 36.71 1j1n s ILE 356 CO -0.02 -0.14 -0.10 -0.54 -1.23 0.00 0.00 174.94 172.91 1j1n s LYS 357 N 2.86 1.15 -1.74 2.79 1.02 -0.19 -4.73 119.74 120.90 1j1n s LYS 357 Ca 0.33 -0.34 0.00 0.00 0.02 0.00 0.00 55.97 55.98 1j1n s LYS 357 Cb -0.15 -1.04 0.00 0.00 -0.52 0.00 0.00 37.83 36.12 1j1n s LYS 357 CO 0.10 0.10 0.00 0.09 -0.92 0.00 0.00 175.35 174.72 1j1n n ASN 358 N 3.41 -5.29 0.00 2.83 5.03 -1.26 -1.55 115.26 118.43 1j1n n ASN 358 Ca -0.20 0.17 0.00 0.00 0.87 0.00 0.00 54.58 55.43 1j1n n ASN 358 Cb 0.53 -4.51 0.00 0.00 -1.02 0.00 0.00 39.78 34.78 1j1n n ASN 358 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 1j1n n GLY 359 N -0.77 0.90 3.22 7.41 0.00 -1.26 -5.03 105.19 109.66 1j1n n GLY 359 Ca -0.21 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.66 1j1n n GLY 359 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1j1n s LYS 360 N -0.15 0.96 0.11 1.61 1.02 -0.59 -5.08 119.74 117.61 1j1n s LYS 360 Ca 0.00 -1.29 -0.31 0.00 0.02 0.00 0.00 55.97 54.38 1j1n s LYS 360 Cb 0.00 -0.62 -0.08 0.00 -0.52 0.00 0.00 37.83 36.61 1j1n s LYS 360 CO 0.00 0.09 1.49 0.00 -0.92 0.00 0.00 175.35 176.01 1j1n s ALA 361 N -2.79 3.66 -0.10 5.17 0.00 -1.26 -1.02 121.76 125.42 1j1n s ALA 361 Ca 0.11 1.17 0.00 0.00 0.00 0.00 0.00 51.96 53.24 1j1n s ALA 361 Cb -0.01 -3.60 0.02 0.00 0.00 0.00 0.00 23.12 19.54 1j1n s ALA 361 CO 0.01 -0.78 -0.09 0.08 0.00 0.00 0.00 175.76 174.97 1j1n s VAL 362 N 1.55 1.09 0.46 0.00 1.01 -0.14 -4.93 120.40 119.44 1j1n s VAL 362 Ca 0.68 -0.36 -0.24 0.00 0.00 0.00 0.00 61.98 62.05 1j1n s VAL 362 Cb -0.38 -1.07 -0.07 0.00 0.00 0.00 0.00 36.38 34.85 1j1n s VAL 362 CO 0.30 0.37 1.34 -0.36 0.00 0.00 0.00 175.10 176.75 1j1n s PHE 363 N 1.42 2.58 0.65 5.22 2.99 -1.26 -1.43 117.98 128.15 1j1n s PHE 363 Ca -0.00 1.37 -0.14 0.00 0.00 0.00 0.00 56.93 58.16 1j1n s PHE 363 Cb -0.13 -3.75 -0.01 0.00 0.00 0.00 0.00 43.02 39.13 1j1n s PHE 363 CO -0.05 -2.49 1.08 0.15 -0.00 0.00 0.00 175.22 173.91 1j1n s LYS 364 N -2.52 2.95 0.35 0.44 1.02 -0.45 -4.88 119.74 116.65 1j1n s LYS 364 Ca 0.62 1.24 0.05 0.00 0.02 0.00 0.00 55.97 57.90 1j1n s LYS 364 Cb -0.39 -1.98 0.69 0.00 -0.52 0.00 0.00 37.83 35.62 1j1n s LYS 364 CO 0.49 -1.11 1.95 -0.44 -0.92 0.00 0.00 175.35 175.32 1j1n h ASP 365 N -0.04 0.73 -0.95 2.83 3.32 -1.94 -1.99 116.42 118.38 1j1n h ASP 365 Ca -0.46 0.00 0.05 0.00 0.02 0.00 0.00 57.03 56.64 1j1n h ASP 365 Cb 1.23 -0.15 -0.06 0.00 0.22 0.00 0.00 39.33 40.57 1j1n h ASP 365 CO 0.55 0.47 0.62 0.77 -1.72 0.00 0.00 179.24 179.93 1j1n h SER 366 N 0.82 1.01 -0.32 6.45 4.64 -1.96 0.15 113.55 124.34 1j1n h SER 366 Ca 0.33 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.53 1j1n h SER 366 Cb 0.24 -0.22 -0.01 0.00 -0.31 0.00 0.00 62.40 62.11 1j1n h SER 366 CO -0.11 0.67 -0.28 0.58 -0.87 0.00 0.00 176.83 176.81 1j1n h VAL 367 N 1.16 1.29 0.00 0.95 2.07 -1.70 -2.67 116.25 117.36 1j1n h VAL 367 Ca 0.39 -1.45 -0.09 0.00 0.82 0.00 0.00 66.70 66.38 1j1n h VAL 367 Cb 0.08 1.49 -0.01 0.00 -1.52 0.00 0.00 31.29 31.33 1j1n h VAL 367 CO -0.14 0.47 -0.43 -0.07 0.02 0.00 0.00 177.57 177.41 1j1n h LEU 368 N 0.53 0.00 0.00 2.57 3.38 -1.02 -3.15 115.31 117.62 1j1n h LEU 368 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.03 1j1n h LEU 368 Cb 0.86 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.61 1j1n h LEU 368 CO 0.07 0.43 -0.65 0.11 0.09 0.00 0.00 178.44 178.50 1j1n h LYS 369 N 0.00 0.00 -6.93 1.13 1.57 -0.71 -3.47 116.57 108.16 1j1n h LYS 369 Ca -0.00 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.22 1j1n h LYS 369 Cb 0.93 0.00 0.13 0.00 0.08 0.00 0.00 32.23 33.37 1j1n h LYS 369 CO 0.06 0.00 0.61 0.45 -0.57 0.00 0.00 179.45 180.00 1j1n n SER 370 N -2.19 2.96 0.09 0.86 2.88 -1.01 -4.89 113.62 112.32 1j1n n SER 370 Ca 0.03 1.10 0.12 0.00 -1.33 0.00 0.00 58.87 58.79 1j1n n SER 370 Cb 0.45 -1.56 0.45 0.00 -0.75 0.00 0.00 64.21 62.80 1j1n n SER 370 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1j1n n PRO 371 N -0.18 0.17 -3.16 -1.46 -0.04 -1.26 -4.73 135.00 124.34 1j1n n PRO 371 Ca 0.06 0.30 -0.39 0.00 -0.04 0.00 0.00 63.50 63.43 1j1n n PRO 371 Cb 0.41 -1.77 -0.06 0.00 -0.04 0.00 0.00 33.50 32.05 1j1n n PRO 371 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1j1n s GLN 372 N -3.18 4.34 0.39 0.54 0.74 -1.26 -4.69 119.66 116.54 1j1n s GLN 372 Ca 0.07 0.82 -0.26 0.00 0.05 0.00 0.00 55.36 56.05 1j1n s GLN 372 Cb 0.11 -3.32 -0.11 0.00 1.10 0.00 0.00 33.01 30.79 1j1n s GLN 372 CO 0.45 0.42 1.18 -2.30 -0.55 0.00 0.00 175.29 174.48 1j1n n PRO 373 N 2.48 1.76 -0.34 1.67 -0.02 -1.26 -4.77 135.00 134.51 1j1n n PRO 373 Ca -0.07 0.62 0.03 0.00 -2.02 0.00 0.00 63.50 62.07 1j1n n PRO 373 Cb 0.51 -2.23 0.18 0.00 -0.02 0.00 