data_19514
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19514
_Entry.PDB_ID 2ME3
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 19514
_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 1 658 658 LYS HA H 658 4.273 4.273 4.499 -0.226 19514
2 1 1 . 1 1 658 658 LYS C C 658 175.560 175.560 175.188 0.372 19514
3 1 1 . 1 1 658 658 LYS CA C 658 56.733 56.733 56.180 0.553 19514
4 1 1 . 1 1 658 658 LYS CB C 658 32.982 32.982 32.651 0.331 19514
5 1 1 . 1 1 659 659 ASP N N 659 121.529 121.529 120.013 1.516 19514
6 1 1 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.557 0.029 19514
7 1 1 . 1 1 659 659 ASP C C 659 176.458 176.458 178.266 -1.808 19514
8 1 1 . 1 1 659 659 ASP CA C 659 54.219 54.219 53.693 0.526 19514
9 1 1 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.881 -0.557 19514
10 1 1 . 1 1 659 659 ASP H H 659 8.329 8.329 7.961 0.368 19514
11 1 1 . 1 1 660 660 LEU N N 660 123.060 123.060 120.379 2.681 19514
12 1 1 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.305 -0.111 19514
13 1 1 . 1 1 660 660 LEU C C 660 177.101 177.101 177.791 -0.690 19514
14 1 1 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.228 0.336 19514
15 1 1 . 1 1 660 660 LEU CB C 660 42.489 42.489 41.778 0.711 19514
16 1 1 . 1 1 660 660 LEU H H 660 8.490 8.490 8.516 -0.026 19514
17 1 1 . 1 1 661 661 LEU N N 661 118.573 118.573 118.611 -0.038 19514
18 1 1 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.454 -0.105 19514
19 1 1 . 1 1 661 661 LEU C C 661 176.328 176.328 176.013 0.315 19514
20 1 1 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.062 0.757 19514
21 1 1 . 1 1 661 661 LEU CB C 661 41.778 41.778 40.075 1.703 19514
22 1 1 . 1 1 661 661 LEU H H 661 8.114 8.114 7.908 0.206 19514
23 1 1 . 1 1 662 662 ALA N N 662 122.836 122.836 123.102 -0.266 19514
24 1 1 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.210 0.195 19514
25 1 1 . 1 1 662 662 ALA C C 662 177.949 177.949 178.096 -0.147 19514
26 1 1 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.324 -0.187 19514
27 1 1 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.577 0.846 19514
28 1 1 . 1 1 662 662 ALA H H 662 7.849 7.849 7.498 0.351 19514
29 1 1 . 1 1 663 663 LEU N N 663 121.289 121.289 126.023 -4.734 19514
30 1 1 . 1 1 663 663 LEU HA H 663 4.185 4.185 3.887 0.298 19514
31 1 1 . 1 1 663 663 LEU C C 663 177.903 177.903 178.267 -0.364 19514
32 1 1 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.634 -0.977 19514
33 1 1 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.636 0.309 19514
34 1 1 . 1 1 663 663 LEU H H 663 8.302 8.302 8.732 -0.430 19514
35 1 1 . 1 1 664 664 ASP N N 664 118.100 118.100 118.028 0.072 19514
36 1 1 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.516 -0.097 19514
37 1 1 . 1 1 664 664 ASP C C 664 177.559 177.559 177.890 -0.331 19514
38 1 1 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.086 -0.779 19514
39 1 1 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.517 0.372 19514
40 1 1 . 1 1 664 664 ASP H H 664 8.437 8.437 8.546 -0.109 19514
41 1 1 . 1 1 665 665 SER N N 665 113.890 113.890 114.117 -0.227 19514
42 1 1 . 1 1 665 665 SER HA H 665 4.348 4.348 4.453 -0.105 19514
43 1 1 . 1 1 665 665 SER C C 665 175.610 175.610 176.629 -1.019 19514
44 1 1 . 1 1 665 665 SER CA C 665 59.988 59.988 59.555 0.433 19514
45 1 1 . 1 1 665 665 SER CB C 665 63.470 63.470 63.823 -0.353 19514
