data_25722
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25722
_Entry.PDB_ID 2N5M
save_
save_delta_chem_shifts
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts
_Entity_delta_chem_shifts.Model_type single
_Entity_delta_chem_shifts.Entry_ID 25722
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 628 628 GLY N N 628 113.006 113.006 107.555 5.451 25722
2 1 1 . 1 1 628 628 GLY H H 628 8.727 8.727 8.135 0.592 25722
3 1 1 . 1 1 629 629 ILE N N 629 122.730 122.730 117.000 5.730 25722
4 1 1 . 1 1 629 629 ILE HA H 629 4.248 4.248 3.641 0.607 25722
5 1 1 . 1 1 629 629 ILE H H 629 8.560 8.560 7.875 0.685 25722
6 1 1 . 1 1 630 630 ARG N N 630 119.880 119.880 123.873 -3.993 25722
7 1 1 . 1 1 630 630 ARG H H 630 8.029 8.029 8.087 -0.058 25722
8 1 1 . 1 1 631 631 LYS N N 631 119.040 119.040 123.510 -4.470 25722
9 1 1 . 1 1 631 631 LYS H H 631 8.664 8.664 8.397 0.267 25722
10 1 1 . 1 1 632 632 THR N N 632 109.950 109.950 115.268 -5.318 25722
11 1 1 . 1 1 632 632 THR H H 632 8.376 8.376 8.617 -0.241 25722
12 1 1 . 1 1 633 633 ARG N N 633 120.950 120.950 120.251 0.699 25722
13 1 1 . 1 1 633 633 ARG HA H 633 3.680 3.680 3.978 -0.298 25722
14 1 1 . 1 1 633 633 ARG H H 633 8.017 8.017 8.611 -0.594 25722
15 1 1 . 1 1 634 634 GLU N N 634 118.201 118.201 117.515 0.686 25722
16 1 1 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.100 -0.020 25722
17 1 1 . 1 1 634 634 GLU H H 634 7.260 7.260 7.852 -0.592 25722
18 1 1 . 1 1 635 635 THR N N 635 115.274 115.274 114.845 0.429 25722
19 1 1 . 1 1 635 635 THR H H 635 8.137 8.137 8.245 -0.108 25722
20 1 1 . 1 1 636 636 GLU N N 636 115.301 115.301 120.488 -5.187 25722
21 1 1 . 1 1 636 636 GLU HA H 636 4.108 4.108 3.733 0.375 25722
22 1 1 . 1 1 636 636 GLU H H 636 8.274 8.274 8.172 0.102 25722
23 1 1 . 1 1 637 637 ARG N N 637 120.174 120.174 119.391 0.783 25722
24 1 1 . 1 1 637 637 ARG HA H 637 3.759 3.759 3.911 -0.152 25722
25 1 1 . 1 1 637 637 ARG H H 637 7.810 7.810 7.975 -0.165 25722
26 1 1 . 1 1 638 638 LEU N N 638 120.658 120.658 119.281 1.377 25722
27 1 1 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.115 -0.665 25722
28 1 1 . 1 1 638 638 LEU H H 638 8.170 8.170 7.590 0.580 25722
29 1 1 . 1 1 639 639 ARG N N 639 116.325 116.325 117.432 -1.107 25722
30 1 1 . 1 1 639 639 ARG HA H 639 3.924 3.924 3.805 0.119 25722
31 1 1 . 1 1 639 639 ARG H H 639 7.510 7.510 7.192 0.318 25722
32 1 1 . 1 1 640 640 ARG N N 640 117.904 117.904 117.255 0.649 25722
33 1 1 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.084 -0.069 25722
34 1 1 . 1 1 640 640 ARG H H 640 7.925 7.925 8.091 -0.166 25722
35 1 1 . 1 1 641 641 GLN N N 641 118.203 118.203 113.327 4.876 25722
36 1 1 . 1 1 641 641 GLN H H 641 8.682 8.682 8.202 0.480 25722
37 1 1 . 1 1 643 643 LEU N N 643 119.140 119.140 119.222 -0.082 25722
38 1 1 . 1 1 643 643 LEU H H 643 7.139 7.139 7.994 -0.855 25722
39 1 1 . 1 1 644 644 GLU N N 644 120.140 120.140 121.342 -1.202 25722
40 1 1 . 1 1 644 644 GLU H H 644 8.849 8.849 8.619 0.230 25722
41 1 1 . 1 1 645 645 VAL N N 645 119.330 119.330 122.053 -2.723 25722
42 1 1 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.812 0.182 25722
43 1 1 . 1 1 645 645 VAL H H 645 7.986 7.986 7.833 0.153 25722
44 1 1 . 1 1 646 646 PHE N N 646 115.458 115.458 119.190 -3.732 25722
45 1 1 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.447 -0.046 25722
46 1 1 . 1 1 646 646 PHE H H 646 8.027 8.027 8.118 -0.091 25722
47 1 1 . 1 1 647 647 TRP N N 647 120.228 120.228 120.824 -0.596 25722
48 1 1 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.544 0.036 25722
49 1 1 . 1 1 647 647 TRP H H 647 7.070 7.070 8.624 -1.554 25722
50 1 1 . 1 1 648 648 GLY N N 648 108.000 108.000 103.818 4.182 25722
51 1 1 . 1 1 648 648 GLY H H 648 8.245 8.245 8.373 -0.128 25722
52 1 1 . 1 1 649 649 GLN N N 649 119.516 119.516 120.884 -1.368 25722
53 1 1 . 1 1 649 649 GLN H H 649 7.682 7.682 7.568 0.114 25722
54 1 1 . 1 1 650 650 ASP N N 650 114.599 114.599 124.676 -10.077 25722
55 1 1 . 1 1 650 650 ASP H H 650 7.880 7.880 8.863 -0.983 25722
56 1 1 . 1 1 651 651 HIS N N 651 126.820 126.820 117.523 9.297 25722
57 1 1 . 1 1 651 651 HIS H H 651 8.968 8.968 8.380 0.588 25722
58 1 1 . 1 1 652 652 LYS N N 652 119.747 119.747 119.814 -0.067 25722
59 1 1 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.091 -0.066 25722
60 1 1 . 1 1 653 653 VAL N N 653 120.591 120.591 119.973 0.618 25722
61 1 1 . 1 1 653 653 VAL HA H 653 3.810 3.810 4.193 -0.383 25722
62 1 1 . 1 1 653 653 VAL H H 653 8.290 8.290 8.231 0.059 25722
63 1 1 . 1 1 654 654 ASP N N 654 119.962 119.962 118.757 1.205 25722
64 1 1 . 1 1 654 654 ASP HA H 654 3.994 3.994 3.881 0.113 25722
65 1 1 . 1 1 654 654 ASP H H 654 7.886 7.886 8.291 -0.405 25722
66 1 1 . 1 1 655 655 PHE N N 655 123.205 123.205 119.944 3.261 25722
67 1 1 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.075 0.385 25722
68 1 1 . 1 1 655 655 PHE H H 655 8.357 8.357 7.293 1.064 25722
69 1 1 . 1 1 656 656 ILE N N 656 122.329 122.329 116.930 5.399 25722
70 1 1 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.712 0.418 25722
71 1 1 . 1 1 656 656 ILE H H 656 7.150 7.150 8.459 -1.309 25722
72 1 1 . 1 1 657 657 LEU N N 657 123.105 123.105 119.921 3.184 25722
73 1 1 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.115 0.287 25722
74 1 1 . 1 1 657 657 LEU H H 657 9.010 9.010 7.379 1.631 25722
75 1 1 . 1 1 658 658 GLN N N 658 114.550 114.550 116.723 -2.173 25722
76 1 1 . 1 1 658 658 GLN H H 658 6.964 6.964 7.757 -0.793 25722
77 1 1 . 1 1 659 659 ARG N N 659 116.034 116.034 118.740 -2.706 25722
78 1 1 . 1 1 659 659 ARG H H 659 7.479 7.479 7.347 0.132 25722
79 1 1 . 1 1 660 660 GLU N N 660 117.630 117.630 119.506 -1.876 25722
80 1 1 . 1 1 660 660 GLU H H 660 8.835 8.835 8.641 0.194 25722
81 1 1 . 1 1 662 662 TYR N N 662 119.800 119.800 120.411 -0.611 25722
82 1 1 . 1 1 662 662 TYR H H 662 8.221 8.221 8.238 -0.017 25722
83 1 1 . 1 1 663 663 CYS N N 663 118.319 118.319 118.323 -0.004 25722
84 1 1 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.947 0.383 25722
85 1 1 . 1 1 663 663 CYS H H 663 8.233 8.233 7.586 0.647 25722
86 1 1 . 1 1 664 664 ARG N N 664 114.391 114.391 118.695 -4.304 25722
87 1 1 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.469 -0.383 25722
88 1 1 . 1 1 664 664 ARG H H 664 7.268 7.268 7.946 -0.678 25722
89 1 1 . 1 1 665 665 ASP N N 665 122.897 122.897 118.736 4.161 25722
90 1 1 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.339 0.251 25722
91 1 1 . 1 1 665 665 ASP H H 665 8.620 8.620 7.634 0.986 25722
92 1 1 . 1 1 666 666 ILE N N 666 116.620 116.620 118.534 -1.914 25722
93 1 1 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.726 0.084 25722
94 1 1 . 1 1 666 666 ILE H H 666 6.976 6.976 7.157 -0.181 25722
95 1 1 . 1 1 667 667 ASN N N 667 124.762 124.762 119.425 5.337 25722
96 1 1 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.435 -0.115 25722
97 1 1 . 1 1 667 667 ASN H H 667 7.397 7.397 7.682 -0.285 25722
98 1 1 . 1 1 668 668 GLN N N 668 114.391 114.391 119.437 -5.046 25722
99 1 1 . 1 1 668 668 GLN HA H 668 4.933 4.933 3.806 1.127 25722
100 1 1 . 1 1 668 668 GLN H H 668 7.267 7.267 7.334 -0.067 25722
101 1 1 . 1 1 669 669 LEU N N 669 121.387 121.387 121.107 0.280 25722
102 1 1 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.879 -0.519 25722
103 1 1 . 1 1 669 669 LEU H H 669 8.309 8.309 7.544 0.765 25722
104 1 1 . 1 1 670 670 SER N N 670 112.305 112.305 112.474 -0.169 25722
105 1 1 . 1 1 670 670 SER HA H 670 4.304 4.304 4.245 0.059 25722
106 1 1 . 1 1 670 670 SER H H 670 7.448 7.448 8.515 -1.067 25722
107 1 1 . 1 1 671 671 GLU N N 671 120.749 120.749 121.185 -0.436 25722
108 1 1 . 1 1 671 671 GLU HA H 671 4.011 4.011 4.318 -0.307 25722
109 1 1 . 1 1 671 671 GLU H H 671 7.831 7.831 8.840 -1.009 25722
110 1 1 . 1 1 672 672 ALA N N 672 119.688 119.688 123.172 -3.484 25722
111 1 1 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.413 -0.329 25722
112 1 1 . 1 1 672 672 ALA H H 672 7.728 7.728 8.255 -0.527 25722
113 1 1 . 1 1 673 673 LEU N N 673 119.258 119.258 119.533 -0.275 25722
114 1 1 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.181 -0.811 25722
115 1 1 . 1 1 673 673 LEU H H 673 8.166 8.166 8.580 -0.414 25722
116 1 1 . 1 1 674 674 LEU N N 674 121.499 121.499 119.618 1.881 25722
117 1 1 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.220 -0.394 25722
118 1 1 . 1 1 674 674 LEU H H 674 7.780 7.780 7.580 0.200 25722
119 1 1 . 1 1 675 675 SER N N 675 109.742 109.742 115.457 -5.715 25722
120 1 1 . 1 1 675 675 SER HA H 675 4.694 4.694 4.324 0.370 25722
121 1 1 . 1 1 675 675 SER H H 675 8.277 8.277 8.544 -0.267 25722
122 1 1 . 1 1 676 676 LEU N N 676 121.811 121.811 122.223 -0.412 25722
123 1 1 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.191 -0.146 25722
124 1 1 . 1 1 676 676 LEU H H 676 7.780 7.780 7.862 -0.081 25722
125 1 1 . 1 1 677 677 ASN N N 677 122.526 122.526 117.038 5.488 25722
126 1 1 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.548 0.257 25722
127 1 1 . 1 1 677 677 ASN H H 677 7.710 7.710 7.739 -0.029 25722
128 1 2 . 1 1 628 628 GLY N N 628 113.006 113.006 109.645 3.361 25722
129 1 2 . 1 1 628 628 GLY H H 628 8.727 8.727 8.200 0.527 25722
130 1 2 . 1 1 629 629 ILE N N 629 122.730 122.730 120.462 2.268 25722
131 1 2 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.256 -0.008 25722
132 1 2 . 1 1 629 629 ILE H H 629 8.560 8.560 8.213 0.347 25722
133 1 2 . 1 1 630 630 ARG N N 630 119.880 119.880 120.155 -0.275 25722
134 1 2 . 1 1 630 630 ARG H H 630 8.029 8.029 8.091 -0.062 25722
135 1 2 . 1 1 631 631 LYS N N 631 119.040 119.040 119.217 -0.177 25722
136 1 2 . 1 1 631 631 LYS H H 631 8.664 8.664 8.511 0.153 25722
137 1 2 . 1 1 632 632 THR N N 632 109.950 109.950 114.268 -4.318 25722
138 1 2 . 1 1 632 632 THR H H 632 8.376 8.376 8.137 0.239 25722
139 1 2 . 1 1 633 633 ARG N N 633 120.950 120.950 120.866 0.084 25722
140 1 2 . 1 1 633 633 ARG HA H 633 3.680 3.680 4.005 -0.325 25722
141 1 2 . 1 1 633 633 ARG H H 633 8.017 8.017 8.511 -0.494 25722
142 1 2 . 1 1 634 634 GLU N N 634 118.201 118.201 116.269 1.932 25722
143 1 2 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.268 -0.188 25722
144 1 2 . 1 1 634 634 GLU H H 634 7.260 7.260 8.200 -0.940 25722
145 1 2 . 1 1 635 635 THR N N 635 115.274 115.274 115.262 0.012 25722
146 1 2 . 1 1 635 635 THR H H 635 8.137 8.137 7.674 0.463 25722
147 1 2 . 1 1 636 636 GLU N N 636 115.301 115.301 120.164 -4.863 25722
148 1 2 . 1 1 636 636 GLU HA H 636 4.108 4.108 4.128 -0.020 25722
149 1 2 . 1 1 636 636 GLU H H 636 8.274 8.274 8.204 0.070 25722
150 1 2 . 1 1 637 637 ARG N N 637 120.174 120.174 119.844 0.330 25722
151 1 2 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.132 -0.373 25722
152 1 2 . 1 1 637 637 ARG H H 637 7.810 7.810 7.760 0.050 25722
153 1 2 . 1 1 638 638 LEU N N 638 120.658 120.658 118.949 1.709 25722
154 1 2 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.259 -0.809 25722
155 1 2 . 1 1 638 638 LEU H H 638 8.170 8.170 7.561 0.609 25722
156 1 2 . 1 1 639 639 ARG N N 639 116.325 116.325 117.059 -0.734 25722
157 1 2 . 1 1 639 639 ARG HA H 639 3.924 3.924 4.078 -0.154 25722
158 1 2 . 1 1 639 639 ARG H H 639 7.510 7.510 7.680 -0.170 25722
159 1 2 . 1 1 640 640 ARG N N 640 117.904 117.904 118.006 -0.102 25722
160 1 2 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.172 -0.157 25722
161 1 2 . 1 1 640 640 ARG H H 640 7.925 7.925 8.292 -0.367 25722
162 1 2 . 1 1 641 641 GLN N N 641 118.203 118.203 113.889 4.314 25722
163 1 2 . 1 1 641 641 GLN H H 641 8.682 8.682 7.905 0.777 25722
164 1 2 . 1 1 643 643 LEU N N 643 119.140 119.140 120.187 -1.047 25722
165 1 2 . 1 1 643 643 LEU H H 643 7.139 7.139 8.048 -0.909 25722
166 1 2 . 1 1 644 644 GLU N N 644 120.140 120.140 123.504 -3.364 25722
167 1 2 . 1 1 644 644 GLU H H 644 8.849 8.849 8.627 0.222 25722
168 1 2 . 1 1 645 645 VAL N N 645 119.330 119.330 123.167 -3.837 25722
169 1 2 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.728 0.266 25722
170 1 2 . 1 1 645 645 VAL H H 645 7.986 7.986 7.887 0.099 25722
171 1 2 . 1 1 646 646 PHE N N 646 115.458 115.458 119.262 -3.804 25722
172 1 2 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.232 0.169 25722
173 1 2 . 1 1 646 646 PHE H H 646 8.027 8.027 7.776 0.251 25722
174 1 2 . 1 1 647 647 TRP N N 647 120.228 120.228 121.158 -0.930 25722
175 1 2 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.694 -0.114 25722
176 1 2 . 1 1 647 647 TRP H H 647 7.070 7.070 8.474 -1.404 25722
177 1 2 . 1 1 648 648 GLY N N 648 108.000 108.000 104.333 3.667 25722
178 1 2 . 1 1 648 648 GLY H H 648 8.245 8.245 8.147 0.098 25722
179 1 2 . 1 1 649 649 GLN N N 649 119.516 119.516 121.029 -1.513 25722
180 1 2 . 1 1 649 649 GLN H H 649 7.682 7.682 7.170 0.512 25722
181 1 2 . 1 1 650 650 ASP N N 650 114.599 114.599 125.092 -10.493 25722
182 1 2 . 1 1 650 650 ASP H H 650 7.880 7.880 8.749 -0.869 25722
183 1 2 . 1 1 651 651 HIS N N 651 126.820 126.820 118.328 8.492 25722
184 1 2 . 1 1 651 651 HIS H H 651 8.968 8.968 8.406 0.562 25722
185 1 2 . 1 1 652 652 LYS N N 652 119.747 119.747 117.867 1.880 25722
186 1 2 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.119 -0.094 25722
187 1 2 . 1 1 653 653 VAL N N 653 120.591 120.591 116.531 4.060 25722
188 1 2 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.661 0.149 25722
189 1 2 . 1 1 653 653 VAL H H 653 8.290 8.290 7.780 0.510 25722
190 1 2 . 1 1 654 654 ASP N N 654 119.962 119.962 119.038 0.924 25722
191 1 2 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.771 -0.777 25722
192 1 2 . 1 1 654 654 ASP H H 654 7.886 7.886 8.332 -0.446 25722
193 1 2 . 1 1 655 655 PHE N N 655 123.205 123.205 119.649 3.556 25722
194 1 2 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.254 0.206 25722
195 1 2 . 1 1 655 655 PHE H H 655 8.357 8.357 7.441 0.916 25722
196 1 2 . 1 1 656 656 ILE N N 656 122.329 122.329 117.932 4.397 25722
197 1 2 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.901 0.229 25722
198 1 2 . 1 1 656 656 ILE H H 656 7.150 7.150 8.486 -1.335 25722
199 1 2 . 1 1 657 657 LEU N N 657 123.105 123.105 119.435 3.670 25722
200 1 2 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.219 0.183 25722
201 1 2 . 1 1 657 657 LEU H H 657 9.010 9.010 7.656 1.354 25722
202 1 2 . 1 1 658 658 GLN N N 658 114.550 114.550 117.754 -3.204 25722
203 1 2 . 1 1 658 658 GLN H H 658 6.964 6.964 8.079 -1.115 25722
204 1 2 . 1 1 659 659 ARG N N 659 116.034 116.034 118.666 -2.632 25722
205 1 2 . 1 1 659 659 ARG H H 659 7.479 7.479 8.269 -0.790 25722
206 1 2 . 1 1 660 660 GLU N N 660 117.630 117.630 117.126 0.504 25722
207 1 2 . 1 1 660 660 GLU H H 660 8.835 8.835 8.575 0.260 25722
208 1 2 . 1 1 662 662 TYR N N 662 119.800 119.800 118.514 1.286 25722
209 1 2 . 1 1 662 662 TYR H H 662 8.221 8.221 8.480 -0.259 25722
210 1 2 . 1 1 663 663 CYS N N 663 118.319 118.319 117.028 1.291 25722
211 1 2 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.929 0.401 25722
212 1 2 . 1 1 663 663 CYS H H 663 8.233 8.233 8.323 -0.090 25722
213 1 2 . 1 1 664 664 ARG N N 664 114.391 114.391 120.291 -5.900 25722