0.00 33.50 31.93 1j1n n PRO 373 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1j1n h VAL 374 N 2.02 1.03 -0.71 -1.45 2.07 -1.92 -1.26 116.25 116.02 1j1n h VAL 374 Ca -0.46 -0.36 -0.04 0.00 0.82 0.00 0.00 66.70 66.66 1j1n h VAL 374 Cb 1.31 -0.11 -0.03 0.00 -1.52 0.00 0.00 31.29 30.93 1j1n h VAL 374 CO 0.60 0.19 0.29 -0.55 0.02 0.00 0.00 177.57 178.11 1j1n h ASN 375 N 1.05 0.96 -0.76 0.57 -1.07 -1.99 -1.13 115.58 113.22 1j1n h ASN 375 Ca 0.42 -0.14 -0.05 0.00 0.07 0.00 0.00 56.30 56.61 1j1n h ASN 375 Cb 0.24 -0.25 -0.03 0.00 -2.07 0.00 0.00 38.32 36.21 1j1n h ASN 375 CO -0.20 0.86 0.29 0.78 0.07 0.00 0.00 177.43 179.24 1j1n h ASN 376 N 1.03 1.06 -0.53 6.14 2.35 -1.65 -0.90 115.58 123.09 1j1n h ASN 376 Ca 0.24 -0.18 0.02 0.00 -0.55 0.00 0.00 56.30 55.83 1j1n h ASN 376 Cb 0.19 -0.28 -0.03 0.00 0.05 0.00 0.00 38.32 38.25 1j1n h ASN 376 CO -0.02 0.95 0.33 1.56 -1.65 0.00 0.00 177.43 178.60 1j1n h GLN 377 N 1.11 0.64 -0.24 0.81 4.20 -0.61 -2.96 115.11 118.06 1j1n h GLN 377 Ca 0.25 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.80 1j1n h GLN 377 Cb 0.23 -0.14 -0.01 0.00 0.30 0.00 0.00 27.48 27.85 1j1n h GLN 377 CO -0.02 0.43 -0.37 -0.07 -0.67 0.00 0.00 178.83 178.13 1j1n h LEU 378 N 0.66 0.57 -0.58 1.46 3.38 -0.77 -3.13 115.31 116.90 1j1n h LEU 378 Ca 0.21 -0.24 0.08 0.00 0.09 0.00 0.00 57.88 58.02 1j1n h LEU 378 Cb -0.01 -0.16 -0.06 0.00 0.09 0.00 0.00 40.66 40.51 1j1n h LEU 378 CO -0.08 0.89 0.23 1.88 0.09 0.00 0.00 178.44 181.46 1j1n h TYR 379 N 0.46 0.41 0.00 1.13 0.05 -0.99 0.87 116.97 118.90 1j1n h TYR 379 Ca 0.05 0.03 0.00 0.00 0.05 0.00 0.00 58.73 58.85 1j1n h TYR 379 Cb 0.85 -0.10 0.00 0.00 1.01 0.00 0.00 36.73 38.50 1j1n h TYR 379 CO 0.03 0.13 0.00 -0.25 -1.05 0.00 0.00 178.16 177.02 1j1n n ASP 380 N -4.97 0.00 -0.16 3.88 10.43 -1.18 -2.05 116.55 122.49 1j1n n ASP 380 Ca 0.08 0.30 0.04 0.00 2.57 0.00 0.00 54.79 57.77 1j1n n ASP 380 Cb 0.24 -0.39 -0.01 0.00 1.84 0.00 0.00 41.12 42.80 1j1n n ASP 380 CO 0.00 0.00 0.00 0.23 -1.07 0.00 0.00 177.20 176.36 1j1n n MET 381 N -1.39 2.52 -0.06 -1.24 2.81 -0.29 -4.90 117.12 114.58 1j1n n MET 381 Ca 0.04 -0.46 0.00 0.00 -1.81 0.00 0.00 57.70 55.47 1j1n n MET 381 Cb 0.12 -1.00 0.00 0.00 -0.71 0.00 0.00 33.22 31.63 1j1n n MET 381 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1j1n n GLY 382 N 0.86 0.97 3.56 3.03 0.00 -0.59 -1.95 105.19 111.07 1j1n n GLY 382 Ca 0.03 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.76 1j1n n GLY 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1j1n s ALA 383 N -2.00 2.95 -1.50 4.61 0.00 0.14 -4.61 121.76 121.35 1j1n s ALA 383 Ca 0.00 -1.68 -0.06 0.00 0.00 0.00 0.00 51.96 50.22 1j1n s ALA 383 Cb 0.00 -0.59 0.02 0.00 0.00 0.00 0.00 23.12 22.55 1j1n s ALA 383 CO 0.00 0.32 0.58 1.04 0.00 0.00 0.00 175.76 177.70 1j1n n GLN 384 N -0.53 -4.57 -3.99 0.00 1.13 -0.48 -2.76 117.38 106.18 1j1n n GLN 384 Ca -0.07 0.82 -0.29 0.00 -1.94 0.00 0.00 57.00 55.52 1j1n n GLN 384 Cb 0.58 -5.65 -0.05 0.00 0.11 0.00 0.00 30.24 25.24 1j1n n GLN 384 CO 0.00 0.00 0.00 0.96 -1.44 0.00 0.00 177.06 176.58 1j1n s ILE 385 N -3.12 5.00 0.00 5.09 -4.36 -1.26 -4.83 121.20 117.71 1j1n s ILE 385 Ca 0.32 -0.69 -0.01 0.00 -0.26 0.00 0.00 60.65 60.01 1j1n s ILE 385 Cb -0.15 -3.49 -0.06 0.00 1.25 0.00 0.00 42.46 40.01 1j1n s ILE 385 CO 0.40 0.03 1.33 -0.81 0.24 0.00 0.00 174.94 176.13 1j1n n PRO 386 N -0.01 0.61 -2.22 0.37 -0.04 -1.26 -4.83 135.00 127.62 1j1n n PRO 386 Ca -0.07 -0.24 -0.20 0.00 -0.04 0.00 0.00 63.50 62.95 1j1n n PRO 386 Cb 0.53 -1.56 0.11 0.00 -0.04 0.00 0.00 33.50 32.54 1j1n n PRO 386 CO 0.00 0.00 0.00 0.44 -0.04 0.00 0.00 175.50 175.90 1j1n n ILE 387 N 2.47 0.00 -2.67 0.52 -5.35 -1.26 -2.82 119.36 110.24 1j1n n ILE 387 Ca 0.10 -1.30 -0.43 0.00 -0.27 0.00 0.00 62.75 60.86 1j1n n ILE 387 Cb 0.28 -1.03 -0.03 0.00 -1.74 0.00 0.00 39.64 37.13 1j1n n ILE 387 CO 0.00 0.00 0.00 -0.83 -1.76 0.00 0.00 176.55 173.96 1j1n s GLY 388 N -4.80 1.36 0.19 3.28 0.00 -1.25 -3.82 107.32 102.27 1j1n s GLY 388 Ca 0.58 -0.56 -0.20 0.00 0.00 0.00 0.00 44.72 44.54 1j1n s GLY 388 CO 0.38 2.29 0.57 -0.11 0.00 0.00 0.00 173.10 176.23 1j1n s PHE 389 N 4.19 -0.31 -0.45 1.90 -0.71 -1.10 -4.78 117.98 116.73 1j1n s PHE 389 Ca 0.44 0.00 -0.14 0.00 -1.04 0.00 0.00 56.93 56.20 1j1n s PHE 389 Cb -0.08 0.49 0.07 0.00 -1.21 0.00 0.00 43.02 42.29 1j1n s PHE 389 CO 0.29 -0.92 0.34 -0.46 -1.34 0.00 0.00 175.22 173.14 1j1n s TRP 390 N -3.82 3.27 0.62 3.49 -0.11 -1.08 -1.30 118.94 120.00 1j1n s TRP 390 Ca 0.05 -1.03 -0.18 0.00 1.22 0.00 0.00 56.10 56.16 1j1n s TRP 390 Cb -0.01 -3.01 -0.02 0.00 -1.50 0.00 0.00 33.47 28.93 1j1n s TRP 390 CO -0.06 -0.78 1.25 -1.14 -4.62 0.00 0.00 176.95 