46 1 1 . 1 1 665 665 SER H H 665 7.894 7.894 8.115 -0.221 19514
47 1 1 . 1 1 666 666 TRP N N 666 122.515 122.515 124.102 -1.587 19514
48 1 1 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.085 0.395 19514
49 1 1 . 1 1 666 666 TRP C C 666 177.235 177.235 177.476 -0.241 19514
50 1 1 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.941 -1.921 19514
51 1 1 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.277 0.161 19514
52 1 1 . 1 1 666 666 TRP H H 666 8.038 8.038 8.592 -0.554 19514
53 1 1 . 1 1 667 667 LYS N N 667 118.444 118.444 118.866 -0.422 19514
54 1 1 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.948 -0.031 19514
55 1 1 . 1 1 667 667 LYS C C 667 177.985 177.985 178.798 -0.813 19514
56 1 1 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.851 -0.365 19514
57 1 1 . 1 1 667 667 LYS CB C 667 32.300 32.300 32.012 0.288 19514
58 1 1 . 1 1 667 667 LYS H H 667 7.882 7.882 8.051 -0.169 19514
59 1 1 . 1 1 668 668 ASN N N 668 116.413 116.413 117.955 -1.542 19514
60 1 1 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.521 0.107 19514
61 1 1 . 1 1 668 668 ASN C C 668 177.013 177.013 177.451 -0.438 19514
62 1 1 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.814 -0.775 19514
63 1 1 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.250 0.047 19514
64 1 1 . 1 1 668 668 ASN H H 668 8.045 8.045 7.547 0.498 19514
65 1 1 . 1 1 669 669 LEU N N 669 120.829 120.829 121.836 -1.007 19514
66 1 1 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.447 0.577 19514
67 1 1 . 1 1 669 669 LEU C C 669 177.559 177.559 177.971 -0.412 19514
68 1 1 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.796 0.145 19514
69 1 1 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.520 0.636 19514
70 1 1 . 1 1 669 669 LEU H H 669 7.804 7.804 7.547 0.257 19514
71 1 1 . 1 1 670 670 TRP N N 670 117.321 117.321 117.336 -0.015 19514
72 1 1 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.509 0.035 19514
73 1 1 . 1 1 670 670 TRP C C 670 177.194 177.194 177.596 -0.402 19514
74 1 1 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.735 0.268 19514
75 1 1 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.562 0.152 19514
76 1 1 . 1 1 670 670 TRP H H 670 7.887 7.887 7.865 0.022 19514
77 1 1 . 1 1 671 671 ASN N N 671 115.549 115.549 114.938 0.611 19514
78 1 1 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.803 -0.253 19514
79 1 1 . 1 1 671 671 ASN C C 671 176.520 176.520 176.344 0.176 19514
80 1 1 . 1 1 671 671 ASN CA C 671 55.017 55.017 55.645 -0.628 19514
81 1 1 . 1 1 671 671 ASN CB C 671 38.658 38.658 39.148 -0.490 19514
82 1 1 . 1 1 671 671 ASN H H 671 7.968 7.968 7.880 0.088 19514
83 1 1 . 1 1 672 672 TRP N N 672 120.350 120.350 119.604 0.746 19514
84 1 1 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.264 0.128 19514
85 1 1 . 1 1 672 672 TRP C C 672 176.592 176.592 177.561 -0.969 19514
86 1 1 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.310 -0.954 19514
87 1 1 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.283 0.163 19514
88 1 1 . 1 1 672 672 TRP H H 672 8.013 8.013 7.568 0.445 19514
89 1 1 . 1 1 673 673 PHE N N 673 117.559 117.559 117.875 -0.316 19514
90 1 1 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.543 -0.284 19514
91 1 1 . 1 1 673 673 PHE C C 673 175.068 175.068 176.495 -1.427 19514