214 1 2 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.014 0.072 25722
215 1 2 . 1 1 664 664 ARG H H 664 7.268 7.268 8.005 -0.737 25722
216 1 2 . 1 1 665 665 ASP N N 665 122.897 122.897 119.334 3.563 25722
217 1 2 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.392 0.198 25722
218 1 2 . 1 1 665 665 ASP H H 665 8.620 8.620 7.627 0.993 25722
219 1 2 . 1 1 666 666 ILE N N 666 116.620 116.620 118.467 -1.847 25722
220 1 2 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.718 0.092 25722
221 1 2 . 1 1 666 666 ILE H H 666 6.976 6.976 7.457 -0.481 25722
222 1 2 . 1 1 667 667 ASN N N 667 124.762 124.762 119.210 5.552 25722
223 1 2 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.328 -0.008 25722
224 1 2 . 1 1 667 667 ASN H H 667 7.397 7.397 7.701 -0.304 25722
225 1 2 . 1 1 668 668 GLN N N 668 114.391 114.391 119.388 -4.997 25722
226 1 2 . 1 1 668 668 GLN HA H 668 4.933 4.933 3.799 1.134 25722
227 1 2 . 1 1 668 668 GLN H H 668 7.267 7.267 7.621 -0.354 25722
228 1 2 . 1 1 669 669 LEU N N 669 121.387 121.387 120.751 0.636 25722
229 1 2 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.855 -0.495 25722
230 1 2 . 1 1 669 669 LEU H H 669 8.309 8.309 7.554 0.755 25722
231 1 2 . 1 1 670 670 SER N N 670 112.305 112.305 112.220 0.085 25722
232 1 2 . 1 1 670 670 SER HA H 670 4.304 4.304 4.063 0.241 25722
233 1 2 . 1 1 670 670 SER H H 670 7.448 7.448 8.493 -1.045 25722
234 1 2 . 1 1 671 671 GLU N N 671 120.749 120.749 120.702 0.047 25722
235 1 2 . 1 1 671 671 GLU HA H 671 4.011 4.011 3.995 0.016 25722
236 1 2 . 1 1 671 671 GLU H H 671 7.831 7.831 7.292 0.539 25722
237 1 2 . 1 1 672 672 ALA N N 672 119.688 119.688 121.811 -2.123 25722
238 1 2 . 1 1 672 672 ALA HA H 672 4.084 4.084 3.546 0.538 25722
239 1 2 . 1 1 672 672 ALA H H 672 7.728 7.728 6.550 1.178 25722
240 1 2 . 1 1 673 673 LEU N N 673 119.258 119.258 119.072 0.186 25722
241 1 2 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.060 -0.690 25722
242 1 2 . 1 1 673 673 LEU H H 673 8.166 8.166 8.196 -0.030 25722
243 1 2 . 1 1 674 674 LEU N N 674 121.499 121.499 119.116 2.383 25722
244 1 2 . 1 1 674 674 LEU HA H 674 3.826 3.826 3.983 -0.157 25722
245 1 2 . 1 1 674 674 LEU H H 674 7.780 7.780 7.445 0.335 25722
246 1 2 . 1 1 675 675 SER N N 675 109.742 109.742 114.773 -5.031 25722
247 1 2 . 1 1 675 675 SER HA H 675 4.694 4.694 4.257 0.437 25722
248 1 2 . 1 1 675 675 SER H H 675 8.277 8.277 8.408 -0.131 25722
249 1 2 . 1 1 676 676 LEU N N 676 121.811 121.811 121.289 0.522 25722
250 1 2 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.163 -0.118 25722
251 1 2 . 1 1 676 676 LEU H H 676 7.780 7.780 7.668 0.112 25722
252 1 2 . 1 1 677 677 ASN N N 677 122.526 122.526 116.851 5.675 25722
253 1 2 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.607 0.198 25722
254 1 2 . 1 1 677 677 ASN H H 677 7.710 7.710 7.657 0.053 25722
255 1 3 . 1 1 628 628 GLY N N 628 113.006 113.006 108.103 4.903 25722
256 1 3 . 1 1 628 628 GLY H H 628 8.727 8.727 8.275 0.452 25722
257 1 3 . 1 1 629 629 ILE N N 629 122.730 122.730 116.425 6.305 25722
258 1 3 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.548 -0.300 25722
259 1 3 . 1 1 629 629 ILE H H 629 8.560 8.560 8.106 0.454 25722
260 1 3 . 1 1 630 630 ARG N N 630 119.880 119.880 119.846 0.034 25722
261 1 3 . 1 1 630 630 ARG H H 630 8.029 8.029 7.959 0.070 25722
262 1 3 . 1 1 631 631 LYS N N 631 119.040 119.040 116.142 2.898 25722
263 1 3 . 1 1 631 631 LYS H H 631 8.664 8.664 8.296 0.368 25722
264 1 3 . 1 1 632 632 THR N N 632 109.950 109.950 113.163 -3.213 25722
265 1 3 . 1 1 632 632 THR H H 632 8.376 8.376 8.220 0.156 25722
266 1 3 . 1 1 633 633 ARG N N 633 120.950 120.950 118.942 2.008 25722
267 1 3 . 1 1 633 633 ARG HA H 633 3.680 3.680 3.982 -0.302 25722
268 1 3 . 1 1 633 633 ARG H H 633 8.017 8.017 8.450 -0.433 25722
269 1 3 . 1 1 634 634 GLU N N 634 118.201 118.201 116.839 1.362 25722
270 1 3 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.215 -0.135 25722
271 1 3 . 1 1 634 634 GLU H H 634 7.260 7.260 8.187 -0.927 25722
272 1 3 . 1 1 635 635 THR N N 635 115.274 115.274 115.537 -0.263 25722
273 1 3 . 1 1 635 635 THR H H 635 8.137 8.137 7.554 0.583 25722
274 1 3 . 1 1 636 636 GLU N N 636 115.301 115.301 120.377 -5.076 25722
275 1 3 . 1 1 636 636 GLU HA H 636 4.108 4.108 3.864 0.244 25722
276 1 3 . 1 1 636 636 GLU H H 636 8.274 8.274 7.954 0.320 25722
277 1 3 . 1 1 637 637 ARG N N 637 120.174 120.174 120.459 -0.285 25722
278 1 3 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.234 -0.475 25722
279 1 3 . 1 1 637 637 ARG H H 637 7.810 7.810 7.542 0.268 25722
280 1 3 . 1 1 638 638 LEU N N 638 120.658 120.658 121.851 -1.193 25722
281 1 3 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.523 -1.073 25722
282 1 3 . 1 1 638 638 LEU H H 638 8.170 8.170 7.783 0.387 25722
283 1 3 . 1 1 639 639 ARG N N 639 116.325 116.325 117.358 -1.033 25722
284 1 3 . 1 1 639 639 ARG HA H 639 3.924 3.924 4.105 -0.181 25722
285 1 3 . 1 1 639 639 ARG H H 639 7.510 7.510 7.788 -0.278 25722
286 1 3 . 1 1 640 640 ARG N N 640 117.904 117.904 118.008 -0.104 25722
287 1 3 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.098 -0.083 25722
288 1 3 . 1 1 640 640 ARG H H 640 7.925 7.925 7.582 0.343 25722
289 1 3 . 1 1 641 641 GLN N N 641 118.203 118.203 117.657 0.546 25722
290 1 3 . 1 1 641 641 GLN H H 641 8.682 8.682 7.730 0.952 25722
291 1 3 . 1 1 643 643 LEU N N 643 119.140 119.140 120.389 -1.249 25722
292 1 3 . 1 1 643 643 LEU H H 643 7.139 7.139 7.675 -0.536 25722
293 1 3 . 1 1 644 644 GLU N N 644 120.140 120.140 125.783 -5.643 25722
294 1 3 . 1 1 644 644 GLU H H 644 8.849 8.849 8.553 0.296 25722
295 1 3 . 1 1 645 645 VAL N N 645 119.330 119.330 124.942 -5.612 25722
296 1 3 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.766 0.228 25722
297 1 3 . 1 1 645 645 VAL H H 645 7.986 7.986 8.256 -0.270 25722
298 1 3 . 1 1 646 646 PHE N N 646 115.458 115.458 118.708 -3.250 25722
299 1 3 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.388 0.013 25722
300 1 3 . 1 1 646 646 PHE H H 646 8.027 8.027 7.909 0.118 25722
301 1 3 . 1 1 647 647 TRP N N 647 120.228 120.228 120.339 -0.111 25722
302 1 3 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.713 -0.133 25722
303 1 3 . 1 1 647 647 TRP H H 647 7.070 7.070 7.898 -0.828 25722
304 1 3 . 1 1 648 648 GLY N N 648 108.000 108.000 102.480 5.520 25722
305 1 3 . 1 1 648 648 GLY H H 648 8.245 8.245 8.214 0.031 25722
306 1 3 . 1 1 649 649 GLN N N 649 119.516 119.516 119.389 0.127 25722
307 1 3 . 1 1 649 649 GLN H H 649 7.682 7.682 7.826 -0.144 25722
308 1 3 . 1 1 650 650 ASP N N 650 114.599 114.599 114.599 0.000 25722
309 1 3 . 1 1 650 650 ASP H H 650 7.880 7.880 8.028 -0.148 25722
310 1 3 . 1 1 651 651 HIS N N 651 126.820 126.820 119.806 7.014 25722
311 1 3 . 1 1 651 651 HIS H H 651 8.968 8.968 8.474 0.494 25722
312 1 3 . 1 1 652 652 LYS N N 652 119.747 119.747 118.836 0.911 25722
313 1 3 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.031 -0.006 25722
314 1 3 . 1 1 653 653 VAL N N 653 120.591 120.591 115.353 5.238 25722
315 1 3 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.913 -0.103 25722
316 1 3 . 1 1 653 653 VAL H H 653 8.290 8.290 7.882 0.408 25722
317 1 3 . 1 1 654 654 ASP N N 654 119.962 119.962 120.104 -0.142 25722
318 1 3 . 1 1 654 654 ASP HA H 654 3.994 3.994 2.384 1.610 25722
319 1 3 . 1 1 654 654 ASP H H 654 7.886 7.886 7.939 -0.053 25722
320 1 3 . 1 1 655 655 PHE N N 655 123.205 123.205 119.167 4.038 25722
321 1 3 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.041 0.419 25722
322 1 3 . 1 1 655 655 PHE H H 655 8.357 8.357 7.190 1.167 25722
323 1 3 . 1 1 656 656 ILE N N 656 122.329 122.329 118.285 4.044 25722
324 1 3 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.744 0.386 25722
325 1 3 . 1 1 656 656 ILE H H 656 7.150 7.150 8.001 -0.851 25722
326 1 3 . 1 1 657 657 LEU N N 657 123.105 123.105 120.085 3.020 25722
327 1 3 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.130 0.272 25722
328 1 3 . 1 1 657 657 LEU H H 657 9.010 9.010 7.761 1.249 25722
329 1 3 . 1 1 658 658 GLN N N 658 114.550 114.550 116.641 -2.091 25722
330 1 3 . 1 1 658 658 GLN H H 658 6.964 6.964 7.621 -0.657 25722
331 1 3 . 1 1 659 659 ARG N N 659 116.034 116.034 118.656 -2.622 25722
332 1 3 . 1 1 659 659 ARG H H 659 7.479 7.479 7.305 0.174 25722
333 1 3 . 1 1 660 660 GLU N N 660 117.630 117.630 118.716 -1.086 25722
334 1 3 . 1 1 660 660 GLU H H 660 8.835 8.835 8.572 0.263 25722
335 1 3 . 1 1 662 662 TYR N N 662 119.800 119.800 120.551 -0.751 25722
336 1 3 . 1 1 662 662 TYR H H 662 8.221 8.221 8.638 -0.417 25722
337 1 3 . 1 1 663 663 CYS N N 663 118.319 118.319 117.126 1.193 25722
338 1 3 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.990 0.340 25722
339 1 3 . 1 1 663 663 CYS H H 663 8.233 8.233 8.480 -0.247 25722
340 1 3 . 1 1 664 664 ARG N N 664 114.391 114.391 119.117 -4.726 25722
341 1 3 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.088 -0.002 25722
342 1 3 . 1 1 664 664 ARG H H 664 7.268 7.268 8.165 -0.897 25722
343 1 3 . 1 1 665 665 ASP N N 665 122.897 122.897 119.587 3.310 25722
344 1 3 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.334 0.256 25722
345 1 3 . 1 1 665 665 ASP H H 665 8.620 8.620 7.751 0.869 25722
346 1 3 . 1 1 666 666 ILE N N 666 116.620 116.620 119.190 -2.570 25722
347 1 3 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.806 0.004 25722
348 1 3 . 1 1 666 666 ILE H H 666 6.976 6.976 7.356 -0.380 25722
349 1 3 . 1 1 667 667 ASN N N 667 124.762 124.762 119.193 5.569 25722
350 1 3 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.390 -0.070 25722
351 1 3 . 1 1 667 667 ASN H H 667 7.397 7.397 7.677 -0.280 25722
352 1 3 . 1 1 668 668 GLN N N 668 114.391 114.391 120.201 -5.810 25722
353 1 3 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.781 0.152 25722
354 1 3 . 1 1 668 668 GLN H H 668 7.267 7.267 7.804 -0.537 25722
355 1 3 . 1 1 669 669 LEU N N 669 121.387 121.387 120.921 0.466 25722
356 1 3 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.885 -0.525 25722
357 1 3 . 1 1 669 669 LEU H H 669 8.309 8.309 7.624 0.685 25722
358 1 3 . 1 1 670 670 SER N N 670 112.305 112.305 112.676 -0.371 25722
359 1 3 . 1 1 670 670 SER HA H 670 4.304 4.304 4.235 0.069 25722
360 1 3 . 1 1 670 670 SER H H 670 7.448 7.448 8.650 -1.202 25722
361 1 3 . 1 1 671 671 GLU N N 671 120.749 120.749 121.561 -0.812 25722
362 1 3 . 1 1 671 671 GLU HA H 671 4.011 4.011 3.898 0.113 25722
363 1 3 . 1 1 671 671 GLU H H 671 7.831 7.831 8.610 -0.779 25722
364 1 3 . 1 1 672 672 ALA N N 672 119.688 119.688 122.627 -2.939 25722
365 1 3 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.116 -0.032 25722
366 1 3 . 1 1 672 672 ALA H H 672 7.728 7.728 7.789 -0.061 25722
367 1 3 . 1 1 673 673 LEU N N 673 119.258 119.258 119.231 0.027 25722
368 1 3 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.120 -0.750 25722
369 1 3 . 1 1 673 673 LEU H H 673 8.166 8.166 8.427 -0.261 25722
370 1 3 . 1 1 674 674 LEU N N 674 121.499 121.499 119.125 2.374 25722
371 1 3 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.157 -0.331 25722
372 1 3 . 1 1 674 674 LEU H H 674 7.780 7.780 7.503 0.277 25722
373 1 3 . 1 1 675 675 SER N N 675 109.742 109.742 114.842 -5.100 25722
374 1 3 . 1 1 675 675 SER HA H 675 4.694 4.694 4.276 0.418 25722
375 1 3 . 1 1 675 675 SER H H 675 8.277 8.277 8.317 -0.040 25722
376 1 3 . 1 1 676 676 LEU N N 676 121.811 121.811 121.581 0.230 25722
377 1 3 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.158 -0.113 25722
378 1 3 . 1 1 676 676 LEU H H 676 7.780 7.780 7.712 0.068 25722
379 1 3 . 1 1 677 677 ASN N N 677 122.526 122.526 116.727 5.799 25722
380 1 3 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.537 0.268 25722
381 1 3 . 1 1 677 677 ASN H H 677 7.710 7.710 7.690 0.020 25722
382 1 4 . 1 1 628 628 GLY N N 628 113.006 113.006 107.752 5.254 25722
383 1 4 . 1 1 628 628 GLY H H 628 8.727 8.727 7.888 0.839 25722
384 1 4 . 1 1 629 629 ILE N N 629 122.730 122.730 117.218 5.512 25722
385 1 4 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.591 -0.343 25722
386 1 4 . 1 1 629 629 ILE H H 629 8.560 8.560 7.947 0.613 25722
387 1 4 . 1 1 630 630 ARG N N 630 119.880 119.880 120.833 -0.953 25722
388 1 4 . 1 1 630 630 ARG H H 630 8.029 8.029 8.537 -0.508 25722
389 1 4 . 1 1 631 631 LYS N N 631 119.040 119.040 118.515 0.525 25722
390 1 4 . 1 1 631 631 LYS H H 631 8.664 8.664 8.243 0.421 25722
391 1 4 . 1 1 632 632 THR N N 632 109.950 109.950 112.446 -2.496 25722
392 1 4 . 1 1 632 632 THR H H 632 8.376 8.376 8.097 0.279 25722
393 1 4 . 1 1 633 633 ARG N N 633 120.950 120.950 122.789 -1.839 25722
394 1 4 . 1 1 633 633 ARG HA H 633 3.680 3.680 4.006 -0.326 25722
395 1 4 . 1 1 633 633 ARG H H 633 8.017 8.017 8.614 -0.597 25722
396 1 4 . 1 1 634 634 GLU N N 634 118.201 118.201 116.976 1.225 25722
397 1 4 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.176 -0.096 25722
398 1 4 . 1 1 634 634 GLU H H 634 7.260 7.260 8.312 -1.052 25722
399 1 4 . 1 1 635 635 THR N N 635 115.274 115.274 114.748 0.526 25722
400 1 4 . 1 1 635 635 THR H H 635 8.137 8.137 7.609 0.528 25722
401 1 4 . 1 1 636 636 GLU N N 636 115.301 115.301 121.724 -6.423 25722
402 1 4 . 1 1 636 636 GLU HA H 636 4.108 4.108 4.445 -0.337 25722
403 1 4 . 1 1 636 636 GLU H H 636 8.274 8.274 8.425 -0.151 25722
404 1 4 . 1 1 637 637 ARG N N 637 120.174 120.174 118.757 1.417 25722
405 1 4 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.089 -0.330 25722
406 1 4 . 1 1 637 637 ARG H H 637 7.810 7.810 7.687 0.123 25722
407 1 4 . 1 1 638 638 LEU N N 638 120.658 120.658 120.775 -0.117 25722
408 1 4 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.067 -0.617 25722
409 1 4 . 1 1 638 638 LEU H H 638 8.170 8.170 8.110 0.060 25722
410 1 4 . 1 1 639 639 ARG N N 639 116.325 116.325 117.420 -1.095 25722
411 1 4 . 1 1 639 639 ARG HA H 639 3.924 3.924 3.825 0.099 25722
412 1 4 . 1 1 639 639 ARG H H 639 7.510 7.510 7.730 -0.220 25722
413 1 4 . 1 1 640 640 ARG N N 640 117.904 117.904 117.663 0.241 25722
414 1 4 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.166 -0.151 25722
415 1 4 . 1 1 640 640 ARG H H 640 7.925 7.925 8.106 -0.181 25722
416 1 4 . 1 1 641 641 GLN N N 641 118.203 118.203 113.353 4.850 25722
417 1 4 . 1 1 641 641 GLN H H 641 8.682 8.682 8.023 0.659 25722
418 1 4 . 1 1 643 643 LEU N N 643 119.140 119.140 119.454 -0.314 25722
419 1 4 . 1 1 643 643 LEU H H 643 7.139 7.139 8.018 -0.879 25722
420 1 4 . 1 1 644 644 GLU N N 644 120.140 120.140 122.705 -2.565 25722
421 1 4 . 1 1 644 644 GLU H H 644 8.849 8.849 8.709 0.140 25722
422 1 4 . 1 1 645 645 VAL N N 645 119.330 119.330 125.246 -5.916 25722
423 1 4 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.785 0.209 25722
424 1 4 . 1 1 645 645 VAL H H 645 7.986 7.986 7.817 0.169 25722
425 1 4 . 1 1 646 646 PHE N N 646 115.458 115.458 118.062 -2.604 25722
426 1 4 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.425 -0.024 25722
427 1 4 . 1 1 646 646 PHE H H 646 8.027 8.027 8.139 -0.112 25722
428 1 4 . 1 1 647 647 TRP N N 647 120.228 120.228 120.437 -0.209 25722