171.60 1j1n s GLN 391 N 1.59 2.76 -0.28 5.86 0.74 0.04 -4.86 119.66 125.51 1j1n s GLN 391 Ca 0.04 1.93 0.03 0.00 0.05 0.00 0.00 55.36 57.41 1j1n s GLN 391 Cb -0.23 -1.89 0.07 0.00 1.10 0.00 0.00 33.01 32.06 1j1n s GLN 391 CO 0.06 -1.40 -0.07 0.34 -0.55 0.00 0.00 175.29 173.67 1j1n s ASP 392 N -1.52 4.51 0.66 6.67 -1.08 -1.26 -4.42 116.67 120.23 1j1n s ASP 392 Ca 0.80 -1.58 0.40 0.00 -0.52 0.00 0.00 52.55 51.64 1j1n s ASP 392 Cb -0.33 -1.55 2.19 0.00 -1.46 0.00 0.00 42.92 41.76 1j1n s ASP 392 CO 0.36 -0.24 2.25 0.22 0.52 0.00 0.00 175.17 178.29 1j1n h TYR 393 N 7.74 0.00 0.00 -5.34 5.03 -1.95 -1.33 116.97 121.12 1j1n h TYR 393 Ca -0.15 0.00 -0.01 0.00 2.58 0.00 0.00 58.73 61.15 1j1n h TYR 393 Cb 1.04 0.00 -0.00 0.00 1.55 0.00 0.00 36.73 39.31 1j1n h TYR 393 CO 0.59 0.00 -0.06 0.22 -1.32 0.00 0.00 178.16 177.59 1j1n h ASP 394 N 0.00 0.00 -0.71 -2.11 -0.00 -1.94 -0.09 116.42 111.57 1j1n h ASP 394 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.03 56.99 1j1n h ASP 394 Cb 0.18 0.00 -0.03 0.00 -0.00 0.00 0.00 39.33 39.48 1j1n h ASP 394 CO -0.00 0.06 0.26 0.10 -0.00 0.00 0.00 179.24 179.66 1j1n h TYR 395 N 0.00 1.10 -0.03 0.28 -0.00 -1.60 -2.65 116.97 114.07 1j1n h TYR 395 Ca -0.00 -0.09 -0.26 0.00 0.00 0.00 0.00 58.73 58.38 1j1n h TYR 395 Cb 0.31 -0.32 0.02 0.00 0.00 0.00 0.00 36.73 36.74 1j1n h TYR 395 CO 0.00 0.86 -0.99 1.49 -0.00 0.00 0.00 178.16 179.52 1j1n h GLU 396 N 1.02 0.72 -0.95 0.10 4.81 -1.34 -3.22 114.58 115.72 1j1n h GLU 396 Ca 0.23 -0.73 0.14 0.00 -0.13 0.00 0.00 59.36 58.87 1j1n h GLU 396 Cb 0.24 0.20 -0.08 0.00 0.63 0.00 0.00 28.75 29.74 1j1n h GLU 396 CO -0.02 1.31 0.60 -0.09 -0.73 0.00 0.00 179.01 180.09 1j1n h ARG 397 N 0.42 0.79 0.00 1.92 2.43 -0.93 -1.64 114.38 117.37 1j1n h ARG 397 Ca -0.11 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.00 1j1n h ARG 397 Cb 1.64 -0.18 -0.00 0.00 -0.42 0.00 0.00 29.97 31.01 1j1n h ARG 397 CO 0.20 0.52 -0.05 1.96 -1.51 0.00 0.00 179.97 181.09 1j1n h GLN 398 N 0.81 0.00 -0.04 0.20 4.20 -1.48 -2.57 115.11 116.23 1j1n h GLN 398 Ca 0.48 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.19 1j1n h GLN 398 Cb 0.66 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.44 1j1n h GLN 398 CO -0.25 0.05 0.00 -2.67 -0.67 0.00 0.00 178.83 175.30 1j1n n TRP 399 N -3.40 0.14 -3.31 2.96 4.27 -0.67 -4.92 117.44 112.50 1j1n n TRP 399 Ca -0.02 -0.91 -0.43 0.00 -3.89 0.00 0.00 57.50 52.25 1j1n n TRP 399 Cb 0.19 -0.16 -0.08 0.00 -1.36 0.00 0.00 31.31 29.89 1j1n n TRP 399 CO 0.00 0.00 0.00 0.99 -2.29 0.00 0.00 177.69 176.39 1j1n s THR 400 N -2.60 5.08 0.92 -1.67 2.01 -0.88 -4.92 115.64 113.58 1j1n s THR 400 Ca 0.29 -0.40 -0.11 0.00 0.31 0.00 0.00 61.69 61.78 1j1n s THR 400 Cb 0.25 -4.06 0.14 0.00 0.01 0.00 0.00 72.50 68.84 1j1n s THR 400 CO 0.04 -0.46 1.09 0.42 -0.69 0.00 0.00 174.62 175.02 1j1n s THR 401 N 2.15 2.56 0.38 -0.82 -4.23 -1.26 -4.71 115.64 109.70 1j1n s THR 401 Ca 0.12 0.18 0.06 0.00 -1.18 0.00 0.00 61.69 60.87 1j1n s THR 401 Cb -0.18 -2.51 0.28 0.00 1.34 0.00 0.00 72.50 71.44 1j1n s THR 401 CO 0.13 -0.24 2.00 -0.65 -0.54 0.00 0.00 174.62 175.32 1j1n h PRO 402 N -1.70 0.67 -0.37 3.99 0.11 -1.98 0.17 132.00 132.90 1j1n h PRO 402 Ca -0.49 -0.04 -0.06 0.00 0.11 0.00 0.00 66.00 65.52 1j1n h PRO 402 Cb 1.28 -0.15 -0.01 0.00 0.11 0.00 0.00 31.00 32.22 1j1n h PRO 402 CO 0.51 0.45 -0.02 0.93 -0.21 0.00 0.00 178.00 179.66 1j1n h GLU 403 N 0.70 0.66 -0.61 1.05 3.07 -1.99 -0.33 114.58 117.12 1j1n h GLU 403 Ca 0.25 -0.22 -0.09 0.00 -0.50 0.00 0.00 59.36 58.80 1j1n h GLU 403 Cb 0.13 -0.06 -0.02 0.00 -0.84 0.00 0.00 28.75 27.96 1j1n h GLU 403 CO -0.07 0.78 0.02 0.00 -1.40 0.00 0.00 179.01 178.34 1j1n h ALA 404 N 0.86 0.83 -0.63 3.43 0.00 -1.68 -2.63 119.26 119.43 1j1n h ALA 404 Ca 0.10 -0.30 -0.05 0.00 0.00 0.00 0.00 54.91 54.66 1j1n h ALA 404 Cb 0.49 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.02 1j1n h ALA 404 CO 0.02 0.65 0.21 0.37 0.00 0.00 0.00 179.25 180.50 1j1n h GLN 405 N 0.97 0.95 -0.35 0.00 5.75 -0.50 -1.33 115.11 120.60 1j1n h GLN 405 Ca 0.18 -0.18 -0.04 0.00 -0.15 0.00 0.00 58.65 58.45 1j1n h GLN 405 Cb 0.54 -0.15 -0.02 0.00 1.07 0.00 0.00 27.48 28.92 1j1n h GLN 405 CO 0.03 0.81 0.03 0.00 -2.65 0.00 0.00 178.83 177.04 1j1n h ALA 406 N 1.30 1.41 -0.22 3.38 0.00 -0.82 -0.22 119.26 124.09 1j1n h ALA 406 Ca 0.21 -0.18 -0.06 0.00 0.00 0.00 0.00 54.91 54.88 1j1n h ALA 406 Cb 0.25 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1j1n h ALA 406 CO -0.01 0.42 -0.10 0.78 0.00 0.00 0.00 179.25 180.34 1j1n h GLY 407 N 0.80 0.49 0.93 0.00 0.00 -0.96 -1.17 103.07 103.16 1j1n h GLY 407 Ca 0.11 -0.44 0.01 0.00 0.00 0.00 0.00 47.33 47.02 1j1n h GLY 407 CO 0.01 