92 1 1 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.817 0.046 19514
93 1 1 . 1 1 673 673 PHE CB C 673 39.298 39.298 37.870 1.428 19514
94 1 1 . 1 1 673 673 PHE H H 673 7.881 7.881 7.686 0.195 19514
95 1 1 . 1 1 674 674 ASN N N 674 118.329 118.329 125.032 -6.703 19514
96 1 1 . 1 1 674 674 ASN HA H 674 4.569 4.569 4.949 -0.380 19514
97 1 1 . 1 1 674 674 ASN C C 674 175.956 175.956 175.838 0.118 19514
98 1 1 . 1 1 674 674 ASN CA C 674 53.378 53.378 51.635 1.743 19514
99 1 1 . 1 1 674 674 ASN CB C 674 38.420 38.420 37.241 1.179 19514
100 1 1 . 1 1 674 674 ASN H H 674 7.750 7.750 8.705 -0.955 19514
101 1 1 . 1 1 675 675 ILE N N 675 119.444 119.444 116.428 3.016 19514
102 1 1 . 1 1 675 675 ILE HA H 675 3.727 3.727 2.289 1.438 19514
103 1 1 . 1 1 675 675 ILE C C 675 176.638 176.638 176.812 -0.174 19514
104 1 1 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.464 -1.360 19514
105 1 1 . 1 1 675 675 ILE CB C 675 38.280 38.280 36.863 1.417 19514
106 1 1 . 1 1 675 675 ILE H H 675 8.015 8.015 7.413 0.602 19514
107 1 1 . 1 1 676 676 THR N N 676 114.109 114.109 113.087 1.022 19514
108 1 1 . 1 1 676 676 THR HA H 676 3.913 3.913 3.791 0.122 19514
109 1 1 . 1 1 676 676 THR C C 676 175.587 175.587 176.663 -1.076 19514
110 1 1 . 1 1 676 676 THR CA C 676 65.121 65.121 66.578 -1.457 19514
111 1 1 . 1 1 676 676 THR CB C 676 68.794 68.794 68.464 0.330 19514
112 1 1 . 1 1 676 676 THR H H 676 7.889 7.889 8.262 -0.373 19514
113 1 1 . 1 1 677 677 ASN N N 677 118.858 118.858 119.142 -0.284 19514
114 1 1 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.566 0.014 19514
115 1 1 . 1 1 677 677 ASN C C 677 176.077 176.077 177.604 -1.527 19514
116 1 1 . 1 1 677 677 ASN CA C 677 54.605 54.605 56.035 -1.429 19514
117 1 1 . 1 1 677 677 ASN CB C 677 38.308 38.308 39.041 -0.733 19514
118 1 1 . 1 1 677 677 ASN H H 677 7.862 7.862 8.188 -0.326 19514
119 1 1 . 1 1 678 678 TRP N N 678 119.189 119.189 118.413 0.776 19514
120 1 1 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.961 -0.344 19514
121 1 1 . 1 1 678 678 TRP C C 678 176.898 176.898 178.224 -1.326 19514
122 1 1 . 1 1 678 678 TRP CA C 678 58.582 58.582 58.077 0.505 19514
123 1 1 . 1 1 678 678 TRP CB C 678 29.597 29.597 29.042 0.555 19514
124 1 1 . 1 1 678 678 TRP H H 678 7.795 7.795 7.644 0.151 19514
125 1 1 . 1 1 679 679 LEU N N 679 117.805 117.805 121.526 -3.721 19514
126 1 1 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.154 -0.131 19514
127 1 1 . 1 1 679 679 LEU C C 679 177.463 177.463 179.005 -1.542 19514
128 1 1 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.260 -0.484 19514
129 1 1 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.176 0.599 19514
130 1 1 . 1 1 679 679 LEU H H 679 7.753 7.753 8.618 -0.865 19514
131 1 1 . 1 1 680 680 TRP N N 680 117.351 117.351 121.366 -4.015 19514
132 1 1 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.454 -0.122 19514
133 1 1 . 1 1 680 680 TRP C C 680 176.369 176.369 176.940 -0.571 19514
134 1 1 . 1 1 680 680 TRP CA C 680 58.967 58.967 59.591 -0.624 19514
135 1 1 . 1 1 680 680 TRP CB C 680 29.189 29.189 28.125 1.064 19514
136 1 1 . 1 1 680 680 TRP H H 680 7.542 7.542 8.178 -0.636 19514
137 1 1 . 1 1 681 681 TYR N N 681 116.232 116.232 117.424 -1.192 19514
138 1 1 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.174 -0.039 19514
139 1 1 . 1 1 681 681 TYR C C 681 175.623 175.623 176.111 -0.488 19514