429 1 4 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.500 0.080 25722
430 1 4 . 1 1 647 647 TRP H H 647 7.070 7.070 8.487 -1.417 25722
431 1 4 . 1 1 648 648 GLY N N 648 108.000 108.000 104.680 3.320 25722
432 1 4 . 1 1 648 648 GLY H H 648 8.245 8.245 8.163 0.082 25722
433 1 4 . 1 1 649 649 GLN N N 649 119.516 119.516 118.056 1.460 25722
434 1 4 . 1 1 649 649 GLN H H 649 7.682 7.682 8.480 -0.798 25722
435 1 4 . 1 1 650 650 ASP N N 650 114.599 114.599 115.456 -0.857 25722
436 1 4 . 1 1 650 650 ASP H H 650 7.880 7.880 8.113 -0.233 25722
437 1 4 . 1 1 651 651 HIS N N 651 126.820 126.820 119.933 6.887 25722
438 1 4 . 1 1 651 651 HIS H H 651 8.968 8.968 8.583 0.385 25722
439 1 4 . 1 1 652 652 LYS N N 652 119.747 119.747 117.828 1.919 25722
440 1 4 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.174 -0.149 25722
441 1 4 . 1 1 653 653 VAL N N 653 120.591 120.591 115.425 5.166 25722
442 1 4 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.782 0.028 25722
443 1 4 . 1 1 653 653 VAL H H 653 8.290 8.290 7.578 0.712 25722
444 1 4 . 1 1 654 654 ASP N N 654 119.962 119.962 119.096 0.866 25722
445 1 4 . 1 1 654 654 ASP HA H 654 3.994 3.994 5.129 -1.135 25722
446 1 4 . 1 1 654 654 ASP H H 654 7.886 7.886 8.397 -0.511 25722
447 1 4 . 1 1 655 655 PHE N N 655 123.205 123.205 120.341 2.864 25722
448 1 4 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.246 0.214 25722
449 1 4 . 1 1 655 655 PHE H H 655 8.357 8.357 7.544 0.813 25722
450 1 4 . 1 1 656 656 ILE N N 656 122.329 122.329 117.091 5.238 25722
451 1 4 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.799 0.331 25722
452 1 4 . 1 1 656 656 ILE H H 656 7.150 7.150 8.886 -1.736 25722
453 1 4 . 1 1 657 657 LEU N N 657 123.105 123.105 120.143 2.962 25722
454 1 4 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.320 0.082 25722
455 1 4 . 1 1 657 657 LEU H H 657 9.010 9.010 7.604 1.406 25722
456 1 4 . 1 1 658 658 GLN N N 658 114.550 114.550 117.488 -2.938 25722
457 1 4 . 1 1 658 658 GLN H H 658 6.964 6.964 8.322 -1.358 25722
458 1 4 . 1 1 659 659 ARG N N 659 116.034 116.034 118.873 -2.839 25722
459 1 4 . 1 1 659 659 ARG H H 659 7.479 7.479 7.402 0.077 25722
460 1 4 . 1 1 660 660 GLU N N 660 117.630 117.630 119.498 -1.868 25722
461 1 4 . 1 1 660 660 GLU H H 660 8.835 8.835 8.717 0.118 25722
462 1 4 . 1 1 662 662 TYR N N 662 119.800 119.800 120.733 -0.933 25722
463 1 4 . 1 1 662 662 TYR H H 662 8.221 8.221 8.609 -0.388 25722
464 1 4 . 1 1 663 663 CYS N N 663 118.319 118.319 116.681 1.638 25722
465 1 4 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.953 0.377 25722
466 1 4 . 1 1 663 663 CYS H H 663 8.233 8.233 8.484 -0.251 25722
467 1 4 . 1 1 664 664 ARG N N 664 114.391 114.391 119.424 -5.033 25722
468 1 4 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.166 -0.080 25722
469 1 4 . 1 1 664 664 ARG H H 664 7.268 7.268 8.340 -1.072 25722
470 1 4 . 1 1 665 665 ASP N N 665 122.897 122.897 119.464 3.433 25722
471 1 4 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.365 0.225 25722
472 1 4 . 1 1 665 665 ASP H H 665 8.620 8.620 7.590 1.030 25722
473 1 4 . 1 1 666 666 ILE N N 666 116.620 116.620 119.347 -2.727 25722
474 1 4 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.637 0.173 25722
475 1 4 . 1 1 666 666 ILE H H 666 6.976 6.976 7.363 -0.387 25722
476 1 4 . 1 1 667 667 ASN N N 667 124.762 124.762 118.259 6.503 25722
477 1 4 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.230 0.090 25722
478 1 4 . 1 1 667 667 ASN H H 667 7.397 7.397 7.638 -0.241 25722
479 1 4 . 1 1 668 668 GLN N N 668 114.391 114.391 119.587 -5.196 25722
480 1 4 . 1 1 668 668 GLN HA H 668 4.933 4.933 2.886 2.046 25722
481 1 4 . 1 1 668 668 GLN H H 668 7.267 7.267 7.384 -0.117 25722
482 1 4 . 1 1 669 669 LEU N N 669 121.387 121.387 120.148 1.239 25722
483 1 4 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.866 -0.506 25722
484 1 4 . 1 1 669 669 LEU H H 669 8.309 8.309 7.474 0.835 25722
485 1 4 . 1 1 670 670 SER N N 670 112.305 112.305 113.063 -0.758 25722
486 1 4 . 1 1 670 670 SER HA H 670 4.304 4.304 4.117 0.187 25722
487 1 4 . 1 1 670 670 SER H H 670 7.448 7.448 8.387 -0.939 25722
488 1 4 . 1 1 671 671 GLU N N 671 120.749 120.749 120.274 0.475 25722
489 1 4 . 1 1 671 671 GLU HA H 671 4.011 4.011 4.059 -0.048 25722
490 1 4 . 1 1 671 671 GLU H H 671 7.831 7.831 8.551 -0.720 25722
491 1 4 . 1 1 672 672 ALA N N 672 119.688 119.688 123.763 -4.075 25722
492 1 4 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.270 -0.186 25722
493 1 4 . 1 1 672 672 ALA H H 672 7.728 7.728 6.736 0.992 25722
494 1 4 . 1 1 673 673 LEU N N 673 119.258 119.258 118.279 0.979 25722
495 1 4 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.037 -0.667 25722
496 1 4 . 1 1 673 673 LEU H H 673 8.166 8.166 7.464 0.702 25722
497 1 4 . 1 1 674 674 LEU N N 674 121.499 121.499 119.792 1.707 25722
498 1 4 . 1 1 674 674 LEU HA H 674 3.826 3.826 3.985 -0.159 25722
499 1 4 . 1 1 674 674 LEU H H 674 7.780 7.780 7.497 0.283 25722
500 1 4 . 1 1 675 675 SER N N 675 109.742 109.742 115.307 -5.565 25722
501 1 4 . 1 1 675 675 SER HA H 675 4.694 4.694 4.300 0.394 25722
502 1 4 . 1 1 675 675 SER H H 675 8.277 8.277 8.402 -0.125 25722
503 1 4 . 1 1 676 676 LEU N N 676 121.811 121.811 122.243 -0.432 25722
504 1 4 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.315 -0.270 25722
505 1 4 . 1 1 676 676 LEU H H 676 7.780 7.780 7.967 -0.187 25722
506 1 4 . 1 1 677 677 ASN N N 677 122.526 122.526 116.564 5.962 25722
507 1 4 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.587 0.218 25722
508 1 4 . 1 1 677 677 ASN H H 677 7.710 7.710 7.780 -0.070 25722
509 1 5 . 1 1 628 628 GLY N N 628 113.006 113.006 107.844 5.162 25722
510 1 5 . 1 1 628 628 GLY H H 628 8.727 8.727 8.384 0.343 25722
511 1 5 . 1 1 629 629 ILE N N 629 122.730 122.730 119.472 3.258 25722
512 1 5 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.470 -0.222 25722
513 1 5 . 1 1 629 629 ILE H H 629 8.560 8.560 8.102 0.458 25722
514 1 5 . 1 1 630 630 ARG N N 630 119.880 119.880 127.573 -7.693 25722
515 1 5 . 1 1 630 630 ARG H H 630 8.029 8.029 8.679 -0.650 25722
516 1 5 . 1 1 631 631 LYS N N 631 119.040 119.040 122.066 -3.026 25722
517 1 5 . 1 1 631 631 LYS H H 631 8.664 8.664 8.389 0.275 25722
518 1 5 . 1 1 632 632 THR N N 632 109.950 109.950 113.200 -3.250 25722
519 1 5 . 1 1 632 632 THR H H 632 8.376 8.376 8.481 -0.105 25722
520 1 5 . 1 1 633 633 ARG N N 633 120.950 120.950 121.037 -0.087 25722
521 1 5 . 1 1 633 633 ARG HA H 633 3.680 3.680 3.879 -0.199 25722
522 1 5 . 1 1 633 633 ARG H H 633 8.017 8.017 8.582 -0.565 25722
523 1 5 . 1 1 634 634 GLU N N 634 118.201 118.201 116.565 1.636 25722
524 1 5 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.187 -0.107 25722
525 1 5 . 1 1 634 634 GLU H H 634 7.260 7.260 8.247 -0.987 25722
526 1 5 . 1 1 635 635 THR N N 635 115.274 115.274 115.022 0.252 25722
527 1 5 . 1 1 635 635 THR H H 635 8.137 8.137 7.406 0.731 25722
528 1 5 . 1 1 636 636 GLU N N 636 115.301 115.301 119.657 -4.356 25722
529 1 5 . 1 1 636 636 GLU HA H 636 4.108 4.108 3.844 0.264 25722
530 1 5 . 1 1 636 636 GLU H H 636 8.274 8.274 7.774 0.500 25722
531 1 5 . 1 1 637 637 ARG N N 637 120.174 120.174 120.278 -0.104 25722
532 1 5 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.114 -0.355 25722
533 1 5 . 1 1 637 637 ARG H H 637 7.810 7.810 7.567 0.243 25722
534 1 5 . 1 1 638 638 LEU N N 638 120.658 120.658 120.171 0.487 25722
535 1 5 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.344 -0.894 25722
536 1 5 . 1 1 638 638 LEU H H 638 8.170 8.170 7.901 0.269 25722
537 1 5 . 1 1 639 639 ARG N N 639 116.325 116.325 117.671 -1.346 25722
538 1 5 . 1 1 639 639 ARG HA H 639 3.924 3.924 4.118 -0.194 25722
539 1 5 . 1 1 639 639 ARG H H 639 7.510 7.510 7.429 0.081 25722
540 1 5 . 1 1 640 640 ARG N N 640 117.904 117.904 118.409 -0.505 25722
541 1 5 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.122 -0.107 25722
542 1 5 . 1 1 640 640 ARG H H 640 7.925 7.925 7.759 0.166 25722
543 1 5 . 1 1 641 641 GLN N N 641 118.203 118.203 117.509 0.694 25722
544 1 5 . 1 1 641 641 GLN H H 641 8.682 8.682 7.912 0.770 25722
545 1 5 . 1 1 643 643 LEU N N 643 119.140 119.140 122.635 -3.495 25722
546 1 5 . 1 1 643 643 LEU H H 643 7.139 7.139 7.516 -0.377 25722
547 1 5 . 1 1 644 644 GLU N N 644 120.140 120.140 125.280 -5.140 25722
548 1 5 . 1 1 644 644 GLU H H 644 8.849 8.849 8.306 0.543 25722
549 1 5 . 1 1 645 645 VAL N N 645 119.330 119.330 122.242 -2.912 25722
550 1 5 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.799 0.195 25722
551 1 5 . 1 1 645 645 VAL H H 645 7.986 7.986 7.799 0.187 25722
552 1 5 . 1 1 646 646 PHE N N 646 115.458 115.458 117.964 -2.506 25722
553 1 5 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.426 -0.025 25722
554 1 5 . 1 1 646 646 PHE H H 646 8.027 8.027 8.143 -0.116 25722
555 1 5 . 1 1 647 647 TRP N N 647 120.228 120.228 121.269 -1.041 25722
556 1 5 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.708 -0.128 25722
557 1 5 . 1 1 647 647 TRP H H 647 7.070 7.070 8.007 -0.937 25722
558 1 5 . 1 1 648 648 GLY N N 648 108.000 108.000 105.635 2.365 25722
559 1 5 . 1 1 648 648 GLY H H 648 8.245 8.245 8.828 -0.583 25722
560 1 5 . 1 1 649 649 GLN N N 649 119.516 119.516 123.126 -3.610 25722
561 1 5 . 1 1 649 649 GLN H H 649 7.682 7.682 7.710 -0.028 25722
562 1 5 . 1 1 650 650 ASP N N 650 114.599 114.599 122.579 -7.980 25722
563 1 5 . 1 1 650 650 ASP H H 650 7.880 7.880 8.403 -0.523 25722
564 1 5 . 1 1 651 651 HIS N N 651 126.820 126.820 119.426 7.394 25722
565 1 5 . 1 1 651 651 HIS H H 651 8.968 8.968 8.443 0.525 25722
566 1 5 . 1 1 652 652 LYS N N 652 119.747 119.747 118.168 1.579 25722
567 1 5 . 1 1 652 652 LYS HA H 652 4.025 4.025 3.986 0.039 25722
568 1 5 . 1 1 653 653 VAL N N 653 120.591 120.591 115.574 5.017 25722
569 1 5 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.510 0.300 25722
570 1 5 . 1 1 653 653 VAL H H 653 8.290 8.290 7.648 0.642 25722
571 1 5 . 1 1 654 654 ASP N N 654 119.962 119.962 118.733 1.229 25722
572 1 5 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.131 -0.137 25722
573 1 5 . 1 1 654 654 ASP H H 654 7.886 7.886 7.743 0.143 25722
574 1 5 . 1 1 655 655 PHE N N 655 123.205 123.205 119.767 3.438 25722
575 1 5 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.095 0.365 25722
576 1 5 . 1 1 655 655 PHE H H 655 8.357 8.357 7.100 1.257 25722
577 1 5 . 1 1 656 656 ILE N N 656 122.329 122.329 117.293 5.036 25722
578 1 5 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.800 0.330 25722
579 1 5 . 1 1 656 656 ILE H H 656 7.150 7.150 8.250 -1.100 25722
580 1 5 . 1 1 657 657 LEU N N 657 123.105 123.105 119.551 3.554 25722
581 1 5 . 1 1 657 657 LEU HA H 657 4.402 4.402 3.979 0.423 25722
582 1 5 . 1 1 657 657 LEU H H 657 9.010 9.010 7.917 1.093 25722
583 1 5 . 1 1 658 658 GLN N N 658 114.550 114.550 115.705 -1.155 25722
584 1 5 . 1 1 658 658 GLN H H 658 6.964 6.964 7.994 -1.030 25722
585 1 5 . 1 1 659 659 ARG N N 659 116.034 116.034 117.314 -1.280 25722
586 1 5 . 1 1 659 659 ARG H H 659 7.479 7.479 8.320 -0.841 25722
587 1 5 . 1 1 660 660 GLU N N 660 117.630 117.630 119.360 -1.730 25722
588 1 5 . 1 1 660 660 GLU H H 660 8.835 8.835 8.405 0.430 25722
589 1 5 . 1 1 662 662 TYR N N 662 119.800 119.800 122.628 -2.828 25722
590 1 5 . 1 1 662 662 TYR H H 662 8.221 8.221 8.643 -0.422 25722
591 1 5 . 1 1 663 663 CYS N N 663 118.319 118.319 116.043 2.276 25722
592 1 5 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.995 0.335 25722
593 1 5 . 1 1 663 663 CYS H H 663 8.233 8.233 8.568 -0.335 25722
594 1 5 . 1 1 664 664 ARG N N 664 114.391 114.391 119.593 -5.202 25722
595 1 5 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.146 -0.060 25722
596 1 5 . 1 1 664 664 ARG H H 664 7.268 7.268 8.114 -0.846 25722
597 1 5 . 1 1 665 665 ASP N N 665 122.897 122.897 118.939 3.958 25722
598 1 5 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.364 0.226 25722
599 1 5 . 1 1 665 665 ASP H H 665 8.620 8.620 7.917 0.703 25722
600 1 5 . 1 1 666 666 ILE N N 666 116.620 116.620 116.164 0.456 25722
601 1 5 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.876 -0.066 25722
602 1 5 . 1 1 666 666 ILE H H 666 6.976 6.976 7.392 -0.416 25722
603 1 5 . 1 1 667 667 ASN N N 667 124.762 124.762 120.689 4.073 25722
604 1 5 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.409 -0.089 25722
605 1 5 . 1 1 667 667 ASN H H 667 7.397 7.397 7.702 -0.305 25722
606 1 5 . 1 1 668 668 GLN N N 668 114.391 114.391 119.963 -5.572 25722
607 1 5 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.812 0.121 25722
608 1 5 . 1 1 668 668 GLN H H 668 7.267 7.267 7.816 -0.549 25722
609 1 5 . 1 1 669 669 LEU N N 669 121.387 121.387 121.201 0.186 25722
610 1 5 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.906 -0.546 25722
611 1 5 . 1 1 669 669 LEU H H 669 8.309 8.309 7.688 0.621 25722
612 1 5 . 1 1 670 670 SER N N 670 112.305 112.305 112.114 0.191 25722
613 1 5 . 1 1 670 670 SER HA H 670 4.304 4.304 4.215 0.089 25722
614 1 5 . 1 1 670 670 SER H H 670 7.448 7.448 8.614 -1.166 25722
615 1 5 . 1 1 671 671 GLU N N 671 120.749 120.749 120.751 -0.002 25722
616 1 5 . 1 1 671 671 GLU HA H 671 4.011 4.011 3.986 0.025 25722
617 1 5 . 1 1 671 671 GLU H H 671 7.831 7.831 8.347 -0.516 25722
618 1 5 . 1 1 672 672 ALA N N 672 119.688 119.688 123.539 -3.851 25722
619 1 5 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.374 -0.290 25722
620 1 5 . 1 1 672 672 ALA H H 672 7.728 7.728 7.885 -0.157 25722
621 1 5 . 1 1 673 673 LEU N N 673 119.258 119.258 119.273 -0.015 25722
622 1 5 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.188 -0.818 25722
623 1 5 . 1 1 673 673 LEU H H 673 8.166 8.166 8.593 -0.427 25722
624 1 5 . 1 1 674 674 LEU N N 674 121.499 121.499 119.251 2.248 25722
625 1 5 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.181 -0.355 25722
626 1 5 . 1 1 674 674 LEU H H 674 7.780 7.780 7.584 0.196 25722
627 1 5 . 1 1 675 675 SER N N 675 109.742 109.742 114.562 -4.820 25722
628 1 5 . 1 1 675 675 SER HA H 675 4.694 4.694 4.303 0.391 25722
629 1 5 . 1 1 675 675 SER H H 675 8.277 8.277 8.325 -0.048 25722
630 1 5 . 1 1 676 676 LEU N N 676 121.811 121.811 122.051 -0.240 25722
631 1 5 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.150 -0.105 25722
632 1 5 . 1 1 676 676 LEU H H 676 7.780 7.780 7.856 -0.076 25722
633 1 5 . 1 1 677 677 ASN N N 677 122.526 122.526 117.157 5.369 25722
634 1 5 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.539 0.266 25722
635 1 5 . 1 1 677 677 ASN H H 677 7.710 7.710 7.856 -0.146 25722
636 1 6 . 1 1 628 628 GLY N N 628 113.006 113.006 110.329 2.677 25722
637 1 6 . 1 1 628 628 GLY H H 628 8.727 8.727 8.326 0.401 25722
638 1 6 . 1 1 629 629 ILE N N 629 122.730 122.730 120.827 1.903 25722
639 1 6 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.507 -0.259 25722
640 1 6 . 1 1 629 629 ILE H H 629 8.560 8.560 7.948 0.612 25722
641 1 6 . 1 1 630 630 ARG N N 630 119.880 119.880 124.266 -4.386 25722
642 1 6 . 1 1 630 630 ARG H H 630 8.029 8.029 8.677 -0.648 25722
643 1 6 . 1 1 631 631 LYS N N 631 119.040 119.040 121.644 -2.604 25722
644 1 6 . 1 1 631 631 LYS H H 631 8.664 8.664 8.545 0.119 25722