0.40 0.11 -2.22 0.00 0.00 0.00 176.54 174.84 1j1n h ILE 408 N 0.16 1.01 -0.34 2.60 2.04 -0.89 -1.80 117.51 120.29 1j1n h ILE 408 Ca 0.05 -0.08 -0.02 0.00 1.00 0.00 0.00 64.86 65.81 1j1n h ILE 408 Cb 0.59 0.75 -0.02 0.00 -0.74 0.00 0.00 36.82 37.40 1j1n h ILE 408 CO 0.03 0.04 0.13 0.44 0.00 0.00 0.00 178.15 178.80 1j1n h ASP 409 N 0.24 0.42 -0.50 1.72 3.32 -1.00 -1.00 116.42 119.62 1j1n h ASP 409 Ca 0.09 -0.04 -0.05 0.00 0.02 0.00 0.00 57.03 57.05 1j1n h ASP 409 Cb 0.01 -0.11 -0.02 0.00 0.22 0.00 0.00 39.33 39.43 1j1n h ASP 409 CO -0.05 0.39 0.12 -0.03 -1.72 0.00 0.00 179.24 177.95 1j1n h MET 410 N 0.47 0.80 -0.35 3.56 4.05 -0.62 -0.64 114.93 122.20 1j1n h MET 410 Ca 0.12 -0.19 -0.13 0.00 -0.28 0.00 0.00 59.70 59.21 1j1n h MET 410 Cb 0.10 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.79 1j1n h MET 410 CO -0.01 0.77 -0.31 1.88 0.23 0.00 0.00 176.91 179.47 1j1n h TYR 411 N 0.69 0.88 -0.15 1.39 -1.99 -0.61 -0.29 116.97 116.89 1j1n h TYR 411 Ca 0.16 -0.23 -0.03 0.00 2.00 0.00 0.00 58.73 60.63 1j1n h TYR 411 Cb 0.34 -0.20 -0.00 0.00 2.00 0.00 0.00 36.73 38.86 1j1n h TYR 411 CO 0.02 0.97 -0.02 0.28 -0.00 0.00 0.00 178.16 179.42 1j1n h VAL 412 N 0.64 1.27 -0.46 -2.88 2.07 -1.06 -2.38 116.25 113.45 1j1n h VAL 412 Ca 0.07 -0.92 -0.07 0.00 0.82 0.00 0.00 66.70 66.61 1j1n h VAL 412 Cb 0.84 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.18 1j1n h VAL 412 CO 0.07 0.27 -0.00 0.50 0.02 0.00 0.00 177.57 178.43 1j1n h LYS 413 N -0.01 0.75 0.00 1.57 3.64 -1.07 -2.59 116.57 118.85 1j1n h LYS 413 Ca 0.04 -0.20 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 1j1n h LYS 413 Cb 0.42 -0.09 0.00 0.00 -0.41 0.00 0.00 32.23 32.15 1j1n h LYS 413 CO 0.01 0.76 0.00 0.41 -2.27 0.00 0.00 179.45 178.36 1j1n n GLY 414 N -0.67 -1.32 3.43 5.01 0.00 -0.13 -4.91 105.19 106.61 1j1n n GLY 414 Ca 0.02 -0.04 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 1j1n n GLY 414 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1j1n n LYS 415 N -1.75 -5.76 0.07 1.61 5.02 -0.91 -4.89 118.16 111.56 1j1n n LYS 415 Ca 0.05 0.76 -0.06 0.00 -2.02 0.00 0.00 58.31 57.04 1j1n n LYS 415 Cb 0.28 -5.67 -0.08 0.00 -0.02 0.00 0.00 35.03 29.53 1j1n n LYS 415 CO 0.00 0.00 0.00 1.88 -0.52 0.00 0.00 177.40 178.76 1j1n h TYR 416 N -1.88 0.00 -2.61 2.13 0.99 -1.82 -3.45 116.97 110.33 1j1n h TYR 416 Ca -0.54 0.00 -0.55 0.00 2.00 0.00 0.00 58.73 59.64 1j1n h TYR 416 Cb 1.36 0.00 -0.01 0.00 1.00 0.00 0.00 36.73 39.08 1j1n h TYR 416 CO 0.55 0.94 1.10 0.08 -0.00 0.00 0.00 178.16 180.83 1j1n s VAL 417 N -2.82 3.59 0.19 -2.88 1.01 -1.26 -2.04 120.40 116.20 1j1n s VAL 417 Ca 0.01 0.70 -0.30 0.00 0.00 0.00 0.00 61.98 62.39 1j1n s VAL 417 Cb 0.10 -3.47 -0.08 0.00 0.00 0.00 0.00 36.38 32.93 1j1n s VAL 417 CO 0.81 -0.08 1.05 -0.04 0.00 0.00 0.00 175.10 176.84 1j1n s MET 418 N 4.12 4.67 0.25 2.72 -1.94 -0.13 -4.98 119.30 124.01 1j1n s MET 418 Ca 0.74 1.65 -0.31 0.00 -1.71 0.00 0.00 55.69 56.05 1j1n s MET 418 Cb -0.33 -3.28 -0.12 0.00 2.01 0.00 0.00 34.83 33.11 1j1n s MET 418 CO 0.29 0.20 1.61 -2.30 -0.01 0.00 0.00 175.02 174.82 1j1n n PRO 419 N 2.08 2.59 -2.27 2.03 -0.02 -1.26 -4.79 135.00 133.36 1j1n n PRO 419 Ca 0.01 0.93 -0.30 0.00 -2.02 0.00 0.00 63.50 62.12 1j1n n PRO 419 Cb 0.47 -2.71 -0.00 0.00 -0.02 0.00 0.00 33.50 31.23 1j1n n PRO 419 CO 0.00 0.00 0.00 0.20 1.98 0.00 0.00 175.50 177.68 1j1n s GLY 420 N 0.71 1.70 0.00 -1.23 0.00 -1.26 -4.94 107.32 102.29 1j1n s GLY 420 Ca 0.69 -0.19 -0.30 0.00 0.00 0.00 0.00 44.72 44.93 1j1n s GLY 420 CO 0.43 0.05 1.13 -0.12 0.00 0.00 0.00 173.10 174.59 1j1n s PHE 421 N -2.89 3.42 -1.57 1.90 5.99 0.92 -4.93 117.98 120.82 1j1n s PHE 421 Ca 0.53 1.39 0.23 0.00 0.00 0.00 0.00 56.93 59.09 1j1n s PHE 421 Cb -0.11 -3.33 0.20 0.00 0.00 0.00 0.00 43.02 39.78 1j1n s PHE 421 CO 0.46 -0.91 1.21 0.39 -0.00 0.00 0.00 175.22 176.36 1j1n n GLU 422 N 4.37 0.66 0.00 10.12 -0.58 -1.26 -4.84 120.64 129.11 1j1n n GLU 422 Ca 0.09 -0.49 0.00 0.00 -0.42 0.00 0.00 57.16 56.33 1j1n n GLU 422 Cb 0.48 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.86 1j1n n GLU 422 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1j1n n GLY 423 N 1.43 0.05 3.33 0.62 0.00 -1.26 -4.96 105.19 104.40 1j1n n GLY 423 Ca 0.08 -1.85 -0.18 0.00 0.00 0.00 0.00 46.02 44.07 1j1n n GLY 423 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1j1n s VAL 424 N -1.65 1.59 -0.65 1.61 -7.23 -1.26 -5.04 120.40 107.77 1j1n s VAL 424 Ca 0.00 -2.17 -0.11 0.00 -1.81 0.00 0.00 61.98 57.89 1j1n s VAL 424 Cb 0.00 -2.02 0.17 0.00 0.56 0.00 0.00 36.38 35.08 1j1n s VAL 424 CO 0.00 -0.61 0.55 0.20 -0.31 0.00 0.00 175.10 174.93 1j1n s ASN 425 N -3.29 6.10 0.53 4.85 0.01 -1.26 -5.05 114.94 