140 1 1 . 1 1 681 681 TYR CA C 681 59.749 59.749 55.373 4.376 19514
141 1 1 . 1 1 681 681 TYR CB C 681 39.096 39.096 37.919 1.177 19514
142 1 1 . 1 1 681 681 TYR H H 681 7.453 7.453 7.721 -0.268 19514
143 1 1 . 1 1 682 682 ILE N N 682 115.034 115.034 116.587 -1.553 19514
144 1 1 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.622 0.563 19514
145 1 1 . 1 1 682 682 ILE C C 682 174.299 174.299 176.632 -2.333 19514
146 1 1 . 1 1 682 682 ILE CA C 682 61.161 61.161 62.033 -0.872 19514
147 1 1 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.268 0.518 19514
148 1 1 . 1 1 682 682 ILE H H 682 7.477 7.477 8.126 -0.649 19514
149 1 2 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.056 0.217 19514
150 1 2 . 1 1 658 658 LYS C C 658 175.560 175.560 175.330 0.230 19514
151 1 2 . 1 1 658 658 LYS CA C 658 56.733 56.733 56.917 -0.184 19514
152 1 2 . 1 1 658 658 LYS CB C 658 32.982 32.982 32.660 0.322 19514
153 1 2 . 1 1 659 659 ASP N N 659 121.529 121.529 119.102 2.427 19514
154 1 2 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.609 -0.023 19514
155 1 2 . 1 1 659 659 ASP C C 659 176.458 176.458 178.042 -1.584 19514
156 1 2 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.679 -0.460 19514
157 1 2 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.469 -0.145 19514
158 1 2 . 1 1 659 659 ASP H H 659 8.329 8.329 8.274 0.055 19514
159 1 2 . 1 1 660 660 LEU N N 660 123.060 123.060 121.370 1.690 19514
160 1 2 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.328 -0.134 19514
161 1 2 . 1 1 660 660 LEU C C 660 177.101 177.101 177.631 -0.530 19514
162 1 2 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.190 0.374 19514
163 1 2 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.341 0.148 19514
164 1 2 . 1 1 660 660 LEU H H 660 8.490 8.490 8.634 -0.144 19514
165 1 2 . 1 1 661 661 LEU N N 661 118.573 118.573 119.411 -0.838 19514
166 1 2 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.390 -0.041 19514
167 1 2 . 1 1 661 661 LEU C C 661 176.328 176.328 176.070 0.258 19514
168 1 2 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.079 0.740 19514
169 1 2 . 1 1 661 661 LEU CB C 661 41.778 41.778 40.070 1.708 19514
170 1 2 . 1 1 661 661 LEU H H 661 8.114 8.114 7.775 0.339 19514
171 1 2 . 1 1 662 662 ALA N N 662 122.836 122.836 122.757 0.079 19514
172 1 2 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.236 0.169 19514
173 1 2 . 1 1 662 662 ALA C C 662 177.949 177.949 178.528 -0.579 19514
174 1 2 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.517 -0.380 19514
175 1 2 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.594 0.829 19514
176 1 2 . 1 1 662 662 ALA H H 662 7.849 7.849 7.547 0.302 19514
177 1 2 . 1 1 663 663 LEU N N 663 121.289 121.289 125.913 -4.624 19514
178 1 2 . 1 1 663 663 LEU HA H 663 4.185 4.185 3.914 0.271 19514
179 1 2 . 1 1 663 663 LEU C C 663 177.903 177.903 178.443 -0.540 19514
180 1 2 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.604 -0.947 19514
181 1 2 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.645 0.300 19514
182 1 2 . 1 1 663 663 LEU H H 663 8.302 8.302 8.716 -0.414 19514
183 1 2 . 1 1 664 664 ASP N N 664 118.100 118.100 118.408 -0.308 19514
184 1 2 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.513 -0.094 19514
185 1 2 . 1 1 664 664 ASP C C 664 177.559 177.559 177.890 -0.331 19514