645 1 6 . 1 1 632 632 THR N N 632 109.950 109.950 115.569 -5.619 25722
646 1 6 . 1 1 632 632 THR H H 632 8.376 8.376 8.217 0.159 25722
647 1 6 . 1 1 633 633 ARG N N 633 120.950 120.950 119.006 1.944 25722
648 1 6 . 1 1 633 633 ARG HA H 633 3.680 3.680 4.017 -0.337 25722
649 1 6 . 1 1 633 633 ARG H H 633 8.017 8.017 8.467 -0.450 25722
650 1 6 . 1 1 634 634 GLU N N 634 118.201 118.201 119.091 -0.890 25722
651 1 6 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.063 0.017 25722
652 1 6 . 1 1 634 634 GLU H H 634 7.260 7.260 7.840 -0.580 25722
653 1 6 . 1 1 635 635 THR N N 635 115.274 115.274 114.406 0.868 25722
654 1 6 . 1 1 635 635 THR H H 635 8.137 8.137 8.510 -0.373 25722
655 1 6 . 1 1 636 636 GLU N N 636 115.301 115.301 121.808 -6.507 25722
656 1 6 . 1 1 636 636 GLU HA H 636 4.108 4.108 3.698 0.410 25722
657 1 6 . 1 1 636 636 GLU H H 636 8.274 8.274 7.736 0.538 25722
658 1 6 . 1 1 637 637 ARG N N 637 120.174 120.174 120.330 -0.156 25722
659 1 6 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.029 -0.270 25722
660 1 6 . 1 1 637 637 ARG H H 637 7.810 7.810 7.477 0.333 25722
661 1 6 . 1 1 638 638 LEU N N 638 120.658 120.658 121.936 -1.278 25722
662 1 6 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.530 -1.080 25722
663 1 6 . 1 1 638 638 LEU H H 638 8.170 8.170 8.719 -0.549 25722
664 1 6 . 1 1 639 639 ARG N N 639 116.325 116.325 117.779 -1.454 25722
665 1 6 . 1 1 639 639 ARG HA H 639 3.924 3.924 3.915 0.009 25722
666 1 6 . 1 1 639 639 ARG H H 639 7.510 7.510 7.935 -0.425 25722
667 1 6 . 1 1 640 640 ARG N N 640 117.904 117.904 117.411 0.493 25722
668 1 6 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.104 -0.089 25722
669 1 6 . 1 1 640 640 ARG H H 640 7.925 7.925 7.809 0.116 25722
670 1 6 . 1 1 641 641 GLN N N 641 118.203 118.203 117.561 0.642 25722
671 1 6 . 1 1 641 641 GLN H H 641 8.682 8.682 7.885 0.797 25722
672 1 6 . 1 1 643 643 LEU N N 643 119.140 119.140 120.022 -0.882 25722
673 1 6 . 1 1 643 643 LEU H H 643 7.139 7.139 7.609 -0.470 25722
674 1 6 . 1 1 644 644 GLU N N 644 120.140 120.140 125.296 -5.156 25722
675 1 6 . 1 1 644 644 GLU H H 644 8.849 8.849 8.840 0.009 25722
676 1 6 . 1 1 645 645 VAL N N 645 119.330 119.330 125.523 -6.193 25722
677 1 6 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.768 0.226 25722
678 1 6 . 1 1 645 645 VAL H H 645 7.986 7.986 8.504 -0.517 25722
679 1 6 . 1 1 646 646 PHE N N 646 115.458 115.458 118.042 -2.584 25722
680 1 6 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.376 0.025 25722
681 1 6 . 1 1 646 646 PHE H H 646 8.027 8.027 8.150 -0.123 25722
682 1 6 . 1 1 647 647 TRP N N 647 120.228 120.228 121.097 -0.869 25722
683 1 6 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.493 0.087 25722
684 1 6 . 1 1 647 647 TRP H H 647 7.070 7.070 8.560 -1.490 25722
685 1 6 . 1 1 648 648 GLY N N 648 108.000 108.000 105.591 2.409 25722
686 1 6 . 1 1 648 648 GLY H H 648 8.245 8.245 8.256 -0.011 25722
687 1 6 . 1 1 649 649 GLN N N 649 119.516 119.516 120.780 -1.264 25722
688 1 6 . 1 1 649 649 GLN H H 649 7.682 7.682 8.031 -0.349 25722
689 1 6 . 1 1 650 650 ASP N N 650 114.599 114.599 118.223 -3.624 25722
690 1 6 . 1 1 650 650 ASP H H 650 7.880 7.880 8.670 -0.790 25722
691 1 6 . 1 1 651 651 HIS N N 651 126.820 126.820 120.857 5.963 25722
692 1 6 . 1 1 651 651 HIS H H 651 8.968 8.968 8.596 0.372 25722
693 1 6 . 1 1 652 652 LYS N N 652 119.747 119.747 117.624 2.123 25722
694 1 6 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.003 0.022 25722
695 1 6 . 1 1 653 653 VAL N N 653 120.591 120.591 116.731 3.860 25722
696 1 6 . 1 1 653 653 VAL HA H 653 3.810 3.810 4.329 -0.519 25722
697 1 6 . 1 1 653 653 VAL H H 653 8.290 8.290 7.595 0.695 25722
698 1 6 . 1 1 654 654 ASP N N 654 119.962 119.962 118.194 1.768 25722
699 1 6 . 1 1 654 654 ASP HA H 654 3.994 3.994 3.870 0.124 25722
700 1 6 . 1 1 654 654 ASP H H 654 7.886 7.886 7.786 0.100 25722
701 1 6 . 1 1 655 655 PHE N N 655 123.205 123.205 120.257 2.948 25722
702 1 6 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.050 0.410 25722
703 1 6 . 1 1 655 655 PHE H H 655 8.357 8.357 7.087 1.270 25722
704 1 6 . 1 1 656 656 ILE N N 656 122.329 122.329 116.911 5.418 25722
705 1 6 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.767 0.363 25722
706 1 6 . 1 1 656 656 ILE H H 656 7.150 7.150 8.468 -1.318 25722
707 1 6 . 1 1 657 657 LEU N N 657 123.105 123.105 120.655 2.450 25722
708 1 6 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.109 0.293 25722
709 1 6 . 1 1 657 657 LEU H H 657 9.010 9.010 7.560 1.450 25722
710 1 6 . 1 1 658 658 GLN N N 658 114.550 114.550 116.792 -2.242 25722
711 1 6 . 1 1 658 658 GLN H H 658 6.964 6.964 7.670 -0.706 25722
712 1 6 . 1 1 659 659 ARG N N 659 116.034 116.034 118.499 -2.465 25722
713 1 6 . 1 1 659 659 ARG H H 659 7.479 7.479 7.420 0.059 25722
714 1 6 . 1 1 660 660 GLU N N 660 117.630 117.630 118.951 -1.321 25722
715 1 6 . 1 1 660 660 GLU H H 660 8.835 8.835 8.674 0.161 25722
716 1 6 . 1 1 662 662 TYR N N 662 119.800 119.800 122.331 -2.531 25722
717 1 6 . 1 1 662 662 TYR H H 662 8.221 8.221 8.629 -0.408 25722
718 1 6 . 1 1 663 663 CYS N N 663 118.319 118.319 116.830 1.489 25722
719 1 6 . 1 1 663 663 CYS HA H 663 4.330 4.330 4.136 0.194 25722
720 1 6 . 1 1 663 663 CYS H H 663 8.233 8.233 8.608 -0.375 25722
721 1 6 . 1 1 664 664 ARG N N 664 114.391 114.391 119.627 -5.236 25722
722 1 6 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.509 -0.423 25722
723 1 6 . 1 1 664 664 ARG H H 664 7.268 7.268 8.135 -0.867 25722
724 1 6 . 1 1 665 665 ASP N N 665 122.897 122.897 119.740 3.157 25722
725 1 6 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.278 0.312 25722
726 1 6 . 1 1 665 665 ASP H H 665 8.620 8.620 7.579 1.041 25722
727 1 6 . 1 1 666 666 ILE N N 666 116.620 116.620 119.041 -2.421 25722
728 1 6 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.778 0.032 25722
729 1 6 . 1 1 666 666 ILE H H 666 6.976 6.976 7.428 -0.452 25722
730 1 6 . 1 1 667 667 ASN N N 667 124.762 124.762 119.320 5.442 25722
731 1 6 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.714 -0.394 25722
732 1 6 . 1 1 667 667 ASN H H 667 7.397 7.397 7.657 -0.260 25722
733 1 6 . 1 1 668 668 GLN N N 668 114.391 114.391 119.528 -5.137 25722
734 1 6 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.582 0.351 25722
735 1 6 . 1 1 668 668 GLN H H 668 7.267 7.267 7.713 -0.446 25722
736 1 6 . 1 1 669 669 LEU N N 669 121.387 121.387 120.423 0.964 25722
737 1 6 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.935 -0.575 25722
738 1 6 . 1 1 669 669 LEU H H 669 8.309 8.309 7.602 0.707 25722
739 1 6 . 1 1 670 670 SER N N 670 112.305 112.305 112.733 -0.428 25722
740 1 6 . 1 1 670 670 SER HA H 670 4.304 4.304 4.243 0.061 25722
741 1 6 . 1 1 670 670 SER H H 670 7.448 7.448 8.447 -0.999 25722
742 1 6 . 1 1 671 671 GLU N N 671 120.749 120.749 121.578 -0.829 25722
743 1 6 . 1 1 671 671 GLU HA H 671 4.011 4.011 4.118 -0.107 25722
744 1 6 . 1 1 671 671 GLU H H 671 7.831 7.831 7.936 -0.105 25722
745 1 6 . 1 1 672 672 ALA N N 672 119.688 119.688 122.695 -3.007 25722
746 1 6 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.413 -0.329 25722
747 1 6 . 1 1 672 672 ALA H H 672 7.728 7.728 8.104 -0.376 25722
748 1 6 . 1 1 673 673 LEU N N 673 119.258 119.258 118.598 0.660 25722
749 1 6 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.093 -0.723 25722
750 1 6 . 1 1 673 673 LEU H H 673 8.166 8.166 7.966 0.200 25722
751 1 6 . 1 1 674 674 LEU N N 674 121.499 121.499 120.338 1.161 25722
752 1 6 . 1 1 674 674 LEU HA H 674 3.826 3.826 3.953 -0.127 25722
753 1 6 . 1 1 674 674 LEU H H 674 7.780 7.780 7.633 0.147 25722
754 1 6 . 1 1 675 675 SER N N 675 109.742 109.742 114.619 -4.877 25722
755 1 6 . 1 1 675 675 SER HA H 675 4.694 4.694 4.295 0.399 25722
756 1 6 . 1 1 675 675 SER H H 675 8.277 8.277 7.919 0.358 25722
757 1 6 . 1 1 676 676 LEU N N 676 121.811 121.811 122.626 -0.815 25722
758 1 6 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.181 -0.136 25722
759 1 6 . 1 1 676 676 LEU H H 676 7.780 7.780 7.716 0.064 25722
760 1 6 . 1 1 677 677 ASN N N 677 122.526 122.526 116.627 5.899 25722
761 1 6 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.581 0.224 25722
762 1 6 . 1 1 677 677 ASN H H 677 7.710 7.710 7.952 -0.242 25722
763 1 7 . 1 1 628 628 GLY N N 628 113.006 113.006 111.069 1.937 25722
764 1 7 . 1 1 628 628 GLY H H 628 8.727 8.727 8.756 -0.029 25722
765 1 7 . 1 1 629 629 ILE N N 629 122.730 122.730 120.235 2.495 25722
766 1 7 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.571 -0.323 25722
767 1 7 . 1 1 629 629 ILE H H 629 8.560 8.560 7.732 0.828 25722
768 1 7 . 1 1 630 630 ARG N N 630 119.880 119.880 124.696 -4.816 25722
769 1 7 . 1 1 630 630 ARG H H 630 8.029 8.029 8.665 -0.636 25722
770 1 7 . 1 1 631 631 LYS N N 631 119.040 119.040 120.708 -1.668 25722
771 1 7 . 1 1 631 631 LYS H H 631 8.664 8.664 8.502 0.162 25722
772 1 7 . 1 1 632 632 THR N N 632 109.950 109.950 113.861 -3.911 25722
773 1 7 . 1 1 632 632 THR H H 632 8.376 8.376 8.043 0.333 25722
774 1 7 . 1 1 633 633 ARG N N 633 120.950 120.950 120.119 0.831 25722
775 1 7 . 1 1 633 633 ARG HA H 633 3.680 3.680 3.984 -0.304 25722
776 1 7 . 1 1 633 633 ARG H H 633 8.017 8.017 8.537 -0.519 25722
777 1 7 . 1 1 634 634 GLU N N 634 118.201 118.201 117.010 1.191 25722
778 1 7 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.175 -0.095 25722
779 1 7 . 1 1 634 634 GLU H H 634 7.260 7.260 7.948 -0.688 25722
780 1 7 . 1 1 635 635 THR N N 635 115.274 115.274 114.140 1.134 25722
781 1 7 . 1 1 635 635 THR H H 635 8.137 8.137 7.719 0.418 25722
782 1 7 . 1 1 636 636 GLU N N 636 115.301 115.301 121.002 -5.701 25722
783 1 7 . 1 1 636 636 GLU HA H 636 4.108 4.108 4.207 -0.099 25722
784 1 7 . 1 1 636 636 GLU H H 636 8.274 8.274 8.105 0.169 25722
785 1 7 . 1 1 637 637 ARG N N 637 120.174 120.174 119.622 0.552 25722
786 1 7 . 1 1 637 637 ARG HA H 637 3.759 3.759 3.997 -0.238 25722
787 1 7 . 1 1 637 637 ARG H H 637 7.810 7.810 7.634 0.176 25722
788 1 7 . 1 1 638 638 LEU N N 638 120.658 120.658 119.700 0.958 25722
789 1 7 . 1 1 638 638 LEU HA H 638 3.450 3.450 3.998 -0.548 25722
790 1 7 . 1 1 638 638 LEU H H 638 8.170 8.170 8.149 0.021 25722
791 1 7 . 1 1 639 639 ARG N N 639 116.325 116.325 116.900 -0.575 25722
792 1 7 . 1 1 639 639 ARG HA H 639 3.924 3.924 3.998 -0.074 25722
793 1 7 . 1 1 639 639 ARG H H 639 7.510 7.510 7.356 0.154 25722
794 1 7 . 1 1 640 640 ARG N N 640 117.904 117.904 117.396 0.508 25722
795 1 7 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.047 -0.032 25722
796 1 7 . 1 1 640 640 ARG H H 640 7.925 7.925 8.029 -0.104 25722
797 1 7 . 1 1 641 641 GLN N N 641 118.203 118.203 113.810 4.393 25722
798 1 7 . 1 1 641 641 GLN H H 641 8.682 8.682 7.816 0.866 25722
799 1 7 . 1 1 643 643 LEU N N 643 119.140 119.140 118.543 0.597 25722
800 1 7 . 1 1 643 643 LEU H H 643 7.139 7.139 7.929 -0.790 25722
801 1 7 . 1 1 644 644 GLU N N 644 120.140 120.140 118.388 1.752 25722
802 1 7 . 1 1 644 644 GLU H H 644 8.849 8.849 8.399 0.450 25722
803 1 7 . 1 1 645 645 VAL N N 645 119.330 119.330 121.320 -1.990 25722
804 1 7 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.854 0.140 25722
805 1 7 . 1 1 645 645 VAL H H 645 7.986 7.986 8.264 -0.278 25722
806 1 7 . 1 1 646 646 PHE N N 646 115.458 115.458 119.196 -3.738 25722
807 1 7 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.419 -0.018 25722
808 1 7 . 1 1 646 646 PHE H H 646 8.027 8.027 8.173 -0.146 25722
809 1 7 . 1 1 647 647 TRP N N 647 120.228 120.228 120.472 -0.244 25722
810 1 7 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.820 -0.240 25722
811 1 7 . 1 1 647 647 TRP H H 647 7.070 7.070 8.450 -1.380 25722
812 1 7 . 1 1 648 648 GLY N N 648 108.000 108.000 106.894 1.106 25722
813 1 7 . 1 1 648 648 GLY H H 648 8.245 8.245 8.567 -0.322 25722
814 1 7 . 1 1 649 649 GLN N N 649 119.516 119.516 122.990 -3.474 25722
815 1 7 . 1 1 649 649 GLN H H 649 7.682 7.682 7.774 -0.092 25722
816 1 7 . 1 1 650 650 ASP N N 650 114.599 114.599 121.603 -7.004 25722
817 1 7 . 1 1 650 650 ASP H H 650 7.880 7.880 8.488 -0.608 25722
818 1 7 . 1 1 651 651 HIS N N 651 126.820 126.820 120.195 6.625 25722
819 1 7 . 1 1 651 651 HIS H H 651 8.968 8.968 8.460 0.508 25722
820 1 7 . 1 1 652 652 LYS N N 652 119.747 119.747 118.074 1.673 25722
821 1 7 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.029 -0.004 25722
822 1 7 . 1 1 653 653 VAL N N 653 120.591 120.591 114.903 5.688 25722
823 1 7 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.035 0.775 25722
824 1 7 . 1 1 653 653 VAL H H 653 8.290 8.290 7.449 0.841 25722
825 1 7 . 1 1 654 654 ASP N N 654 119.962 119.962 117.890 2.072 25722
826 1 7 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.125 -0.131 25722
827 1 7 . 1 1 654 654 ASP H H 654 7.886 7.886 7.546 0.340 25722
828 1 7 . 1 1 655 655 PHE N N 655 123.205 123.205 119.678 3.527 25722
829 1 7 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.097 0.363 25722
830 1 7 . 1 1 655 655 PHE H H 655 8.357 8.357 7.351 1.006 25722
831 1 7 . 1 1 656 656 ILE N N 656 122.329 122.329 117.738 4.591 25722
832 1 7 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.828 0.302 25722
833 1 7 . 1 1 656 656 ILE H H 656 7.150 7.150 8.237 -1.087 25722
834 1 7 . 1 1 657 657 LEU N N 657 123.105 123.105 119.191 3.914 25722
835 1 7 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.049 0.353 25722
836 1 7 . 1 1 657 657 LEU H H 657 9.010 9.010 7.643 1.367 25722
837 1 7 . 1 1 658 658 GLN N N 658 114.550 114.550 113.860 0.690 25722
838 1 7 . 1 1 658 658 GLN H H 658 6.964 6.964 7.762 -0.798 25722
839 1 7 . 1 1 659 659 ARG N N 659 116.034 116.034 117.173 -1.139 25722
840 1 7 . 1 1 659 659 ARG H H 659 7.479 7.479 8.276 -0.797 25722
841 1 7 . 1 1 660 660 GLU N N 660 117.630 117.630 119.435 -1.805 25722
842 1 7 . 1 1 660 660 GLU H H 660 8.835 8.835 8.278 0.557 25722
843 1 7 . 1 1 662 662 TYR N N 662 119.800 119.800 123.873 -4.073 25722
844 1 7 . 1 1 662 662 TYR H H 662 8.221 8.221 8.612 -0.391 25722
845 1 7 . 1 1 663 663 CYS N N 663 118.319 118.319 115.976 2.343 25722
846 1 7 . 1 1 663 663 CYS HA H 663 4.330 4.330 4.035 0.295 25722
847 1 7 . 1 1 663 663 CYS H H 663 8.233 8.233 8.482 -0.249 25722
848 1 7 . 1 1 664 664 ARG N N 664 114.391 114.391 118.987 -4.596 25722
849 1 7 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.101 -0.015 25722
850 1 7 . 1 1 664 664 ARG H H 664 7.268 7.268 8.261 -0.993 25722
851 1 7 . 1 1 665 665 ASP N N 665 122.897 122.897 118.270 4.627 25722
852 1 7 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.346 0.244 25722
853 1 7 . 1 1 665 665 ASP H H 665 8.620 8.620 7.902 0.718 25722
854 1 7 . 1 1 666 666 ILE N N 666 116.620 116.620 117.547 -0.927 25722
855 1 7 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.872 -0.062 25722
856 1 7 . 1 1 666 666 ILE H H 666 6.976 6.976 7.250 -0.274 25722
857 1 7 . 1 1 667 667 ASN N N 667 124.762 124.762 120.147 4.615 25722
858 1 7 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.451 -0.131 25722
859 1 7 . 1 1 667 667 ASN H H 667 7.397 7.397 7.763 -0.366 25722