116.84 1j1n s ASN 425 Ca 0.22 -2.36 -0.11 0.00 -0.71 0.00 0.00 52.86 49.89 1j1n s ASN 425 Cb 0.00 -2.09 -0.05 0.00 0.41 0.00 0.00 41.25 39.52 1j1n s ASN 425 CO 0.06 -0.62 0.92 -0.04 -1.51 0.00 0.00 177.10 175.91 1j1n s MET 426 N 0.68 3.69 0.83 -0.60 -1.94 -1.26 -4.78 119.30 115.92 1j1n s MET 426 Ca 0.12 0.62 -0.12 0.00 -1.71 0.00 0.00 55.69 54.61 1j1n s MET 426 Cb -0.20 -2.21 0.10 0.00 2.01 0.00 0.00 34.83 34.54 1j1n s MET 426 CO -0.04 -0.33 1.18 0.95 -0.01 0.00 0.00 175.02 176.77 1j1n s THR 427 N -2.82 2.04 0.19 2.05 -4.23 -1.26 -4.49 115.64 107.12 1j1n s THR 427 Ca 0.53 -0.05 -0.12 0.00 -1.18 0.00 0.00 61.69 60.88 1j1n s THR 427 Cb -0.10 -2.99 0.11 0.00 1.34 0.00 0.00 72.50 70.85 1j1n s THR 427 CO 0.43 0.00 1.83 -0.09 -0.54 0.00 0.00 174.62 176.25 1j1n h ARG 428 N -1.11 0.71 -0.69 3.99 1.12 -1.98 -0.78 114.38 115.64 1j1n h ARG 428 Ca -0.45 -0.04 -0.07 0.00 -1.11 0.00 0.00 59.98 58.30 1j1n h ARG 428 Cb 1.31 -0.16 -0.03 0.00 -0.01 0.00 0.00 29.97 31.08 1j1n h ARG 428 CO 0.59 0.47 0.14 0.93 -3.11 0.00 0.00 179.97 178.99 1j1n h GLU 429 N 0.73 1.11 -0.25 0.20 3.07 -2.00 -1.74 114.58 115.69 1j1n h GLU 429 Ca 0.25 -0.28 -0.05 0.00 -0.50 0.00 0.00 59.36 58.78 1j1n h GLU 429 Cb 0.03 -0.14 -0.01 0.00 -0.84 0.00 0.00 28.75 27.79 1j1n h GLU 429 CO -0.10 0.99 -0.04 0.93 -1.40 0.00 0.00 179.01 179.39 1j1n h GLU 430 N 1.05 0.47 0.00 2.33 5.08 -1.83 -2.91 114.58 118.77 1j1n h GLU 430 Ca 0.21 -0.17 -0.04 0.00 -1.00 0.00 0.00 59.36 58.37 1j1n h GLU 430 Cb 0.40 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 1j1n h GLU 430 CO 0.01 0.68 -0.17 -0.09 -1.00 0.00 0.00 179.01 178.43 1j1n h ARG 431 N 0.23 0.00 -0.51 2.33 2.43 -1.06 -2.08 114.38 115.73 1j1n h ARG 431 Ca 0.07 0.00 -0.05 0.00 -0.81 0.00 0.00 59.98 59.19 1j1n h ARG 431 Cb 0.49 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.01 1j1n h ARG 431 CO 0.02 0.17 0.11 0.00 -1.51 0.00 0.00 179.97 178.76 1j1n h ALA 432 N 1.83 1.24 -0.44 2.80 0.00 -1.11 0.19 119.26 123.77 1j1n h ALA 432 Ca -0.00 -0.20 -0.13 0.00 0.00 0.00 0.00 54.91 54.58 1j1n h ALA 432 Cb 0.49 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 1j1n h ALA 432 CO 0.02 0.52 -0.22 0.82 0.00 0.00 0.00 179.25 180.40 1j1n h ILE 433 N 0.75 1.27 -0.20 0.00 5.03 -1.33 -1.16 117.51 121.87 1j1n h ILE 433 Ca 0.16 -1.37 -0.00 0.00 -0.12 0.00 0.00 64.86 63.53 1j1n h ILE 433 Cb 0.30 1.22 -0.01 0.00 -3.03 0.00 0.00 36.82 35.30 1j1n h ILE 433 CO 0.00 0.47 0.12 0.22 -0.68 0.00 0.00 178.15 178.28 1j1n h TYR 434 N 0.76 0.26 -0.09 1.37 5.03 -1.06 -1.48 116.97 121.77 1j1n h TYR 434 Ca 0.10 -0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.36 1j1n h TYR 434 Cb 0.79 -0.09 -0.01 0.00 1.55 0.00 0.00 36.73 38.98 1j1n h TYR 434 CO 0.06 0.21 -0.17 -0.44 -1.32 0.00 0.00 178.16 176.49 1j1n h ASP 435 N 0.24 0.13 -0.24 -2.11 3.32 -0.55 -0.94 116.42 116.26 1j1n h ASP 435 Ca 0.07 -0.03 -0.17 0.00 0.02 0.00 0.00 57.03 56.92 1j1n h ASP 435 Cb 0.02 -0.03 0.00 0.00 0.22 0.00 0.00 39.33 39.54 1j1n h ASP 435 CO -0.01 0.32 -0.53 0.50 -1.72 0.00 0.00 179.24 177.79 1j1n h LYS 436 N 0.13 0.79 0.00 3.56 3.64 -0.73 -3.42 116.57 120.54 1j1n h LYS 436 Ca 0.03 -0.52 -0.17 0.00 -1.27 0.00 0.00 60.65 58.71 1j1n h LYS 436 Cb 0.39 0.07 -0.03 0.00 -0.41 0.00 0.00 32.23 32.25 1j1n h LYS 436 CO 0.03 1.15 -1.64 0.66 -2.27 0.00 0.00 179.45 177.37 1j1n n TYR 437 N -4.08 0.00 -0.02 1.91 0.53 -0.60 -4.80 117.16 110.10 1j1n n TYR 437 Ca -0.05 0.00 -0.09 0.00 -1.02 0.00 0.00 57.90 56.74 1j1n n TYR 437 Cb 0.62 -0.45 -0.03 0.00 -1.03 0.00 0.00 39.34 38.45 1j1n n TYR 437 CO 0.00 0.00 0.00 2.35 -1.02 0.00 0.00 176.86 178.19 1j1n h TRP 438 N 0.00 -0.66 -0.83 -0.72 -0.00 -1.37 -1.60 115.95 110.76 1j1n h TRP 438 Ca -0.25 0.03 0.14 0.00 -0.00 0.00 0.00 58.89 58.81 1j1n h TRP 438 Cb 1.48 0.32 -0.09 0.00 -0.00 0.00 0.00 29.16 30.87 1j1n h TRP 438 CO 0.01 -0.33 0.42 0.00 -0.00 0.00 0.00 178.44 178.54 1j1n h ALA 439 N 0.69 1.24 -0.29 2.65 0.00 -1.84 0.70 119.26 122.40 1j1n h ALA 439 Ca 0.12 0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.08 1j1n h ALA 439 Cb 0.47 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 1j1n h ALA 439 CO -0.34 -0.09 0.05 0.22 0.00 0.00 0.00 179.25 179.08 1j1n h ASP 440 N 0.61 0.46 -0.31 0.00 3.58 -1.77 -2.32 116.42 116.68 1j1n h ASP 440 Ca 0.45 -0.26 -0.00 0.00 0.42 0.00 0.00 57.03 57.64 1j1n h ASP 440 Cb 0.62 -0.12 -0.02 0.00 1.72 0.00 0.00 39.33 41.54 1j1n h ASP 440 CO -0.36 0.61 0.18 0.58 -2.88 0.00 0.00 179.24 177.37 1j1n h VAL 441 N 0.30 1.12 -0.52 2.25 2.07 -0.36 -1.93 116.25 119.17 1j1n h VAL 441 Ca 0.09 -0.28 0.03 0.00 0.82 0.00 0.00 66.70 67.36 1j1n h VAL 441 Cb 0.34 0.74 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 1j1n