860 1 7 . 1 1 668 668 GLN N N 668 114.391 114.391 120.521 -6.130 25722
861 1 7 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.607 0.326 25722
862 1 7 . 1 1 668 668 GLN H H 668 7.267 7.267 7.701 -0.434 25722
863 1 7 . 1 1 669 669 LEU N N 669 121.387 121.387 120.257 1.130 25722
864 1 7 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.967 -0.607 25722
865 1 7 . 1 1 669 669 LEU H H 669 8.309 8.309 7.710 0.599 25722
866 1 7 . 1 1 670 670 SER N N 670 112.305 112.305 113.785 -1.480 25722
867 1 7 . 1 1 670 670 SER HA H 670 4.304 4.304 4.196 0.108 25722
868 1 7 . 1 1 670 670 SER H H 670 7.448 7.448 8.823 -1.375 25722
869 1 7 . 1 1 671 671 GLU N N 671 120.749 120.749 121.938 -1.189 25722
870 1 7 . 1 1 671 671 GLU HA H 671 4.011 4.011 4.010 0.001 25722
871 1 7 . 1 1 671 671 GLU H H 671 7.831 7.831 8.497 -0.666 25722
872 1 7 . 1 1 672 672 ALA N N 672 119.688 119.688 122.457 -2.769 25722
873 1 7 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.453 -0.369 25722
874 1 7 . 1 1 672 672 ALA H H 672 7.728 7.728 7.935 -0.207 25722
875 1 7 . 1 1 673 673 LEU N N 673 119.258 119.258 119.403 -0.145 25722
876 1 7 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.209 -0.839 25722
877 1 7 . 1 1 673 673 LEU H H 673 8.166 8.166 8.593 -0.427 25722
878 1 7 . 1 1 674 674 LEU N N 674 121.499 121.499 119.623 1.876 25722
879 1 7 . 1 1 674 674 LEU HA H 674 3.826 3.826 3.945 -0.119 25722
880 1 7 . 1 1 674 674 LEU H H 674 7.780 7.780 7.596 0.184 25722
881 1 7 . 1 1 675 675 SER N N 675 109.742 109.742 115.017 -5.275 25722
882 1 7 . 1 1 675 675 SER HA H 675 4.694 4.694 4.233 0.461 25722
883 1 7 . 1 1 675 675 SER H H 675 8.277 8.277 7.780 0.497 25722
884 1 7 . 1 1 676 676 LEU N N 676 121.811 121.811 121.437 0.374 25722
885 1 7 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.245 -0.200 25722
886 1 7 . 1 1 676 676 LEU H H 676 7.780 7.780 7.825 -0.045 25722
887 1 7 . 1 1 677 677 ASN N N 677 122.526 122.526 116.624 5.902 25722
888 1 7 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.610 0.195 25722
889 1 7 . 1 1 677 677 ASN H H 677 7.710 7.710 7.926 -0.216 25722
890 1 8 . 1 1 628 628 GLY N N 628 113.006 113.006 108.579 4.427 25722
891 1 8 . 1 1 628 628 GLY H H 628 8.727 8.727 9.041 -0.314 25722
892 1 8 . 1 1 629 629 ILE N N 629 122.730 122.730 117.809 4.921 25722
893 1 8 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.416 -0.168 25722
894 1 8 . 1 1 629 629 ILE H H 629 8.560 8.560 8.098 0.462 25722
895 1 8 . 1 1 630 630 ARG N N 630 119.880 119.880 122.102 -2.222 25722
896 1 8 . 1 1 630 630 ARG H H 630 8.029 8.029 7.890 0.139 25722
897 1 8 . 1 1 631 631 LYS N N 631 119.040 119.040 124.158 -5.118 25722
898 1 8 . 1 1 631 631 LYS H H 631 8.664 8.664 8.732 -0.068 25722
899 1 8 . 1 1 632 632 THR N N 632 109.950 109.950 116.342 -6.392 25722
900 1 8 . 1 1 632 632 THR H H 632 8.376 8.376 7.788 0.588 25722
901 1 8 . 1 1 633 633 ARG N N 633 120.950 120.950 120.102 0.848 25722
902 1 8 . 1 1 633 633 ARG HA H 633 3.680 3.680 4.007 -0.327 25722
903 1 8 . 1 1 633 633 ARG H H 633 8.017 8.017 8.632 -0.615 25722
904 1 8 . 1 1 634 634 GLU N N 634 118.201 118.201 116.328 1.873 25722
905 1 8 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.221 -0.141 25722
906 1 8 . 1 1 634 634 GLU H H 634 7.260 7.260 8.249 -0.989 25722
907 1 8 . 1 1 635 635 THR N N 635 115.274 115.274 114.493 0.781 25722
908 1 8 . 1 1 635 635 THR H H 635 8.137 8.137 7.388 0.749 25722
909 1 8 . 1 1 636 636 GLU N N 636 115.301 115.301 120.315 -5.014 25722
910 1 8 . 1 1 636 636 GLU HA H 636 4.108 4.108 3.821 0.287 25722
911 1 8 . 1 1 636 636 GLU H H 636 8.274 8.274 8.119 0.155 25722
912 1 8 . 1 1 637 637 ARG N N 637 120.174 120.174 118.866 1.308 25722
913 1 8 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.091 -0.332 25722
914 1 8 . 1 1 637 637 ARG H H 637 7.810 7.810 7.601 0.209 25722
915 1 8 . 1 1 638 638 LEU N N 638 120.658 120.658 119.435 1.223 25722
916 1 8 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.053 -0.603 25722
917 1 8 . 1 1 638 638 LEU H H 638 8.170 8.170 7.368 0.802 25722
918 1 8 . 1 1 639 639 ARG N N 639 116.325 116.325 119.041 -2.716 25722
919 1 8 . 1 1 639 639 ARG HA H 639 3.924 3.924 4.123 -0.199 25722
920 1 8 . 1 1 639 639 ARG H H 639 7.510 7.510 7.634 -0.124 25722
921 1 8 . 1 1 640 640 ARG N N 640 117.904 117.904 118.445 -0.541 25722
922 1 8 . 1 1 640 640 ARG HA H 640 4.015 4.015 3.973 0.042 25722
923 1 8 . 1 1 640 640 ARG H H 640 7.925 7.925 7.609 0.316 25722
924 1 8 . 1 1 641 641 GLN N N 641 118.203 118.203 116.339 1.864 25722
925 1 8 . 1 1 641 641 GLN H H 641 8.682 8.682 7.716 0.966 25722
926 1 8 . 1 1 643 643 LEU N N 643 119.140 119.140 123.585 -4.445 25722
927 1 8 . 1 1 643 643 LEU H H 643 7.139 7.139 8.401 -1.262 25722
928 1 8 . 1 1 644 644 GLU N N 644 120.140 120.140 123.965 -3.825 25722
929 1 8 . 1 1 644 644 GLU H H 644 8.849 8.849 8.565 0.284 25722
930 1 8 . 1 1 645 645 VAL N N 645 119.330 119.330 119.759 -0.429 25722
931 1 8 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.835 0.159 25722
932 1 8 . 1 1 645 645 VAL H H 645 7.986 7.986 8.445 -0.459 25722
933 1 8 . 1 1 646 646 PHE N N 646 115.458 115.458 118.314 -2.856 25722
934 1 8 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.361 0.040 25722
935 1 8 . 1 1 646 646 PHE H H 646 8.027 8.027 7.939 0.088 25722
936 1 8 . 1 1 647 647 TRP N N 647 120.228 120.228 120.269 -0.041 25722
937 1 8 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.770 -0.190 25722
938 1 8 . 1 1 647 647 TRP H H 647 7.070 7.070 8.478 -1.408 25722
939 1 8 . 1 1 648 648 GLY N N 648 108.000 108.000 105.084 2.916 25722
940 1 8 . 1 1 648 648 GLY H H 648 8.245 8.245 8.782 -0.537 25722
941 1 8 . 1 1 649 649 GLN N N 649 119.516 119.516 119.554 -0.038 25722
942 1 8 . 1 1 649 649 GLN H H 649 7.682 7.682 7.753 -0.070 25722
943 1 8 . 1 1 650 650 ASP N N 650 114.599 114.599 113.815 0.784 25722
944 1 8 . 1 1 650 650 ASP H H 650 7.880 7.880 8.308 -0.428 25722
945 1 8 . 1 1 651 651 HIS N N 651 126.820 126.820 120.195 6.625 25722
946 1 8 . 1 1 651 651 HIS H H 651 8.968 8.968 8.309 0.659 25722
947 1 8 . 1 1 652 652 LYS N N 652 119.747 119.747 118.810 0.937 25722
948 1 8 . 1 1 652 652 LYS HA H 652 4.025 4.025 3.995 0.030 25722
949 1 8 . 1 1 653 653 VAL N N 653 120.591 120.591 115.176 5.415 25722
950 1 8 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.703 0.107 25722
951 1 8 . 1 1 653 653 VAL H H 653 8.290 8.290 7.264 1.026 25722
952 1 8 . 1 1 654 654 ASP N N 654 119.962 119.962 118.269 1.693 25722
953 1 8 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.026 -0.032 25722
954 1 8 . 1 1 654 654 ASP H H 654 7.886 7.886 7.577 0.309 25722
955 1 8 . 1 1 655 655 PHE N N 655 123.205 123.205 119.969 3.236 25722
956 1 8 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.093 0.367 25722
957 1 8 . 1 1 655 655 PHE H H 655 8.357 8.357 7.172 1.185 25722
958 1 8 . 1 1 656 656 ILE N N 656 122.329 122.329 116.687 5.642 25722
959 1 8 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.918 0.212 25722
960 1 8 . 1 1 656 656 ILE H H 656 7.150 7.150 8.151 -1.001 25722
961 1 8 . 1 1 657 657 LEU N N 657 123.105 123.105 119.439 3.666 25722
962 1 8 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.342 0.060 25722
963 1 8 . 1 1 657 657 LEU H H 657 9.010 9.010 7.445 1.565 25722
964 1 8 . 1 1 658 658 GLN N N 658 114.550 114.550 118.393 -3.843 25722
965 1 8 . 1 1 658 658 GLN H H 658 6.964 6.964 7.343 -0.379 25722
966 1 8 . 1 1 659 659 ARG N N 659 116.034 116.034 121.756 -5.722 25722
967 1 8 . 1 1 659 659 ARG H H 659 7.479 7.479 8.626 -1.147 25722
968 1 8 . 1 1 660 660 GLU N N 660 117.630 117.630 117.537 0.093 25722
969 1 8 . 1 1 660 660 GLU H H 660 8.835 8.835 7.526 1.309 25722
970 1 8 . 1 1 662 662 TYR N N 662 119.800 119.800 119.140 0.660 25722
971 1 8 . 1 1 662 662 TYR H H 662 8.221 8.221 8.622 -0.401 25722
972 1 8 . 1 1 663 663 CYS N N 663 118.319 118.319 115.815 2.504 25722
973 1 8 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.941 0.389 25722
974 1 8 . 1 1 663 663 CYS H H 663 8.233 8.233 8.518 -0.285 25722
975 1 8 . 1 1 664 664 ARG N N 664 114.391 114.391 119.377 -4.986 25722
976 1 8 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.028 0.058 25722
977 1 8 . 1 1 664 664 ARG H H 664 7.268 7.268 7.588 -0.320 25722
978 1 8 . 1 1 665 665 ASP N N 665 122.897 122.897 119.234 3.663 25722
979 1 8 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.359 0.232 25722
980 1 8 . 1 1 665 665 ASP H H 665 8.620 8.620 7.889 0.731 25722
981 1 8 . 1 1 666 666 ILE N N 666 116.620 116.620 118.777 -2.157 25722
982 1 8 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.722 0.088 25722
983 1 8 . 1 1 666 666 ILE H H 666 6.976 6.976 7.234 -0.258 25722
984 1 8 . 1 1 667 667 ASN N N 667 124.762 124.762 119.943 4.819 25722
985 1 8 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.385 -0.065 25722
986 1 8 . 1 1 667 667 ASN H H 667 7.397 7.397 7.636 -0.239 25722
987 1 8 . 1 1 668 668 GLN N N 668 114.391 114.391 120.251 -5.860 25722
988 1 8 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.616 0.317 25722
989 1 8 . 1 1 668 668 GLN H H 668 7.267 7.267 7.809 -0.542 25722
990 1 8 . 1 1 669 669 LEU N N 669 121.387 121.387 120.472 0.915 25722
991 1 8 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.933 -0.573 25722
992 1 8 . 1 1 669 669 LEU H H 669 8.309 8.309 7.999 0.310 25722
993 1 8 . 1 1 670 670 SER N N 670 112.305 112.305 113.739 -1.434 25722
994 1 8 . 1 1 670 670 SER HA H 670 4.304 4.304 4.116 0.188 25722
995 1 8 . 1 1 670 670 SER H H 670 7.448 7.448 8.607 -1.159 25722
996 1 8 . 1 1 671 671 GLU N N 671 120.749 120.749 120.974 -0.225 25722
997 1 8 . 1 1 671 671 GLU HA H 671 4.011 4.011 3.965 0.046 25722
998 1 8 . 1 1 671 671 GLU H H 671 7.831 7.831 8.375 -0.544 25722
999 1 8 . 1 1 672 672 ALA N N 672 119.688 119.688 122.718 -3.030 25722
1000 1 8 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.354 -0.270 25722
1001 1 8 . 1 1 672 672 ALA H H 672 7.728 7.728 8.164 -0.436 25722
1002 1 8 . 1 1 673 673 LEU N N 673 119.258 119.258 119.231 0.027 25722
1003 1 8 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.196 -0.826 25722
1004 1 8 . 1 1 673 673 LEU H H 673 8.166 8.166 8.496 -0.330 25722
1005 1 8 . 1 1 674 674 LEU N N 674 121.499 121.499 119.616 1.883 25722
1006 1 8 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.175 -0.349 25722
1007 1 8 . 1 1 674 674 LEU H H 674 7.780 7.780 7.527 0.253 25722
1008 1 8 . 1 1 675 675 SER N N 675 109.742 109.742 114.552 -4.810 25722
1009 1 8 . 1 1 675 675 SER HA H 675 4.694 4.694 4.319 0.375 25722
1010 1 8 . 1 1 675 675 SER H H 675 8.277 8.277 8.204 0.073 25722
1011 1 8 . 1 1 676 676 LEU N N 676 121.811 121.811 122.185 -0.374 25722
1012 1 8 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.170 -0.125 25722
1013 1 8 . 1 1 676 676 LEU H H 676 7.780 7.780 7.828 -0.048 25722
1014 1 8 . 1 1 677 677 ASN N N 677 122.526 122.526 116.905 5.621 25722
1015 1 8 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.529 0.276 25722
1016 1 8 . 1 1 677 677 ASN H H 677 7.710 7.710 7.874 -0.164 25722
1017 1 9 . 1 1 628 628 GLY N N 628 113.006 113.006 109.550 3.456 25722
1018 1 9 . 1 1 628 628 GLY H H 628 8.727 8.727 7.994 0.733 25722
1019 1 9 . 1 1 629 629 ILE N N 629 122.730 122.730 117.674 5.056 25722
1020 1 9 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.346 -0.098 25722
1021 1 9 . 1 1 629 629 ILE H H 629 8.560 8.560 8.212 0.348 25722
1022 1 9 . 1 1 630 630 ARG N N 630 119.880 119.880 125.156 -5.276 25722
1023 1 9 . 1 1 630 630 ARG H H 630 8.029 8.029 8.783 -0.754 25722
1024 1 9 . 1 1 631 631 LYS N N 631 119.040 119.040 120.374 -1.334 25722
1025 1 9 . 1 1 631 631 LYS H H 631 8.664 8.664 8.366 0.298 25722
1026 1 9 . 1 1 632 632 THR N N 632 109.950 109.950 113.395 -3.445 25722
1027 1 9 . 1 1 632 632 THR H H 632 8.376 8.376 8.099 0.277 25722
1028 1 9 . 1 1 633 633 ARG N N 633 120.950 120.950 120.687 0.263 25722
1029 1 9 . 1 1 633 633 ARG HA H 633 3.680 3.680 4.042 -0.362 25722
1030 1 9 . 1 1 633 633 ARG H H 633 8.017 8.017 8.585 -0.568 25722
1031 1 9 . 1 1 634 634 GLU N N 634 118.201 118.201 116.749 1.452 25722
1032 1 9 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.189 -0.109 25722
1033 1 9 . 1 1 634 634 GLU H H 634 7.260 7.260 8.136 -0.876 25722
1034 1 9 . 1 1 635 635 THR N N 635 115.274 115.274 115.341 -0.067 25722
1035 1 9 . 1 1 635 635 THR H H 635 8.137 8.137 7.387 0.750 25722
1036 1 9 . 1 1 636 636 GLU N N 636 115.301 115.301 120.421 -5.120 25722
1037 1 9 . 1 1 636 636 GLU HA H 636 4.108 4.108 4.347 -0.239 25722
1038 1 9 . 1 1 636 636 GLU H H 636 8.274 8.274 8.347 -0.073 25722
1039 1 9 . 1 1 637 637 ARG N N 637 120.174 120.174 119.273 0.901 25722
1040 1 9 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.183 -0.424 25722
1041 1 9 . 1 1 637 637 ARG H H 637 7.810 7.810 7.695 0.115 25722
1042 1 9 . 1 1 638 638 LEU N N 638 120.658 120.658 122.216 -1.558 25722
1043 1 9 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.165 -0.715 25722
1044 1 9 . 1 1 638 638 LEU H H 638 8.170 8.170 7.783 0.387 25722
1045 1 9 . 1 1 639 639 ARG N N 639 116.325 116.325 117.559 -1.234 25722
1046 1 9 . 1 1 639 639 ARG HA H 639 3.924 3.924 3.849 0.075 25722
1047 1 9 . 1 1 639 639 ARG H H 639 7.510 7.510 7.615 -0.105 25722
1048 1 9 . 1 1 640 640 ARG N N 640 117.904 117.904 118.520 -0.616 25722
1049 1 9 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.169 -0.154 25722
1050 1 9 . 1 1 640 640 ARG H H 640 7.925 7.925 7.573 0.352 25722
1051 1 9 . 1 1 641 641 GLN N N 641 118.203 118.203 116.961 1.242 25722
1052 1 9 . 1 1 641 641 GLN H H 641 8.682 8.682 7.925 0.757 25722
1053 1 9 . 1 1 643 643 LEU N N 643 119.140 119.140 120.932 -1.792 25722
1054 1 9 . 1 1 643 643 LEU H H 643 7.139 7.139 7.380 -0.241 25722
1055 1 9 . 1 1 644 644 GLU N N 644 120.140 120.140 120.955 -0.815 25722
1056 1 9 . 1 1 644 644 GLU H H 644 8.849 8.849 8.422 0.427 25722
1057 1 9 . 1 1 645 645 VAL N N 645 119.330 119.330 124.755 -5.425 25722
1058 1 9 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.743 0.251 25722
1059 1 9 . 1 1 645 645 VAL H H 645 7.986 7.986 8.187 -0.201 25722
1060 1 9 . 1 1 646 646 PHE N N 646 115.458 115.458 116.932 -1.474 25722
1061 1 9 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.462 -0.061 25722
1062 1 9 . 1 1 646 646 PHE H H 646 8.027 8.027 8.052 -0.025 25722
1063 1 9 . 1 1 647 647 TRP N N 647 120.228 120.228 121.378 -1.150 25722
1064 1 9 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.531 0.049 25722
1065 1 9 . 1 1 647 647 TRP H H 647 7.070 7.070 8.400 -1.330 25722
1066 1 9 . 1 1 648 648 GLY N N 648 108.000 108.000 104.422 3.578 25722
1067 1 9 . 1 1 648 648 GLY H H 648 8.245 8.245 8.227 0.018 25722
1068 1 9 . 1 1 649 649 GLN N N 649 119.516 119.516 118.816 0.700 25722
1069 1 9 . 1 1 649 649 GLN H H 649 7.682 7.682 8.401 -0.719 25722
1070 1 9 . 1 1 650 650 ASP N N 650 114.599 114.599 115.385 -0.786 25722
1071 1 9 . 1 1 650 650 ASP H H 650 7.880 7.880 8.246 -0.366 25722
1072 1 9 . 1 1 651 651 HIS N N 651 126.820 126.820 119.576 7.244 25722
1073 1 9 . 1 1 651 651 HIS H H 651 8.968 8.968 8.283 0.685 25722
1074 1 9 . 1 1 652 652 LYS N N 652 119.747 119.747 118.840 0.907 25722