h VAL 441 CO 0.01 0.12 0.30 -0.09 0.02 0.00 0.00 177.57 177.92 1j1n h ARG 442 N 0.40 0.57 -0.57 1.57 2.43 -0.83 0.34 114.38 118.28 1j1n h ARG 442 Ca 0.11 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.21 1j1n h ARG 442 Cb 0.03 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 1j1n h ARG 442 CO -0.02 0.38 0.21 1.15 -1.51 0.00 0.00 179.97 180.18 1j1n h THR 443 N 0.59 1.23 -0.53 0.20 2.02 -1.29 -1.62 112.91 113.50 1j1n h THR 443 Ca 0.22 -0.74 -0.01 0.00 0.77 0.00 0.00 66.41 66.64 1j1n h THR 443 Cb 0.06 0.64 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1j1n h THR 443 CO -0.12 0.28 0.27 0.22 0.37 0.00 0.00 175.52 176.55 1j1n h TYR 444 N 0.79 0.75 -0.38 3.16 3.20 -0.87 -1.58 116.97 122.05 1j1n h TYR 444 Ca 0.19 -0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.06 1j1n h TYR 444 Cb 0.23 -0.24 -0.03 0.00 1.54 0.00 0.00 36.73 38.24 1j1n h TYR 444 CO 0.01 0.57 0.19 0.52 -1.64 0.00 0.00 178.16 177.81 1j1n h MET 445 N 0.71 0.38 -0.71 1.82 2.86 -0.66 -1.19 114.93 118.14 1j1n h MET 445 Ca 0.18 -0.02 -0.02 0.00 -2.06 0.00 0.00 59.70 57.79 1j1n h MET 445 Cb 0.08 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.62 1j1n h MET 445 CO -0.03 0.25 0.38 -0.92 1.06 0.00 0.00 176.91 177.66 1j1n h TYR 446 N 0.39 0.99 -0.69 -0.22 5.03 -1.05 0.12 116.97 121.54 1j1n h TYR 446 Ca 0.16 -0.03 -0.07 0.00 2.58 0.00 0.00 58.73 61.37 1j1n h TYR 446 Cb 0.06 -0.31 -0.03 0.00 1.55 0.00 0.00 36.73 38.00 1j1n h TYR 446 CO -0.10 0.70 0.15 0.93 -1.32 0.00 0.00 178.16 178.53 1j1n h GLU 447 N 0.98 1.12 -0.30 1.82 5.08 -0.91 -0.14 114.58 122.23 1j1n h GLU 447 Ca 0.25 -0.27 -0.13 0.00 -1.00 0.00 0.00 59.36 58.21 1j1n h GLU 447 Cb 0.05 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.15 1j1n h GLU 447 CO -0.04 0.99 -0.31 0.52 -1.00 0.00 0.00 179.01 179.18 1j1n h MET 448 N 1.05 0.74 -0.75 2.33 2.86 -0.92 -2.51 114.93 117.73 1j1n h MET 448 Ca 0.22 -0.39 0.02 0.00 -2.06 0.00 0.00 59.70 57.48 1j1n h MET 448 Cb 0.39 0.01 -0.04 0.00 0.06 0.00 0.00 31.60 32.02 1j1n h MET 448 CO 0.01 1.01 0.49 0.78 1.06 0.00 0.00 176.91 180.26 1j1n h GLY 449 N 0.50 1.07 1.21 8.32 0.00 -0.51 -0.24 103.07 113.41 1j1n h GLY 449 Ca 0.05 -0.38 -0.07 0.00 0.00 0.00 0.00 47.33 46.93 1j1n h GLY 449 CO 0.08 0.35 0.08 -1.61 0.00 0.00 0.00 176.54 175.44 1j1n h GLN 450 N 0.98 0.97 -0.56 4.80 4.15 -0.98 -1.10 115.11 123.37 1j1n h GLN 450 Ca 0.29 -0.25 -0.07 0.00 0.77 0.00 0.00 58.65 59.39 1j1n h GLN 450 Cb -0.06 -0.12 -0.02 0.00 0.21 0.00 0.00 27.48 27.49 1j1n h GLN 450 CO -0.08 0.91 0.09 0.00 -1.93 0.00 0.00 178.83 177.82 1j1n h ALA 451 N 1.17 0.75 -0.35 3.38 0.00 -0.95 -0.71 119.26 122.54 1j1n h ALA 451 Ca 0.18 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.83 1j1n h ALA 451 Cb 0.42 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1j1n h ALA 451 CO 0.01 0.49 0.14 -1.49 0.00 0.00 0.00 179.25 178.40 1j1n h TRP 452 N 0.82 0.54 -0.20 0.00 6.55 -0.74 -0.89 115.95 122.03 1j1n h TRP 452 Ca 0.17 -0.04 -0.01 0.00 0.95 0.00 0.00 58.89 59.96 1j1n h TRP 452 Cb 0.41 -0.16 -0.01 0.00 -0.86 0.00 0.00 29.16 28.54 1j1n h TRP 452 CO 0.03 0.49 0.08 0.28 -1.05 0.00 0.00 178.44 178.27 1j1n h VAL 453 N 0.42 1.16 0.00 1.49 2.07 -1.05 -2.62 116.25 117.72 1j1n h VAL 453 Ca 0.12 -0.49 0.00 0.00 0.82 0.00 0.00 66.70 67.14 1j1n h VAL 453 Cb 0.18 1.12 0.00 0.00 -1.52 0.00 0.00 31.29 31.08 1j1n h VAL 453 CO -0.01 0.16 0.00 0.23 0.02 0.00 0.00 177.57 177.97 1j1n n MET 454 N -4.83 0.20 -1.03 1.57 2.81 -0.29 -4.65 117.12 110.91 1j1n n MET 454 Ca -0.04 0.12 -0.01 0.00 -1.81 0.00 0.00 57.70 55.97 1j1n n MET 454 Cb 0.12 -1.50 -0.00 0.00 -0.71 0.00 0.00 33.22 31.13 1j1n n MET 454 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1j1n n GLY 455 N 0.36 0.49 0.08 3.03 0.00 -0.46 -4.91 105.19 103.77 1j1n n GLY 455 Ca 0.08 -0.52 0.12 0.00 0.00 0.00 0.00 46.02 45.70 1j1n n GLY 455 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1j1n n THR 456 N -2.93 0.43 -4.12 2.61 -2.24 -0.49 -4.79 114.28 102.75 1j1n n THR 456 Ca -0.01 -0.26 -0.15 0.00 -2.27 0.00 0.00 64.05 61.36 1j1n n THR 456 Cb 0.05 -0.32 -0.14 0.00 -2.10 0.00 0.00 70.33 67.82 1j1n n THR 456 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1j1n s LYS 457 N -3.13 0.39 -0.15 -0.78 1.02 -1.15 -5.01 119.74 110.93 1j1n s LYS 457 Ca 0.09 -0.23 -0.22 0.00 0.02 0.00 0.00 55.97 55.62 1j1n s LYS 457 Cb 0.13 -0.35 -0.03 0.00 -0.52 0.00 0.00 37.83 37.06 1j1n s LYS 457 CO 0.66 0.09 0.69 0.34 -0.92 0.00 0.00 175.35 176.22 1j1n s ASP 458 N -0.26 6.83 0.10 2.83 2.15 -1.26 -4.22 116.67 122.85 1j1n s ASP 458 Ca 0.01 1.01 -0.30 0.00 0.43 0.00 0.00 52.55 53.69 1j1n s ASP 458 Cb -0.03 -2.39 -0.11 0.00 -0.30 0.00 0.00 42.92 40.09 1j1n s ASP 458 CO -0.00 -0.25 1.61 0.58 -0.17 0.00 0.00 175.17 176.94 1j1n h VAL 459 N 5.05 0.26 -0.40 1.11 2.07 -1.96 -1.97 116.25 120.40 1j1n h VAL 459 Ca -0.34 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 1j1n h VAL 459 Cb 1.16 0.26 -0.02 0.00 -1.52 0.00 0.00 31.29 31.17 1j1n h VAL 459 CO 0.78 0.00 0.23 0.44 0.02 0.00 0.00 177.57 179.05 1j1n h ASP 460 N -0.68 0.48 0.75 0.57 3.45 -1.94 -1.17 116.42 117.88 1j1n h ASP 460 Ca -0.00 -0.06 0.00 0.00 0.43 0.00 0.00 57.03 57.39 1j1n h ASP 460 Cb 0.65 -0.12 0.00 0.00 -0.56 0.00 0.00 39.33 39.29 1j1n h ASP 460 CO -0.13 0.41 0.00 0.11 -1.57 0.00 0.00 179.24 178.06 1j1n h LYS 461 N 0.52 0.00 -0.07 3.56 1.57 -1.97 -3.10 116.57 117.08 1j1n h LYS 461 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1j1n h LYS 461 Cb 0.02 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.33 1j1n h LYS 461 CO -0.03 0.00 0.00 0.25 -0.57 0.00 0.00 179.45 179.10 1j1n n THR 462 N -2.82 0.50 -0.14 -0.16 -2.24 -0.75 -4.75 114.28 103.92 1j1n n THR 462 Ca 0.00 -0.75 -0.08 0.00 -2.27 0.00 0.00 64.05 60.95 1j1n n THR 462 Cb 0.24 0.80 -0.00 0.00 -2.10 0.00 0.00 70.33 69.26 1j1n n THR 462 CO 0.00 0.00 0.00 -0.25 -0.57 0.00 0.00 175.07 174.25 1j1n h TRP 463 N 0.81 0.59 -0.69 4.78 2.91 -1.14 0.37 115.95 123.59 1j1n h TRP 463 Ca 0.00 -0.02 -0.04 0.00 1.13 0.00 0.00 58.89 59.95 1j1n h TRP 463 Cb 0.38 -0.19 -0.03 0.00 -0.51 0.00 0.00 29.16 28.82 1j1n h TRP 463 CO 0.04 0.47 0.26 -0.44 -1.03 0.00 0.00 178.44 177.75 1j1n h ASP 464 N 0.54 0.94 -0.38 2.65 3.45 -1.85 -0.03 116.42 121.73 1j1n h ASP 464 Ca 0.14 -0.14 -0.00 0.00 0.43 0.00 0.00 57.03 57.46 1j1n h ASP 464 Cb 0.10 -0.24 -0.02 0.00 -0.56 0.00 0.00 39.33 38.60 1j1n h ASP 464 CO -0.02 0.85 0.22 -0.08 -1.57 0.00 0.00 179.24 178.64 1j1n h GLU 465 N 1.00 0.52 -0.49 3.56 4.81 -1.79 -0.99 114.58 121.20 1j1n h GLU 465 Ca 0.23 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 59.41 1j1n h GLU 465 Cb 0.21 -0.11 -0.02 0.00 0.63 0.00 0.00 28.75 29.46 1j1n h GLU 465 CO -0.02 0.40 0.32 -0.92 -0.73 0.00 0.00 179.01 178.06 1j1n h TYR 466 N 0.49 0.62 -0.55 0.92 5.03 -0.41 -1.76 116.97 121.31 1j1n h TYR 466 Ca 0.14 0.01 -0.05 0.00 2.58 0.00 0.00 58.73 61.41 1j1n h TYR 466 Cb 0.02 -0.21 -0.03 0.00 1.55 0.00 0.00 36.73 38.07 1j1n h TYR 466 CO -0.03 0.40 0.15 1.96 -1.32 0.00 0.00 178.16 179.32 1j1n h GLN 467 N 0.66 0.83 -0.65 1.82 1.08 -0.66 -0.81 115.11 117.39 1j1n h GLN 467 Ca 0.18 -0.16 -0.06 0.00 -1.45 0.00 0.00 58.65 57.16 1j1n h GLN 467 Cb -0.06 -0.13 -0.03 0.00 -0.05 0.00 0.00 27.48 27.21 1j1n h GLN 467 CO -0.04 0.74 0.18 0.00 -0.95 0.00 0.00 178.83 178.75 1j1n h ARG 468 N 0.81 1.03 -0.62 1.46 3.08 -0.73 -2.40 114.38 117.02 1j1n h ARG 468 Ca 0.18 -0.24 -0.05 0.00 0.07 0.00 0.00 59.98 59.94 1j1n h ARG 468 Cb 0.27 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 30.15 1j1n h ARG 468 CO -0.01 0.92 0.18 1.96 -1.07 0.00 0.00 179.97 181.95 1j1n h GLN 469 N 0.96 0.97 -0.94 0.04 1.08 -0.82 -1.56 115.11 114.83 1j1n h GLN 469 Ca 0.21 -0.22 0.01 0.00 -1.45 0.00 0.00 58.65 57.20 1j1n h GLN 469 Cb 0.34 -0.13 -0.05 0.00 -0.05 0.00 0.00 27.48 27.58 1j1n h GLN 469 CO -0.00 0.87 0.62 -0.07 -0.95 0.00 0.00 178.83 179.30 1j1n h LEU 470 N 0.89 1.07 -0.04 1.46 3.38 -0.92 -0.53 115.31 120.62 1j1n h LEU 470 Ca 0.20 -0.02 -0.01 0.00 0.09 0.00 0.00 57.88 58.13 1j1n h LEU 470 Cb 0.32 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.80 1j1n h LEU 470 CO -0.00 0.77 -0.03 0.50 0.09 0.00 0.00 178.44 179.77 1j1n h LYS 471 N 1.26 0.08 0.00 1.13 3.64 -1.11 -0.92 116.57 120.66 1j1n h LYS 471 Ca 0.35 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.69 1j1n h LYS 471 Cb -0.12 -0.00 0.00 0.00 -0.41 0.00 0.00 32.23 31.70 1j1n h LYS 471 CO -0.08 0.51 0.00 1.47 -2.27 0.00 0.00 179.45 179.08 1j1n n LEU 472 N -4.80 0.17 -0.60 5.20 -0.00 -0.62 -1.75 117.00 114.60 1j1n n LEU 472 Ca -0.08 0.53 0.12 0.00 -0.00 0.00 0.00 56.01 56.59 1j1n n LEU 472 Cb 0.26 -0.50 0.22 0.00 -0.00 0.00 0.00 43.42 43.39 1j1n n LEU 472 CO 0.35 -0.25 0.60 0.54 -0.00 0.00 0.00 177.39 178.63 1j1n n ARG 473 N -1.68 1.62 -0.60 1.47 1.74 -0.22 -4.98 116.66 114.02 1j1n n ARG 473 Ca 0.04 -1.21 0.00 0.00 -0.77 0.00 0.00 57.85 55.91 1j1n n ARG 473 Cb 0.23 -1.47 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1j1n n ARG 473 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1j1n n GLY 474 N 1.33 0.70 0.25 -0.13 0.00 -0.71 -4.74 105.19 101.88 1j1n n GLY 474 Ca 0.14 -0.04 -0.03 0.00 0.00 0.00 0.00 46.02 46.08 1j1n n GLY 474 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1j1n h LEU 475 N 0.00 0.58 -1.29 0.99 5.85 -1.38 -1.48 115.31 118.58 1j1n h LEU 475 Ca 0.00 0.01 -0.06 0.00 0.84 0.00 0.00 57.88 58.67 1j1n h LEU 475 Cb 0.00 