1075 1 9 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.196 -0.171 25722
1076 1 9 . 1 1 653 653 VAL N N 653 120.591 120.591 117.181 3.410 25722
1077 1 9 . 1 1 653 653 VAL HA H 653 3.810 3.810 4.867 -1.057 25722
1078 1 9 . 1 1 653 653 VAL H H 653 8.290 8.290 7.704 0.586 25722
1079 1 9 . 1 1 654 654 ASP N N 654 119.962 119.962 118.628 1.334 25722
1080 1 9 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.643 -0.649 25722
1081 1 9 . 1 1 654 654 ASP H H 654 7.886 7.886 8.000 -0.114 25722
1082 1 9 . 1 1 655 655 PHE N N 655 123.205 123.205 120.355 2.850 25722
1083 1 9 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.728 -0.268 25722
1084 1 9 . 1 1 655 655 PHE H H 655 8.357 8.357 7.465 0.892 25722
1085 1 9 . 1 1 656 656 ILE N N 656 122.329 122.329 117.967 4.362 25722
1086 1 9 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.857 0.273 25722
1087 1 9 . 1 1 656 656 ILE H H 656 7.150 7.150 8.953 -1.803 25722
1088 1 9 . 1 1 657 657 LEU N N 657 123.105 123.105 121.317 1.788 25722
1089 1 9 . 1 1 657 657 LEU HA H 657 4.402 4.402 3.857 0.545 25722
1090 1 9 . 1 1 657 657 LEU H H 657 9.010 9.010 8.268 0.742 25722
1091 1 9 . 1 1 658 658 GLN N N 658 114.550 114.550 115.633 -1.083 25722
1092 1 9 . 1 1 658 658 GLN H H 658 6.964 6.964 7.856 -0.892 25722
1093 1 9 . 1 1 659 659 ARG N N 659 116.034 116.034 115.960 0.074 25722
1094 1 9 . 1 1 659 659 ARG H H 659 7.479 7.479 7.738 -0.259 25722
1095 1 9 . 1 1 660 660 GLU N N 660 117.630 117.630 117.764 -0.134 25722
1096 1 9 . 1 1 660 660 GLU H H 660 8.835 8.835 8.530 0.305 25722
1097 1 9 . 1 1 662 662 TYR N N 662 119.800 119.800 118.283 1.517 25722
1098 1 9 . 1 1 662 662 TYR H H 662 8.221 8.221 8.484 -0.263 25722
1099 1 9 . 1 1 663 663 CYS N N 663 118.319 118.319 116.381 1.938 25722
1100 1 9 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.973 0.357 25722
1101 1 9 . 1 1 663 663 CYS H H 663 8.233 8.233 8.387 -0.154 25722
1102 1 9 . 1 1 664 664 ARG N N 664 114.391 114.391 119.619 -5.228 25722
1103 1 9 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.093 -0.007 25722
1104 1 9 . 1 1 664 664 ARG H H 664 7.268 7.268 7.665 -0.397 25722
1105 1 9 . 1 1 665 665 ASP N N 665 122.897 122.897 119.893 3.004 25722
1106 1 9 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.310 0.280 25722
1107 1 9 . 1 1 665 665 ASP H H 665 8.620 8.620 7.778 0.842 25722
1108 1 9 . 1 1 666 666 ILE N N 666 116.620 116.620 119.022 -2.402 25722
1109 1 9 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.755 0.055 25722
1110 1 9 . 1 1 666 666 ILE H H 666 6.976 6.976 7.319 -0.343 25722
1111 1 9 . 1 1 667 667 ASN N N 667 124.762 124.762 118.774 5.988 25722
1112 1 9 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.313 0.007 25722
1113 1 9 . 1 1 667 667 ASN H H 667 7.397 7.397 7.544 -0.147 25722
1114 1 9 . 1 1 668 668 GLN N N 668 114.391 114.391 119.326 -4.935 25722
1115 1 9 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.133 0.800 25722
1116 1 9 . 1 1 668 668 GLN H H 668 7.267 7.267 7.926 -0.659 25722
1117 1 9 . 1 1 669 669 LEU N N 669 121.387 121.387 119.922 1.465 25722
1118 1 9 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.913 -0.553 25722
1119 1 9 . 1 1 669 669 LEU H H 669 8.309 8.309 7.643 0.666 25722
1120 1 9 . 1 1 670 670 SER N N 670 112.305 112.305 113.329 -1.024 25722
1121 1 9 . 1 1 670 670 SER HA H 670 4.304 4.304 4.100 0.204 25722
1122 1 9 . 1 1 670 670 SER H H 670 7.448 7.448 7.937 -0.489 25722
1123 1 9 . 1 1 671 671 GLU N N 671 120.749 120.749 121.201 -0.452 25722
1124 1 9 . 1 1 671 671 GLU HA H 671 4.011 4.011 3.841 0.170 25722
1125 1 9 . 1 1 671 671 GLU H H 671 7.831 7.831 8.028 -0.197 25722
1126 1 9 . 1 1 672 672 ALA N N 672 119.688 119.688 122.427 -2.739 25722
1127 1 9 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.402 -0.318 25722
1128 1 9 . 1 1 672 672 ALA H H 672 7.728 7.728 6.875 0.853 25722
1129 1 9 . 1 1 673 673 LEU N N 673 119.258 119.258 118.814 0.444 25722
1130 1 9 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.130 -0.760 25722
1131 1 9 . 1 1 673 673 LEU H H 673 8.166 8.166 8.379 -0.213 25722
1132 1 9 . 1 1 674 674 LEU N N 674 121.499 121.499 119.564 1.935 25722
1133 1 9 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.219 -0.393 25722
1134 1 9 . 1 1 674 674 LEU H H 674 7.780 7.780 7.466 0.314 25722
1135 1 9 . 1 1 675 675 SER N N 675 109.742 109.742 114.718 -4.976 25722
1136 1 9 . 1 1 675 675 SER HA H 675 4.694 4.694 4.317 0.377 25722
1137 1 9 . 1 1 675 675 SER H H 675 8.277 8.277 8.419 -0.142 25722
1138 1 9 . 1 1 676 676 LEU N N 676 121.811 121.811 121.527 0.284 25722
1139 1 9 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.247 -0.202 25722
1140 1 9 . 1 1 676 676 LEU H H 676 7.780 7.780 7.668 0.112 25722
1141 1 9 . 1 1 677 677 ASN N N 677 122.526 122.526 116.833 5.693 25722
1142 1 9 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.535 0.270 25722
1143 1 9 . 1 1 677 677 ASN H H 677 7.710 7.710 7.705 0.005 25722
1144 1 10 . 1 1 628 628 GLY N N 628 113.006 113.006 108.002 5.004 25722
1145 1 10 . 1 1 628 628 GLY H H 628 8.727 8.727 8.361 0.366 25722
1146 1 10 . 1 1 629 629 ILE N N 629 122.730 122.730 120.159 2.571 25722
1147 1 10 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.575 -0.327 25722
1148 1 10 . 1 1 629 629 ILE H H 629 8.560 8.560 7.909 0.651 25722
1149 1 10 . 1 1 630 630 ARG N N 630 119.880 119.880 124.989 -5.109 25722
1150 1 10 . 1 1 630 630 ARG H H 630 8.029 8.029 8.627 -0.598 25722
1151 1 10 . 1 1 631 631 LYS N N 631 119.040 119.040 120.868 -1.828 25722
1152 1 10 . 1 1 631 631 LYS H H 631 8.664 8.664 8.214 0.450 25722
1153 1 10 . 1 1 632 632 THR N N 632 109.950 109.950 113.869 -3.919 25722
1154 1 10 . 1 1 632 632 THR H H 632 8.376 8.376 8.236 0.140 25722
1155 1 10 . 1 1 633 633 ARG N N 633 120.950 120.950 121.328 -0.378 25722
1156 1 10 . 1 1 633 633 ARG HA H 633 3.680 3.680 3.949 -0.269 25722
1157 1 10 . 1 1 633 633 ARG H H 633 8.017 8.017 8.740 -0.723 25722
1158 1 10 . 1 1 634 634 GLU N N 634 118.201 118.201 115.586 2.615 25722
1159 1 10 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.217 -0.137 25722
1160 1 10 . 1 1 634 634 GLU H H 634 7.260 7.260 8.423 -1.163 25722
1161 1 10 . 1 1 635 635 THR N N 635 115.274 115.274 115.198 0.076 25722
1162 1 10 . 1 1 635 635 THR H H 635 8.137 8.137 7.466 0.671 25722
1163 1 10 . 1 1 636 636 GLU N N 636 115.301 115.301 120.442 -5.141 25722
1164 1 10 . 1 1 636 636 GLU HA H 636 4.108 4.108 4.286 -0.178 25722
1165 1 10 . 1 1 636 636 GLU H H 636 8.274 8.274 7.856 0.418 25722
1166 1 10 . 1 1 637 637 ARG N N 637 120.174 120.174 119.681 0.493 25722
1167 1 10 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.161 -0.402 25722
1168 1 10 . 1 1 637 637 ARG H H 637 7.810 7.810 7.455 0.354 25722
1169 1 10 . 1 1 638 638 LEU N N 638 120.658 120.658 121.439 -0.781 25722
1170 1 10 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.385 -0.935 25722
1171 1 10 . 1 1 638 638 LEU H H 638 8.170 8.170 7.789 0.381 25722
1172 1 10 . 1 1 639 639 ARG N N 639 116.325 116.325 117.955 -1.630 25722
1173 1 10 . 1 1 639 639 ARG HA H 639 3.924 3.924 4.004 -0.080 25722
1174 1 10 . 1 1 639 639 ARG H H 639 7.510 7.510 7.341 0.169 25722
1175 1 10 . 1 1 640 640 ARG N N 640 117.904 117.904 118.482 -0.578 25722
1176 1 10 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.076 -0.061 25722
1177 1 10 . 1 1 640 640 ARG H H 640 7.925 7.925 7.576 0.349 25722
1178 1 10 . 1 1 641 641 GLN N N 641 118.203 118.203 117.421 0.782 25722
1179 1 10 . 1 1 641 641 GLN H H 641 8.682 8.682 7.770 0.912 25722
1180 1 10 . 1 1 643 643 LEU N N 643 119.140 119.140 117.282 1.858 25722
1181 1 10 . 1 1 643 643 LEU H H 643 7.139 7.139 7.586 -0.447 25722
1182 1 10 . 1 1 644 644 GLU N N 644 120.140 120.140 124.120 -3.980 25722
1183 1 10 . 1 1 644 644 GLU H H 644 8.849 8.849 8.611 0.238 25722
1184 1 10 . 1 1 645 645 VAL N N 645 119.330 119.330 125.624 -6.294 25722
1185 1 10 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.762 0.232 25722
1186 1 10 . 1 1 645 645 VAL H H 645 7.986 7.986 7.975 0.011 25722
1187 1 10 . 1 1 646 646 PHE N N 646 115.458 115.458 117.638 -2.180 25722
1188 1 10 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.354 0.047 25722
1189 1 10 . 1 1 646 646 PHE H H 646 8.027 8.027 8.195 -0.168 25722
1190 1 10 . 1 1 647 647 TRP N N 647 120.228 120.228 121.052 -0.824 25722
1191 1 10 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.669 -0.089 25722
1192 1 10 . 1 1 647 647 TRP H H 647 7.070 7.070 8.386 -1.316 25722
1193 1 10 . 1 1 648 648 GLY N N 648 108.000 108.000 106.946 1.054 25722
1194 1 10 . 1 1 648 648 GLY H H 648 8.245 8.245 8.294 -0.049 25722
1195 1 10 . 1 1 649 649 GLN N N 649 119.516 119.516 119.550 -0.034 25722
1196 1 10 . 1 1 649 649 GLN H H 649 7.682 7.682 7.829 -0.147 25722
1197 1 10 . 1 1 650 650 ASP N N 650 114.599 114.599 113.406 1.193 25722
1198 1 10 . 1 1 650 650 ASP H H 650 7.880 7.880 8.572 -0.692 25722
1199 1 10 . 1 1 651 651 HIS N N 651 126.820 126.820 119.010 7.810 25722
1200 1 10 . 1 1 651 651 HIS H H 651 8.968 8.968 8.400 0.568 25722
1201 1 10 . 1 1 652 652 LYS N N 652 119.747 119.747 118.093 1.654 25722
1202 1 10 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.120 -0.095 25722
1203 1 10 . 1 1 653 653 VAL N N 653 120.591 120.591 116.397 4.194 25722
1204 1 10 . 1 1 653 653 VAL HA H 653 3.810 3.810 2.911 0.899 25722
1205 1 10 . 1 1 653 653 VAL H H 653 8.290 8.290 7.332 0.958 25722
1206 1 10 . 1 1 654 654 ASP N N 654 119.962 119.962 118.145 1.817 25722
1207 1 10 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.097 -0.103 25722
1208 1 10 . 1 1 654 654 ASP H H 654 7.886 7.886 7.722 0.164 25722
1209 1 10 . 1 1 655 655 PHE N N 655 123.205 123.205 120.428 2.777 25722
1210 1 10 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.611 -0.151 25722
1211 1 10 . 1 1 655 655 PHE H H 655 8.357 8.357 7.189 1.168 25722
1212 1 10 . 1 1 656 656 ILE N N 656 122.329 122.329 118.026 4.303 25722
1213 1 10 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.833 0.297 25722
1214 1 10 . 1 1 656 656 ILE H H 656 7.150 7.150 8.474 -1.324 25722
1215 1 10 . 1 1 657 657 LEU N N 657 123.105 123.105 120.377 2.728 25722
1216 1 10 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.203 0.199 25722
1217 1 10 . 1 1 657 657 LEU H H 657 9.010 9.010 7.786 1.224 25722
1218 1 10 . 1 1 658 658 GLN N N 658 114.550 114.550 118.944 -4.394 25722
1219 1 10 . 1 1 658 658 GLN H H 658 6.964 6.964 7.805 -0.841 25722
1220 1 10 . 1 1 659 659 ARG N N 659 116.034 116.034 116.284 -0.250 25722
1221 1 10 . 1 1 659 659 ARG H H 659 7.479 7.479 8.054 -0.575 25722
1222 1 10 . 1 1 660 660 GLU N N 660 117.630 117.630 119.825 -2.195 25722
1223 1 10 . 1 1 660 660 GLU H H 660 8.835 8.835 7.706 1.129 25722
1224 1 10 . 1 1 662 662 TYR N N 662 119.800 119.800 118.199 1.601 25722
1225 1 10 . 1 1 662 662 TYR H H 662 8.221 8.221 8.581 -0.360 25722
1226 1 10 . 1 1 663 663 CYS N N 663 118.319 118.319 115.990 2.329 25722
1227 1 10 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.906 0.424 25722
1228 1 10 . 1 1 663 663 CYS H H 663 8.233 8.233 8.469 -0.236 25722
1229 1 10 . 1 1 664 664 ARG N N 664 114.391 114.391 119.648 -5.257 25722
1230 1 10 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.166 -0.080 25722
1231 1 10 . 1 1 664 664 ARG H H 664 7.268 7.268 7.452 -0.184 25722
1232 1 10 . 1 1 665 665 ASP N N 665 122.897 122.897 119.398 3.499 25722
1233 1 10 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.322 0.268 25722
1234 1 10 . 1 1 665 665 ASP H H 665 8.620 8.620 8.340 0.280 25722
1235 1 10 . 1 1 666 666 ILE N N 666 116.620 116.620 118.731 -2.111 25722
1236 1 10 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.835 -0.025 25722
1237 1 10 . 1 1 666 666 ILE H H 666 6.976 6.976 7.578 -0.602 25722
1238 1 10 . 1 1 667 667 ASN N N 667 124.762 124.762 119.142 5.620 25722
1239 1 10 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.340 -0.020 25722
1240 1 10 . 1 1 667 667 ASN H H 667 7.397 7.397 7.674 -0.277 25722
1241 1 10 . 1 1 668 668 GLN N N 668 114.391 114.391 119.533 -5.142 25722
1242 1 10 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.470 0.463 25722
1243 1 10 . 1 1 668 668 GLN H H 668 7.267 7.267 7.603 -0.336 25722
1244 1 10 . 1 1 669 669 LEU N N 669 121.387 121.387 120.253 1.134 25722
1245 1 10 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.971 -0.611 25722
1246 1 10 . 1 1 669 669 LEU H H 669 8.309 8.309 7.645 0.664 25722
1247 1 10 . 1 1 670 670 SER N N 670 112.305 112.305 112.586 -0.281 25722
1248 1 10 . 1 1 670 670 SER HA H 670 4.304 4.304 4.258 0.046 25722
1249 1 10 . 1 1 670 670 SER H H 670 7.448 7.448 8.726 -1.278 25722
1250 1 10 . 1 1 671 671 GLU N N 671 120.749 120.749 121.631 -0.882 25722
1251 1 10 . 1 1 671 671 GLU HA H 671 4.011 4.011 4.033 -0.022 25722
1252 1 10 . 1 1 671 671 GLU H H 671 7.831 7.831 8.216 -0.385 25722
1253 1 10 . 1 1 672 672 ALA N N 672 119.688 119.688 122.411 -2.723 25722
1254 1 10 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.422 -0.338 25722
1255 1 10 . 1 1 672 672 ALA H H 672 7.728 7.728 7.611 0.117 25722
1256 1 10 . 1 1 673 673 LEU N N 673 119.258 119.258 119.161 0.097 25722
1257 1 10 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.146 -0.776 25722
1258 1 10 . 1 1 673 673 LEU H H 673 8.166 8.166 7.701 0.465 25722
1259 1 10 . 1 1 674 674 LEU N N 674 121.499 121.499 119.276 2.223 25722
1260 1 10 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.275 -0.449 25722
1261 1 10 . 1 1 674 674 LEU H H 674 7.780 7.780 7.657 0.123 25722
1262 1 10 . 1 1 675 675 SER N N 675 109.742 109.742 115.722 -5.980 25722
1263 1 10 . 1 1 675 675 SER HA H 675 4.694 4.694 4.285 0.408 25722
1264 1 10 . 1 1 675 675 SER H H 675 8.277 8.277 8.312 -0.035 25722
1265 1 10 . 1 1 676 676 LEU N N 676 121.811 121.811 121.775 0.036 25722
1266 1 10 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.229 -0.184 25722
1267 1 10 . 1 1 676 676 LEU H H 676 7.780 7.780 8.080 -0.300 25722
1268 1 10 . 1 1 677 677 ASN N N 677 122.526 122.526 117.228 5.298 25722
1269 1 10 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.574 0.231 25722
1270 1 10 . 1 1 677 677 ASN H H 677 7.710 7.710 7.707 0.003 25722
1271 1 11 . 1 1 628 628 GLY N N 628 113.006 113.006 108.282 4.724 25722
1272 1 11 . 1 1 628 628 GLY H H 628 8.727 8.727 8.012 0.715 25722
1273 1 11 . 1 1 629 629 ILE N N 629 122.730 122.730 118.226 4.504 25722
1274 1 11 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.470 -0.222 25722
1275 1 11 . 1 1 629 629 ILE H H 629 8.560 8.560 8.126 0.434 25722
1276 1 11 . 1 1 630 630 ARG N N 630 119.880 119.880 122.286 -2.406 25722
1277 1 11 . 1 1 630 630 ARG H H 630 8.029 8.029 8.551 -0.522 25722
1278 1 11 . 1 1 631 631 LYS N N 631 119.040 119.040 121.083 -2.043 25722
1279 1 11 . 1 1 631 631 LYS H H 631 8.664 8.664 8.404 0.260 25722
1280 1 11 . 1 1 632 632 THR N N 632 109.950 109.950 113.172 -3.222 25722
1281 1 11 . 1 1 632 632 THR H H 632 8.376 8.376 8.135 0.241 25722
1282 1 11 . 1 1 633 633 ARG N N 633 120.950 120.950 120.378 0.572 25722
1283 1 11 . 1 1 633 633 ARG HA H 633 3.680 3.680 4.005 -0.325 25722
1284 1 11 . 1 1 633 633 ARG H H 633 8.017 8.017 8.458 -0.441 25722
1285 1 11 . 1 1 634 634 GLU N N 634 118.201 118.201 116.169 2.032 25722
1286 1 11 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.281 -0.201 25722
1287 1 11 . 1 1 634 634 GLU H H 634 7.260 7.260 8.106 -0.846 25722
1288 1 11 . 1 1 635 635 THR N N 635 115.274 115.274 116.059 -0.785 25722
1289 1 11 . 1 1 635 635 THR H H 635 8.137 8.137 7.583 0.554 25722
1290 1 11 . 1 1 636 636 GLU N N 636 115.301 115.301 120.835 -5.534 25722
1291 1 11 . 1 1 636 636 GLU HA H 636 4.108 4.108 4.073 0.035 25722
1292 1 11 . 1 1 636 636 GLU H H 636 8.274 8.274 8.206 0.068 25722
1293 1 11 . 1 1 637 637 ARG N N 637 120.174 120.174 119.355 0.819 25722
1294 1 11 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.123 -0.364 25722
1295 1 11 . 1 1 637 637 ARG H H 637 7.810 7.810 7.759 0.051 25722
1296 1 11 . 1 1 638 638 LEU N N 638 120.658 120.658 119.455 1.203 25722
1297 1 11 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.014 -0.564 25722
1298 1 11 . 1 1 638 638 LEU H H 638 8.170 8.170 7.613 0.557 25722
1299 1 11 . 1 1 639 639 ARG N N 639 116.325 116.325 118.873 -2.548 25722
1300 1 11 . 1 1 639 639 ARG HA H 639 3.924 3.924 4.082 -0.158 25722
1301 1 11 . 1 1 639 639 ARG H H 639 7.510 7.510 7.747 -0.237 25722
1302 1 11 . 1 1 640 640 ARG N N 640 117.904 117.904 118.206 -0.302 25722
1303 1 11 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.210 -0.195 25722
1304 1 11 . 1 1 640 640 ARG H H 640 7.925 7.925 8.058 -0.133 25722
1305 1 11 . 1 1 641 641 GLN N N 641 118.203 118.203 117.926 0.277 25722
1306 1 11 . 1 1 641 641 GLN H H 641 8.682 8.682 7.817 0.865 25722
1307 1 11 . 1 1 643 643 LEU N N 643 119.140 119.140 120.612 -1.472 25722
1308 1 11 . 1 1 643 643 LEU H H 643 7.139 7.139 7.549 -0.410 25722
1309 1 11 . 1 1 644 644 GLU N N 644 120.140 120.140 118.425 1.715 25722
1310 1 11 . 1 1 644 644 GLU H H 644 8.849 8.849 8.512 0.337 25722
1311 1 11 . 1 1 645 645 VAL N N 645 119.330 119.330 121.012 -1.682 25722
1312 1 11 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.828 0.166 25722
1313 1 11 . 1 1 645 645 VAL H H 645 7.986 7.986 8.352 -0.366 25722
1314 1 11 . 1 1 646 646 PHE N N 646 115.458 115.458 118.671 -3.213 25722
1315 1 11 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.476 -0.075 25722
1316 1 11 . 1 1 646 646 PHE H H 646 8.027 8.027 7.721 0.306 25722
1317 1 11 . 1 1 647 647 TRP N N 647 120.228 120.228 121.581 -1.353 25722
1318 1 11 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.780 -0.200 25722
1319 1 11 . 1 1 647 647 TRP H H 647 7.070 7.070 8.391 -1.321 25722
1320 1 11 . 1 1 648 648 GLY N N 648 108.000 108.000 104.723 3.277 25722
1321 1 11 . 1 1 648 648 GLY H H 648 8.245 8.245 8.165 0.080 25722
1322 1 11 . 1 1 649 649 GLN N N 649 119.516 119.516 121.119 -1.603 25722
1323 1 11 . 1 1 649 649 GLN H H 649 7.682 7.682 7.375 0.307 25722
1324 1 11 . 1 1 650 650 ASP N N 650 114.599 114.599 125.026 -10.427 25722
1325 1 11 . 1 1 650 650 ASP H H 650 7.880 7.880 8.695 -0.815 25722
1326 1 11 . 1 1 651 651 HIS N N 651 126.820 126.820 118.371 8.449 25722
1327 1 11 . 1 1 651 651 HIS H H 651 8.968 8.968 8.360 0.608 25722
1328 1 11 . 1 1 652 652 LYS N N 652 119.747 119.747 117.826 1.921 25722
1329 1 11 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.048 -0.023 25722
1330 1 11 . 1 1 653 653 VAL N N 653 120.591 120.591 115.886 4.705 25722
1331 1 11 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.589 0.221 25722
1332 1 11 . 1 1 653 653 VAL H H 653 8.290 8.290 7.687 0.603 25722
1333 1 11 . 1 1 654 654 ASP N N 654 119.962 119.962 119.509 0.453 25722
1334 1 11 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.775 -0.781 25722
1335 1 11 . 1 1 654 654 ASP H H 654 7.886 7.886 8.299 -0.413 25722
1336 1 11 . 1 1 655 655 PHE N N 655 123.205 123.205 120.307 2.898 25722
1337 1 11 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.144 0.316 25722
1338 1 11 . 1 1 655 655 PHE H H 655 8.357 8.357 7.338 1.019 25722
1339 1 11 . 1 1 656 656 ILE N N 656 122.329 122.329 117.677 4.652 25722
1340 1 11 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.804 0.326 25722
1341 1 11 . 1 1 656 656 ILE H H 656 7.150 7.150 8.643 -1.493 25722
1342 1 11 . 1 1 657 657 LEU N N 657 123.105 123.105 119.877 3.228 25722
1343 1 11 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.116 0.286 25722
1344 1 11 . 1 1 657 657 LEU H H 657 9.010 9.010 7.590 1.420 25722
1345 1 11 . 1 1 658 658 GLN N N 658 114.550 114.550 116.519 -1.969 25722
1346 1 11 . 1 1 658 658 GLN H H 658 6.964 6.964 7.604 -0.640 25722
1347 1 11 . 1 1 659 659 ARG N N 659 116.034 116.034 118.869 -2.835 25722
1348 1 11 . 1 1 659 659 ARG H H 659 7.479 7.479 7.499 -0.020 25722
1349 1 11 . 1 1 660 660 GLU N N 660 117.630 117.630 119.445 -1.815 25722
1350 1 11 . 1 1 660 660 GLU H H 660 8.835 8.835 8.572 0.263 25722
1351 1 11 . 1 1 662 662 TYR N N 662 119.800 119.800 120.517 -0.717 25722
1352 1 11 . 1 1 662 662 TYR H H 662 8.221 8.221 8.629 -0.408 25722
1353 1 11 . 1 1 663 663 CYS N N 663 118.319 118.319 116.702 1.617 25722
1354 1 11 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.985 0.345 25722
1355 1 11 . 1 1 663 663 CYS H H 663 8.233 8.233 8.451 -0.218 25722
1356 1 11 . 1 1 664 664 ARG N N 664 114.391 114.391 118.551 -4.160 25722
1357 1 11 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.108 -0.022 25722
1358 1 11 . 1 1 664 664 ARG H H 664 7.268 7.268 8.181 -0.913 25722
1359 1 11 . 1 1 665 665 ASP N N 665 122.897 122.897 119.261 3.636 25722
1360 1 11 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.346 0.244 25722
1361 1 11 . 1 1 665 665 ASP H H 665 8.620 8.620 7.571 1.049 25722
1362 1 11 . 1 1 666 666 ILE N N 666 116.620 116.620 118.896 -2.276 25722
1363 1 11 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.769 0.041 25722
1364 1 11 . 1 1 666 666 ILE H H 666 6.976 6.976 7.361 -0.385 25722
1365 1 11 . 1 1 667 667 ASN N N 667 124.762 124.762 119.137 5.625 25722
1366 1 11 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.300 0.020 25722
1367 1 11 . 1 1 667 667 ASN H H 667 7.397 7.397 7.659 -0.262 25722
1368 1 11 . 1 1 668 668 GLN N N 668 114.391 114.391 119.478 -5.087 25722
1369 1 11 . 1 1 668 668 GLN HA H 668 4.933 4.933 3.799 1.134 25722
1370 1 11 . 1 1 668 668 GLN H H 668 7.267 7.267 7.625 -0.358 25722
1371 1 11 . 1 1 669 669 LEU N N 669 121.387 121.387 121.096 0.291 25722
1372 1 11 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.770 -0.410 25722
1373 1 11 . 1 1 669 669 LEU H H 669 8.309 8.309 7.540 0.769 25722
1374 1 11 . 1 1 670 670 SER N N 670 112.305 112.305 112.751 -0.446 25722
1375 1 11 . 1 1 670 670 SER HA H 670 4.304 4.304 4.128 0.176 25722
1376 1 11 . 1 1 670 670 SER H H 670 7.448 7.448 8.596 -1.148 25722
1377 1 11 . 1 1 671 671 GLU N N 671 120.749 120.749 120.938 -0.189 25722
1378 1 11 . 1 1 671 671 GLU HA H 671 4.011 4.011 3.948 0.063 25722
1379 1 11 . 1 1 671 671 GLU H H 671 7.831 7.831 7.873 -0.042 25722
1380 1 11 . 1 1 672 672 ALA N N 672 119.688 119.688 122.160 -2.472 25722
1381 1 11 . 1 1 672 672 ALA HA H 672 4.084 4.084 3.591 0.493 25722
1382 1 11 . 1 1 672 672 ALA H H 672 7.728 7.728 6.592 1.136 25722
1383 1 11 . 1 1 673 673 LEU N N 673 119.258 119.258 118.608 0.650 25722
1384 1 11 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.036 -0.666 25722
1385 1 11 . 1 1 673 673 LEU H H 673 8.166 8.166 8.399 -0.233 25722
1386 1 11 . 1 1 674 674 LEU N N 674 121.499 121.499 119.514 1.985 25722
1387 1 11 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.225 -0.399 25722
1388 1 11 . 1 1 674 674 LEU H H 674 7.780 7.780 7.460 0.320 25722
1389 1 11 . 1 1 675 675 SER N N 675 109.742 109.742 114.800 -5.058 25722
1390 1 11 . 1 1 675 675 SER HA H 675 4.694 4.694 4.356 0.338 25722
1391 1 11 . 1 1 675 675 SER H H 675 8.277 8.277 8.484 -0.207 25722
1392 1 11 . 1 1 676 676 LEU N N 676 121.811 121.811 121.970 -0.159 25722
1393 1 11 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.180 -0.135 25722
1394 1 11 . 1 1 676 676 LEU H H 676 7.780 7.780 7.751 0.029 25722
1395 1 11 . 1 1 677 677 ASN N N 677 122.526 122.526 117.269 5.257 25722
1396 1 11 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.529 0.276 25722
1397 1 11 . 1 1 677 677 ASN H H 677 7.710 7.710 7.717 -0.007 25722
1398 1 12 . 1 1 628 628 GLY N N 628 113.006 113.006 108.907 4.099 25722
1399 1 12 . 1 1 628 628 GLY H H 628 8.727 8.727 8.604 0.123 25722
1400 1 12 . 1 1 629 629 ILE N N 629 122.730 122.730 120.440 2.290 25722
1401 1 12 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.488 -0.240 25722
1402 1 12 . 1 1 629 629 ILE H H 629 8.560 8.560 7.978 0.582 25722
1403 1 12 . 1 1 630 630 ARG N N 630 119.880 119.880 128.536 -8.656 25722
1404 1 12 . 1 1 630 630 ARG H H 630 8.029 8.029 8.582 -0.553 25722
1405 1 12 . 1 1 631 631 LYS N N 631 119.040 119.040 125.176 -6.136 25722
1406 1 12 . 1 1 631 631 LYS H H 631 8.664 8.664 8.395 0.269 25722
1407 1 12 . 1 1 632 632 THR N N 632 109.950 109.950 117.336 -7.386 25722
1408 1 12 . 1 1 632 632 THR H H 632 8.376 8.376 8.735 -0.359 25722
1409 1 12 . 1 1 633 633 ARG N N 633 120.950 120.950 120.016 0.934 25722
1410 1 12 . 1 1 633 633 ARG HA H 633 3.680 3.680 3.950 -0.270 25722
1411 1 12 . 1 1 633 633 ARG H H 633 8.017 8.017 8.489 -0.472 25722
1412 1 12 . 1 1 634 634 GLU N N 634 118.201 118.201 115.699 2.502 25722
1413 1 12 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.223 -0.143 25722
1414 1 12 . 1 1 634 634 GLU H H 634 7.260 7.260 7.989 -0.729 25722
1415 1 12 . 1 1 635 635 THR N N 635 115.274 115.274 114.039 1.235 25722
1416 1 12 . 1 1 635 635 THR H H 635 8.137 8.137 8.086 0.051 25722
1417 1 12 . 1 1 636 636 GLU N N 636 115.301 115.301 120.191 -4.890 25722
1418 1 12 . 1 1 636 636 GLU HA H 636 4.108 4.108 3.852 0.256 25722
1419 1 12 . 1 1 636 636 GLU H H 636 8.274 8.274 8.170 0.104 25722
1420 1 12 . 1 1 637 637 ARG N N 637 120.174 120.174 119.065 1.109 25722
1421 1 12 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.050 -0.291 25722
1422 1 12 . 1 1 637 637 ARG H H 637 7.810 7.810 7.701 0.109 25722
1423 1 12 . 1 1 638 638 LEU N N 638 120.658 120.658 119.895 0.763 25722
1424 1 12 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.008 -0.558 25722
1425 1 12 . 1 1 638 638 LEU H H 638 8.170 8.170 7.553 0.617 25722
1426 1 12 . 1 1 639 639 ARG N N 639 116.325 116.325 118.877 -2.552 25722
1427 1 12 . 1 1 639 639 ARG HA H 639 3.924 3.924 4.008 -0.084 25722
1428 1 12 . 1 1 639 639 ARG H H 639 7.510 7.510 7.368 0.142 25722
1429 1 12 . 1 1 640 640 ARG N N 640 117.904 117.904 117.799 0.105 25722
1430 1 12 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.096 -0.081 25722
1431 1 12 . 1 1 640 640 ARG H H 640 7.925 7.925 8.153 -0.228 25722
1432 1 12 . 1 1 641 641 GLN N N 641 118.203 118.203 117.823 0.380 25722
1433 1 12 . 1 1 641 641 GLN H H 641 8.682 8.682 7.840 0.842 25722
1434 1 12 . 1 1 643 643 LEU N N 643 119.140 119.140 121.278 -2.138 25722
1435 1 12 . 1 1 643 643 LEU H H 643 7.139 7.139 7.951 -0.812 25722
1436 1 12 . 1 1 644 644 GLU N N 644 120.140 120.140 118.224 1.916 25722
1437 1 12 . 1 1 644 644 GLU H H 644 8.849 8.849 8.186 0.663 25722
1438 1 12 . 1 1 645 645 VAL N N 645 119.330 119.330 118.065 1.265 25722
1439 1 12 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.860 0.134 25722
1440 1 12 . 1 1 645 645 VAL H H 645 7.986 7.986 8.111 -0.125 25722
1441 1 12 . 1 1 646 646 PHE N N 646 115.458 115.458 118.625 -3.167 25722
1442 1 12 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.455 -0.054 25722
1443 1 12 . 1 1 646 646 PHE H H 646 8.027 8.027 7.972 0.055 25722
1444 1 12 . 1 1 647 647 TRP N N 647 120.228 120.228 120.518 -0.290 25722
1445 1 12 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.737 -0.157 25722
1446 1 12 . 1 1 647 647 TRP H H 647 7.070 7.070 8.286 -1.216 25722
1447 1 12 . 1 1 648 648 GLY N N 648 108.000 108.000 106.311 1.689 25722
1448 1 12 . 1 1 648 648 GLY H H 648 8.245 8.245 8.667 -0.422 25722
1449 1 12 . 1 1 649 649 GLN N N 649 119.516 119.516 120.322 -0.806 25722
1450 1 12 . 1 1 649 649 GLN H H 649 7.682 7.682 7.494 0.188 25722
1451 1 12 . 1 1 650 650 ASP N N 650 114.599 114.599 124.452 -9.853 25722
1452 1 12 . 1 1 650 650 ASP H H 650 7.880 7.880 8.769 -0.889 25722
1453 1 12 . 1 1 651 651 HIS N N 651 126.820 126.820 117.293 9.527 25722
1454 1 12 . 1 1 651 651 HIS H H 651 8.968 8.968 8.241 0.727 25722
1455 1 12 . 1 1 652 652 LYS N N 652 119.747 119.747 118.824 0.923 25722
1456 1 12 . 1 1 652 652 LYS HA H 652 4.025 4.025 3.998 0.027 25722
1457 1 12 . 1 1 653 653 VAL N N 653 120.591 120.591 116.805 3.786 25722
1458 1 12 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.721 0.089 25722
1459 1 12 . 1 1 653 653 VAL H H 653 8.290 8.290 7.721 0.569 25722
1460 1 12 . 1 1 654 654 ASP N N 654 119.962 119.962 118.530 1.432 25722
1461 1 12 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.102 -0.108 25722
1462 1 12 . 1 1 654 654 ASP H H 654 7.886 7.886 7.581 0.305 25722
1463 1 12 . 1 1 655 655 PHE N N 655 123.205 123.205 119.180 4.025 25722
1464 1 12 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.134 0.326 25722
1465 1 12 . 1 1 655 655 PHE H H 655 8.357 8.357 7.178 1.179 25722
1466 1 12 . 1 1 656 656 ILE N N 656 122.329 122.329 117.652 4.677 25722
1467 1 12 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.952 0.178 25722
1468 1 12 . 1 1 656 656 ILE H H 656 7.150 7.150 8.327 -1.177 25722
1469 1 12 . 1 1 657 657 LEU N N 657 123.105 123.105 119.685 3.420 25722
1470 1 12 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.253 0.149 25722
1471 1 12 . 1 1 657 657 LEU H H 657 9.010 9.010 7.609 1.401 25722
1472 1 12 . 1 1 658 658 GLN N N 658 114.550 114.550 119.015 -4.465 25722
1473 1 12 . 1 1 658 658 GLN H H 658 6.964 6.964 7.449 -0.485 25722
1474 1 12 . 1 1 659 659 ARG N N 659 116.034 116.034 119.716 -3.682 25722
1475 1 12 . 1 1 659 659 ARG H H 659 7.479 7.479 8.427 -0.948 25722
1476 1 12 . 1 1 660 660 GLU N N 660 117.630 117.630 118.627 -0.997 25722
1477 1 12 . 1 1 660 660 GLU H H 660 8.835 8.835 7.716 1.119 25722
1478 1 12 . 1 1 662 662 TYR N N 662 119.800 119.800 118.356 1.444 25722
1479 1 12 . 1 1 662 662 TYR H H 662 8.221 8.221 8.533 -0.312 25722
1480 1 12 . 1 1 663 663 CYS N N 663 118.319 118.319 116.266 2.053 25722
1481 1 12 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.973 0.357 25722
1482 1 12 . 1 1 663 663 CYS H H 663 8.233 8.233 8.434 -0.201 25722
1483 1 12 . 1 1 664 664 ARG N N 664 114.391 114.391 119.409 -5.018 25722
1484 1 12 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.093 -0.007 25722
1485 1 12 . 1 1 664 664 ARG H H 664 7.268 7.268 8.094 -0.826 25722
1486 1 12 . 1 1 665 665 ASP N N 665 122.897 122.897 119.051 3.846 25722
1487 1 12 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.336 0.254 25722
1488 1 12 . 1 1 665 665 ASP H H 665 8.620 8.620 8.217 0.403 25722
1489 1 12 . 1 1 666 666 ILE N N 666 116.620 116.620 115.978 0.642 25722
1490 1 12 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.878 -0.068 25722
1491 1 12 . 1 1 666 666 ILE H H 666 6.976 6.976 7.536 -0.560 25722
1492 1 12 . 1 1 667 667 ASN N N 667 124.762 124.762 120.411 4.351 25722
1493 1 12 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.431 -0.111 25722