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.91 1j1n h LEU 475 CO 0.00 0.40 -0.28 1.88 -0.34 0.00 0.00 178.44 180.10 1j1n h TYR 476 N 0.71 0.00 -0.04 1.25 -1.99 -1.86 -0.65 116.97 114.40 1j1n h TYR 476 Ca 0.26 0.00 -0.21 0.00 2.00 0.00 0.00 58.73 60.78 1j1n h TYR 476 Cb 0.08 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.81 1j1n h TYR 476 CO -0.06 0.28 -0.86 0.37 -0.00 0.00 0.00 178.16 177.88 1j1n h GLN 477 N 0.00 0.46 -0.52 4.88 4.15 -1.77 -2.04 115.11 120.28 1j1n h GLN 477 Ca -0.00 -0.44 -0.03 0.00 0.77 0.00 0.00 58.65 58.94 1j1n h GLN 477 Cb 0.68 0.11 -0.02 0.00 0.21 0.00 0.00 27.48 28.46 1j1n h GLN 477 CO 0.04 1.09 0.19 0.28 -1.93 0.00 0.00 178.83 178.50 1j1n h VAL 478 N 0.29 1.22 -0.79 2.39 2.07 -0.70 -1.36 116.25 119.37 1j1n h VAL 478 Ca -0.06 -0.70 -0.02 0.00 0.82 0.00 0.00 66.70 66.74 1j1n h VAL 478 Cb 1.48 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 31.92 1j1n h VAL 478 CO 0.15 0.26 0.43 -0.07 0.02 0.00 0.00 177.57 178.36 1j1n h LEU 479 N 0.70 0.98 -0.45 2.57 3.38 -1.07 -1.05 115.31 120.36 1j1n h LEU 479 Ca 0.17 -0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.04 1j1n h LEU 479 Cb 0.22 -0.25 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1j1n h LEU 479 CO -0.01 0.79 0.20 -0.61 0.09 0.00 0.00 178.44 178.90 1j1n h GLN 480 N 1.10 0.65 -0.70 1.13 4.15 -0.90 0.14 115.11 120.69 1j1n h GLN 480 Ca 0.28 -0.10 -0.00 0.00 0.77 0.00 0.00 58.65 59.59 1j1n h GLN 480 Cb 0.03 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 27.58 1j1n h GLN 480 CO -0.04 0.57 0.42 0.52 -1.93 0.00 0.00 178.83 178.37 1j1n h MET 481 N 0.58 0.95 -0.17 1.69 2.86 -0.74 -1.37 114.93 118.73 1j1n h MET 481 Ca 0.15 -0.09 -0.10 0.00 -2.06 0.00 0.00 59.70 57.60 1j1n h MET 481 Cb 0.15 -0.20 -0.01 0.00 0.06 0.00 0.00 31.60 31.60 1j1n h MET 481 CO -0.02 0.68 -0.35 0.52 1.06 0.00 0.00 176.91 178.80 1j1n h MET 482 N 0.95 0.35 -0.58 1.72 2.86 -0.82 -2.21 114.93 117.20 1j1n h MET 482 Ca 0.25 -0.15 -0.10 0.00 -2.06 0.00 0.00 59.70 57.63 1j1n h MET 482 Cb -0.03 -0.01 -0.02 0.00 0.06 0.00 0.00 31.60 31.60 1j1n h MET 482 CO -0.05 0.66 -0.04 0.37 1.06 0.00 0.00 176.91 178.91 1j1n h GLN 483 N 0.30 1.04 -0.53 1.72 5.75 -0.19 0.75 115.11 123.96 1j1n h GLN 483 Ca 0.04 -0.35 -0.04 0.00 -0.15 0.00 0.00 58.65 58.15 1j1n h GLN 483 Cb 0.76 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.20 1j1n h GLN 483 CO 0.06 1.04 0.19 1.96 -2.65 0.00 0.00 178.83 179.43 1j1n h GLN 484 N 0.94 0.81 -0.40 1.69 4.20 -1.03 0.38 115.11 121.70 1j1n h GLN 484 Ca 0.16 -0.16 -0.03 0.00 0.06 0.00 0.00 58.65 58.67 1j1n h GLN 484 Cb 0.60 -0.12 -0.02 0.00 0.30 0.00 0.00 27.48 28.24 1j1n h GLN 484 CO 0.04 0.73 0.11 0.00 -0.67 0.00 0.00 178.83 179.04 1j1n h ALA 485 N 1.04 0.52 -0.28 3.87 0.00 -1.15 -1.80 119.26 121.46 1j1n h ALA 485 Ca 0.17 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.92 1j1n h ALA 485 Cb 0.24 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 1j1n h ALA 485 CO -0.01 0.18 0.16 -0.92 0.00 0.00 0.00 179.25 178.66 1j1n h TYR 486 N 0.50 0.29 -0.82 0.00 3.20 -0.58 -2.77 116.97 116.79 1j1n h TYR 486 Ca 0.13 0.01 -0.01 0.00 3.14 0.00 0.00 58.73 62.00 1j1n h TYR 486 Cb 0.28 -0.09 -0.04 0.00 1.54 0.00 0.00 36.73 38.41 1j1n h TYR 486 CO 0.01 0.17 0.49 -0.44 -1.64 0.00 0.00 178.16 176.76 1j1n h ASP 487 N 0.33 0.98 -0.38 -2.11 3.32 -0.76 0.10 116.42 117.90 1j1n h ASP 487 Ca 0.11 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 1j1n h ASP 487 Cb 0.00 -0.25 -0.02 0.00 0.22 0.00 0.00 39.33 39.28 1j1n h ASP 487 CO -0.05 0.76 0.17 0.03 -1.72 0.00 0.00 179.24 178.42 1j1n h ARG 488 N 1.13 0.61 0.12 3.56 3.08 -1.06 0.14 114.38 121.96 1j1n h ARG 488 Ca 0.29 -0.08 -0.27 0.00 0.07 0.00 0.00 59.98 60.00 1j1n h ARG 488 Cb -0.04 -0.11 -0.00 0.00 0.08 0.00 0.00 29.97 29.89 1j1n h ARG 488 CO -0.05 0.51 -1.35 0.37 -1.07 0.00 0.00 179.97 178.38 1j1n h GLN 489 N 0.61 0.25 0.00 0.04 4.15 -1.17 -3.42 115.11 115.56 1j1n h GLN 489 Ca 0.15 -0.43 -0.33 0.00 0.77 0.00 0.00 58.65 58.81 1j1n h GLN 489 Cb 0.13 0.16 -0.06 0.00 0.21 0.00 0.00 27.48 27.91 1j1n h GLN 489 CO -0.01 1.20 -2.25 0.66 -1.93 0.00 0.00 178.83 176.50 1j1n n TYR 490 N -3.95 0.00 -3.54 3.99 4.02 0.30 -5.03 117.16 112.95 1j1n n TYR 490 Ca -0.24 0.00 -0.15 0.00 -0.01 0.00 0.00 57.90 57.50 1j1n n TYR 490 Cb 0.89 -0.90 0.01 0.00 -0.02 0.00 0.00 39.34 39.33 1j1n n TYR 490 CO 0.00 0.00 0.00 1.63 -1.01 0.00 0.00 176.86 177.48 1j1n n LYS 491 N -2.68 0.91 -0.00 -0.72 5.02 0.48 -5.03 118.16 116.14 1j1n n LYS 491 Ca -0.30 -2.11 0.00 0.00 -2.02 0.00 0.00 58.31 53.88 1j1n n LYS 491 Cb 1.09 0.12 0.00 0.00 -0.02 0.00 0.00 35.03 36.22 1j1n n LYS 491 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15