1494 1 12 . 1 1 667 667 ASN H H 667 7.397 7.397 7.707 -0.310 25722
1495 1 12 . 1 1 668 668 GLN N N 668 114.391 114.391 119.812 -5.421 25722
1496 1 12 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.538 0.395 25722
1497 1 12 . 1 1 668 668 GLN H H 668 7.267 7.267 7.623 -0.356 25722
1498 1 12 . 1 1 669 669 LEU N N 669 121.387 121.387 120.426 0.961 25722
1499 1 12 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.993 -0.633 25722
1500 1 12 . 1 1 669 669 LEU H H 669 8.309 8.309 7.702 0.607 25722
1501 1 12 . 1 1 670 670 SER N N 670 112.305 112.305 112.800 -0.495 25722
1502 1 12 . 1 1 670 670 SER HA H 670 4.304 4.304 4.228 0.076 25722
1503 1 12 . 1 1 670 670 SER H H 670 7.448 7.448 8.798 -1.350 25722
1504 1 12 . 1 1 671 671 GLU N N 671 120.749 120.749 121.373 -0.624 25722
1505 1 12 . 1 1 671 671 GLU HA H 671 4.011 4.011 4.054 -0.043 25722
1506 1 12 . 1 1 671 671 GLU H H 671 7.831 7.831 8.180 -0.349 25722
1507 1 12 . 1 1 672 672 ALA N N 672 119.688 119.688 122.796 -3.108 25722
1508 1 12 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.269 -0.185 25722
1509 1 12 . 1 1 672 672 ALA H H 672 7.728 7.728 7.831 -0.103 25722
1510 1 12 . 1 1 673 673 LEU N N 673 119.258 119.258 119.201 0.057 25722
1511 1 12 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.134 -0.764 25722
1512 1 12 . 1 1 673 673 LEU H H 673 8.166 8.166 8.437 -0.271 25722
1513 1 12 . 1 1 674 674 LEU N N 674 121.499 121.499 119.897 1.602 25722
1514 1 12 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.232 -0.406 25722
1515 1 12 . 1 1 674 674 LEU H H 674 7.780 7.780 7.575 0.205 25722
1516 1 12 . 1 1 675 675 SER N N 675 109.742 109.742 114.624 -4.882 25722
1517 1 12 . 1 1 675 675 SER HA H 675 4.694 4.694 4.324 0.370 25722
1518 1 12 . 1 1 675 675 SER H H 675 8.277 8.277 8.147 0.130 25722
1519 1 12 . 1 1 676 676 LEU N N 676 121.811 121.811 121.926 -0.115 25722
1520 1 12 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.233 -0.188 25722
1521 1 12 . 1 1 676 676 LEU H H 676 7.780 7.780 7.904 -0.124 25722
1522 1 12 . 1 1 677 677 ASN N N 677 122.526 122.526 116.951 5.575 25722
1523 1 12 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.550 0.255 25722
1524 1 12 . 1 1 677 677 ASN H H 677 7.710 7.710 7.845 -0.135 25722
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 48 3.689 0.085 3.727 25722
2 1 1 "Average Difference" HA 34 0.379 -0.018 0.384 25722
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25722
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25722
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25722
6 1 1 "Average Difference" HN 47 0.629 0.061 0.633 25722
7 1 2 "Average Difference" N 48 3.498 -0.108 3.534 25722
8 1 2 "Average Difference" HA 34 0.403 -0.038 0.407 25722
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25722
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25722
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25722
12 1 2 "Average Difference" HN 47 0.646 0.007 0.653 25722
13 1 3 "Average Difference" N 48 3.343 -0.227 3.370 25722
14 1 3 "Average Difference" HA 34 0.432 0.010 0.438 25722
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25722
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25722
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25722
18 1 3 "Average Difference" HN 47 0.549 -0.005 0.555 25722
19 1 4 "Average Difference" N 48 3.388 -0.300 3.411 25722
20 1 4 "Average Difference" HA 34 0.505 -0.017 0.512 25722
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25722
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25722
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25722
24 1 4 "Average Difference" HN 47 0.688 0.063 0.692 25722
25 1 5 "Average Difference" N 48 3.515 0.289 3.540 25722
26 1 5 "Average Difference" HA 34 0.315 0.032 0.318 25722
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25722
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25722
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25722
30 1 5 "Average Difference" HN 47 0.595 0.065 0.598 25722
31 1 6 "Average Difference" N 48 3.256 0.428 3.262 25722
32 1 6 "Average Difference" HA 34 0.350 0.045 0.353 25722
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25722
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25722
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25722
36 1 6 "Average Difference" HN 47 0.615 0.077 0.617 25722
37 1 7 "Average Difference" N 48 3.331 -0.093 3.365 25722
38 1 7 "Average Difference" HA 34 0.319 0.019 0.323 25722
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25722
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25722
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25722
42 1 7 "Average Difference" HN 47 0.625 0.079 0.627 25722
43 1 8 "Average Difference" N 48 3.446 -0.047 3.482 25722
44 1 8 "Average Difference" HA 34 0.290 0.018 0.294 25722
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25722
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25722
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25722
48 1 8 "Average Difference" HN 47 0.680 0.029 0.687 25722
49 1 9 "Average Difference" N 48 3.040 -0.163 3.067 25722
50 1 9 "Average Difference" HA 34 0.434 0.040 0.438 25722
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25722
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25722
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25722
54 1 9 "Average Difference" HN 47 0.586 0.018 0.592 25722
55 1 10 "Average Difference" N 48 3.267 -0.018 3.302 25722
56 1 10 "Average Difference" HA 34 0.358 0.051 0.359 25722
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25722
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25722
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25722
60 1 10 "Average Difference" HN 47 0.636 0.001 0.643 25722
61 1 11 "Average Difference" N 48 3.425 -0.015 3.461 25722
62 1 11 "Average Difference" HA 34 0.398 -0.032 0.402 25722
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25722
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25722
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25722
66 1 11 "Average Difference" HN 47 0.636 -0.003 0.643 25722
67 1 12 "Average Difference" N 48 3.837 0.168 3.874 25722
68 1 12 "Average Difference" HA 34 0.286 0.030 0.288 25722
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25722
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25722
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25722
72 1 12 "Average Difference" HN 47 0.627 0.062 0.631 25722
stop_
save_
save_delta_chem_shifts_average
_Entity_delta_chem_shifts.Sf_category delta_chem_shifts
_Entity_delta_chem_shifts.Sf_framecode delta_chem_shifts_average
_Entity_delta_chem_shifts.Model_type average
_Entity_delta_chem_shifts.Entry_ID 25722
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 628 628 GLY N N 628 113.006 113.006 108.801 4.205 25722
2 1 . 1 1 628 628 GLY H H 628 8.727 8.727 8.331 0.396 25722
3 1 . 1 1 629 629 ILE N N 629 122.730 122.730 118.829 3.901 25722
4 1 . 1 1 629 629 ILE HA H 629 4.248 4.248 4.407 -0.159 25722
5 1 . 1 1 629 629 ILE H H 629 8.560 8.560 8.021 0.539 25722
6 1 . 1 1 630 630 ARG N N 630 119.880 119.880 123.693 -3.813 25722
7 1 . 1 1 630 630 ARG H H 630 8.029 8.029 8.427 -0.398 25722
8 1 . 1 1 631 631 LYS N N 631 119.040 119.040 121.122 -2.082 25722
9 1 . 1 1 631 631 LYS H H 631 8.664 8.664 8.416 0.248 25722
10 1 . 1 1 632 632 THR N N 632 109.950 109.950 114.324 -4.374 25722
11 1 . 1 1 632 632 THR H H 632 8.376 8.376 8.234 0.142 25722
12 1 . 1 1 633 633 ARG N N 633 120.950 120.950 120.460 0.490 25722
13 1 . 1 1 633 633 ARG HA H 633 3.680 3.680 3.984 -0.304 25722
14 1 . 1 1 633 633 ARG H H 633 8.017 8.017 8.556 -0.539 25722
15 1 . 1 1 634 634 GLU N N 634 118.201 118.201 116.733 1.468 25722
16 1 . 1 1 634 634 GLU HA H 634 4.080 4.080 4.193 -0.113 25722
17 1 . 1 1 634 634 GLU H H 634 7.260 7.260 8.124 -0.864 25722
18 1 . 1 1 635 635 THR N N 635 115.274 115.274 114.924 0.350 25722
19 1 . 1 1 635 635 THR H H 635 8.137 8.137 7.719 0.418 25722
20 1 . 1 1 636 636 GLU N N 636 115.301 115.301 120.619 -5.318 25722
21 1 . 1 1 636 636 GLU HA H 636 4.108 4.108 4.025 0.083 25722
22 1 . 1 1 636 636 GLU H H 636 8.274 8.274 8.089 0.185 25722
23 1 . 1 1 637 637 ARG N N 637 120.174 120.174 119.577 0.597 25722
24 1 . 1 1 637 637 ARG HA H 637 3.759 3.759 4.093 -0.334 25722
25 1 . 1 1 637 637 ARG H H 637 7.810 7.810 7.654 0.155 25722
26 1 . 1 1 638 638 LEU N N 638 120.658 120.658 120.425 0.233 25722
27 1 . 1 1 638 638 LEU HA H 638 3.450 3.450 4.205 -0.755 25722
28 1 . 1 1 638 638 LEU H H 638 8.170 8.170 7.827 0.343 25722
29 1 . 1 1 639 639 ARG N N 639 116.325 116.325 117.827 -1.502 25722
30 1 . 1 1 639 639 ARG HA H 639 3.924 3.924 3.993 -0.068 25722
31 1 . 1 1 639 639 ARG H H 639 7.510 7.510 7.568 -0.058 25722
32 1 . 1 1 640 640 ARG N N 640 117.904 117.904 117.967 -0.063 25722
33 1 . 1 1 640 640 ARG HA H 640 4.015 4.015 4.110 -0.095 25722
34 1 . 1 1 640 640 ARG H H 640 7.925 7.925 7.886 0.039 25722
35 1 . 1 1 641 641 GLN N N 641 118.203 118.203 116.131 2.072 25722
36 1 . 1 1 641 641 GLN H H 641 8.682 8.682 7.878 0.804 25722
37 1 . 1 1 643 643 LEU N N 643 119.140 119.140 120.345 -1.205 25722
38 1 . 1 1 643 643 LEU H H 643 7.139 7.139 7.805 -0.666 25722
39 1 . 1 1 644 644 GLU N N 644 120.140 120.140 122.332 -2.192 25722
40 1 . 1 1 644 644 GLU H H 644 8.849 8.849 8.529 0.320 25722
41 1 . 1 1 645 645 VAL N N 645 119.330 119.330 122.809 -3.479 25722
42 1 . 1 1 645 645 VAL HA H 645 3.994 3.994 3.795 0.199 25722
43 1 . 1 1 645 645 VAL H H 645 7.986 7.986 8.119 -0.133 25722
44 1 . 1 1 646 646 PHE N N 646 115.458 115.458 118.384 -2.926 25722
45 1 . 1 1 646 646 PHE HA H 646 4.401 4.401 4.402 -0.001 25722
46 1 . 1 1 646 646 PHE H H 646 8.027 8.027 8.024 0.003 25722
47 1 . 1 1 647 647 TRP N N 647 120.228 120.228 120.866 -0.638 25722
48 1 . 1 1 647 647 TRP HA H 647 4.580 4.580 4.663 -0.083 25722
49 1 . 1 1 647 647 TRP H H 647 7.070 7.070 8.370 -1.300 25722
50 1 . 1 1 648 648 GLY N N 648 108.000 108.000 105.076 2.924 25722
51 1 . 1 1 648 648 GLY H H 648 8.245 8.245 8.390 -0.145 25722
52 1 . 1 1 649 649 GLN N N 649 119.516 119.516 120.468 -0.952 25722
53 1 . 1 1 649 649 GLN H H 649 7.682 7.682 7.784 -0.102 25722
54 1 . 1 1 650 650 ASP N N 650 114.599 114.599 119.526 -4.927 25722
55 1 . 1 1 650 650 ASP H H 650 7.880 7.880 8.492 -0.612 25722
56 1 . 1 1 651 651 HIS N N 651 126.820 126.820 119.209 7.611 25722
57 1 . 1 1 651 651 HIS H H 651 8.968 8.968 8.411 0.557 25722
58 1 . 1 1 652 652 LYS N N 652 119.747 119.747 118.384 1.363 25722
59 1 . 1 1 652 652 LYS HA H 652 4.025 4.025 4.066 -0.041 25722
60 1 . 1 1 653 653 VAL N N 653 120.591 120.591 116.328 4.263 25722
61 1 . 1 1 653 653 VAL HA H 653 3.810 3.810 3.768 0.042 25722
62 1 . 1 1 653 653 VAL H H 653 8.290 8.290 7.656 0.634 25722
63 1 . 1 1 654 654 ASP N N 654 119.962 119.962 118.741 1.221 25722
64 1 . 1 1 654 654 ASP HA H 654 3.994 3.994 4.161 -0.167 25722
65 1 . 1 1 654 654 ASP H H 654 7.886 7.886 7.934 -0.048 25722
66 1 . 1 1 655 655 PHE N N 655 123.205 123.205 119.920 3.285 25722
67 1 . 1 1 655 655 PHE HA H 655 4.460 4.460 4.214 0.246 25722
68 1 . 1 1 655 655 PHE H H 655 8.357 8.357 7.279 1.078 25722
69 1 . 1 1 656 656 ILE N N 656 122.329 122.329 117.516 4.813 25722
70 1 . 1 1 656 656 ILE HA H 656 4.130 4.130 3.826 0.304 25722
71 1 . 1 1 656 656 ILE H H 656 7.150 7.150 8.445 -1.294 25722
72 1 . 1 1 657 657 LEU N N 657 123.105 123.105 119.973 3.132 25722
73 1 . 1 1 657 657 LEU HA H 657 4.402 4.402 4.141 0.261 25722
74 1 . 1 1 657 657 LEU H H 657 9.010 9.010 7.685 1.325 25722
75 1 . 1 1 658 658 GLN N N 658 114.550 114.550 116.956 -2.406 25722
76 1 . 1 1 658 658 GLN H H 658 6.964 6.964 7.772 -0.808 25722
77 1 . 1 1 659 659 ARG N N 659 116.034 116.034 118.375 -2.341 25722
78 1 . 1 1 659 659 ARG H H 659 7.479 7.479 7.890 -0.411 25722
79 1 . 1 1 660 660 GLU N N 660 117.630 117.630 118.816 -1.186 25722
80 1 . 1 1 660 660 GLU H H 660 8.835 8.835 8.326 0.509 25722
81 1 . 1 1 662 662 TYR N N 662 119.800 119.800 120.295 -0.495 25722
82 1 . 1 1 662 662 TYR H H 662 8.221 8.221 8.558 -0.337 25722
83 1 . 1 1 663 663 CYS N N 663 118.319 118.319 116.597 1.722 25722
84 1 . 1 1 663 663 CYS HA H 663 4.330 4.330 3.980 0.350 25722
85 1 . 1 1 663 663 CYS H H 663 8.233 8.233 8.399 -0.166 25722
86 1 . 1 1 664 664 ARG N N 664 114.391 114.391 119.361 -4.971 25722
87 1 . 1 1 664 664 ARG HA H 664 4.086 4.086 4.165 -0.079 25722
88 1 . 1 1 664 664 ARG H H 664 7.268 7.268 7.995 -0.728 25722
89 1 . 1 1 665 665 ASP N N 665 122.897 122.897 119.242 3.655 25722
90 1 . 1 1 665 665 ASP HA H 665 4.590 4.590 4.341 0.249 25722
91 1 . 1 1 665 665 ASP H H 665 8.620 8.620 7.816 0.804 25722
92 1 . 1 1 666 666 ILE N N 666 116.620 116.620 118.308 -1.688 25722
93 1 . 1 1 666 666 ILE HA H 666 3.810 3.810 3.781 0.029 25722
94 1 . 1 1 666 666 ILE H H 666 6.976 6.976 7.369 -0.393 25722
95 1 . 1 1 667 667 ASN N N 667 124.762 124.762 119.471 5.291 25722
96 1 . 1 1 667 667 ASN HA H 667 4.320 4.320 4.394 -0.074 25722
97 1 . 1 1 667 667 ASN H H 667 7.397 7.397 7.670 -0.273 25722
98 1 . 1 1 668 668 GLN N N 668 114.391 114.391 119.752 -5.361 25722
99 1 . 1 1 668 668 GLN HA H 668 4.933 4.933 4.236 0.697 25722
100 1 . 1 1 668 668 GLN H H 668 7.267 7.267 7.663 -0.396 25722
101 1 . 1 1 669 669 LEU N N 669 121.387 121.387 120.581 0.806 25722
102 1 . 1 1 669 669 LEU HA H 669 3.360 3.360 3.906 -0.546 25722
103 1 . 1 1 669 669 LEU H H 669 8.309 8.309 7.644 0.665 25722
104 1 . 1 1 670 670 SER N N 670 112.305 112.305 112.856 -0.551 25722
105 1 . 1 1 670 670 SER HA H 670 4.304 4.304 4.179 0.125 25722
106 1 . 1 1 670 670 SER H H 670 7.448 7.448 8.549 -1.101 25722
107 1 . 1 1 671 671 GLU N N 671 120.749 120.749 121.176 -0.426 25722
108 1 . 1 1 671 671 GLU HA H 671 4.011 4.011 4.019 -0.008 25722
109 1 . 1 1 671 671 GLU H H 671 7.831 7.831 8.229 -0.398 25722
110 1 . 1 1 672 672 ALA N N 672 119.688 119.688 122.715 -3.027 25722
111 1 . 1 1 672 672 ALA HA H 672 4.084 4.084 4.219 -0.135 25722
112 1 . 1 1 672 672 ALA H H 672 7.728 7.728 7.527 0.201 25722
113 1 . 1 1 673 673 LEU N N 673 119.258 119.258 119.034 0.224 25722
114 1 . 1 1 673 673 LEU HA H 673 3.370 3.370 4.128 -0.757 25722
115 1 . 1 1 673 673 LEU H H 673 8.166 8.166 8.269 -0.103 25722
116 1 . 1 1 674 674 LEU N N 674 121.499 121.499 119.561 1.938 25722
117 1 . 1 1 674 674 LEU HA H 674 3.826 3.826 4.129 -0.303 25722
118 1 . 1 1 674 674 LEU H H 674 7.780 7.780 7.544 0.236 25722
119 1 . 1 1 675 675 SER N N 675 109.742 109.742 114.916 -5.174 25722
120 1 . 1 1 675 675 SER HA H 675 4.694 4.694 4.299 0.395 25722
121 1 . 1 1 675 675 SER H H 675 8.277 8.277 8.272 0.005 25722
122 1 . 1 1 676 676 LEU N N 676 121.811 121.811 121.903 -0.092 25722
123 1 . 1 1 676 676 LEU HA H 676 4.045 4.045 4.205 -0.160 25722
124 1 . 1 1 676 676 LEU H H 676 7.780 7.780 7.820 -0.040 25722
125 1 . 1 1 677 677 ASN N N 677 122.526 122.526 116.898 5.628 25722
126 1 . 1 1 677 677 ASN HA H 677 4.805 4.805 4.560 0.245 25722
127 1 . 1 1 677 677 ASN H H 677 7.710 7.710 7.787 -0.077 25722
stop_
save_