186 1 2 . 1 1 664 664 ASP CA C 664 56.307 56.307 56.965 -0.658 19514
187 1 2 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.668 0.222 19514
188 1 2 . 1 1 664 664 ASP H H 664 8.437 8.437 8.490 -0.053 19514
189 1 2 . 1 1 665 665 SER N N 665 113.890 113.890 113.977 -0.087 19514
190 1 2 . 1 1 665 665 SER HA H 665 4.348 4.348 4.455 -0.107 19514
191 1 2 . 1 1 665 665 SER C C 665 175.610 175.610 176.778 -1.168 19514
192 1 2 . 1 1 665 665 SER CA C 665 59.988 59.988 59.461 0.527 19514
193 1 2 . 1 1 665 665 SER CB C 665 63.470 63.470 63.824 -0.353 19514
194 1 2 . 1 1 665 665 SER H H 665 7.894 7.894 8.059 -0.165 19514
195 1 2 . 1 1 666 666 TRP N N 666 122.515 122.515 123.696 -1.181 19514
196 1 2 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.179 0.301 19514
197 1 2 . 1 1 666 666 TRP C C 666 177.235 177.235 177.220 0.015 19514
198 1 2 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.500 -1.480 19514
199 1 2 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.379 0.059 19514
200 1 2 . 1 1 666 666 TRP H H 666 8.038 8.038 8.385 -0.347 19514
201 1 2 . 1 1 667 667 LYS N N 667 118.444 118.444 118.614 -0.170 19514
202 1 2 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.955 -0.038 19514
203 1 2 . 1 1 667 667 LYS C C 667 177.985 177.985 178.584 -0.599 19514
204 1 2 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.730 -0.244 19514
205 1 2 . 1 1 667 667 LYS CB C 667 32.300 32.300 31.902 0.398 19514
206 1 2 . 1 1 667 667 LYS H H 667 7.882 7.882 8.173 -0.291 19514
207 1 2 . 1 1 668 668 ASN N N 668 116.413 116.413 117.172 -0.759 19514
208 1 2 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.544 0.084 19514
209 1 2 . 1 1 668 668 ASN C C 668 177.013 177.013 177.293 -0.280 19514
210 1 2 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.710 -0.671 19514
211 1 2 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.003 0.294 19514
212 1 2 . 1 1 668 668 ASN H H 668 8.045 8.045 7.633 0.412 19514
213 1 2 . 1 1 669 669 LEU N N 669 120.829 120.829 121.593 -0.764 19514
214 1 2 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.621 0.403 19514
215 1 2 . 1 1 669 669 LEU C C 669 177.559 177.559 178.277 -0.718 19514
216 1 2 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.806 0.135 19514
217 1 2 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.593 0.563 19514
218 1 2 . 1 1 669 669 LEU H H 669 7.804 7.804 7.592 0.212 19514
219 1 2 . 1 1 670 670 TRP N N 670 117.321 117.321 117.584 -0.263 19514
220 1 2 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.480 0.064 19514
221 1 2 . 1 1 670 670 TRP C C 670 177.194 177.194 177.704 -0.510 19514
222 1 2 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.796 0.207 19514
223 1 2 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.605 0.109 19514
224 1 2 . 1 1 670 670 TRP H H 670 7.887 7.887 7.878 0.009 19514
225 1 2 . 1 1 671 671 ASN N N 671 115.549 115.549 114.934 0.615 19514
226 1 2 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.804 -0.254 19514
227 1 2 . 1 1 671 671 ASN C C 671 176.520 176.520 176.545 -0.025 19514
228 1 2 . 1 1 671 671 ASN CA C 671 55.017 55.017 55.475 -0.458 19514
229 1 2 . 1 1 671 671 ASN CB C 671 38.658 38.658 39.218 -0.560 19514
230 1 2 . 1 1 671 671 ASN H H 671 7.968 7.968 7.886 0.082 19514
231 1 2 . 1 1 672 672 TRP N N 672 120.350 120.350 120.432 -0.082 19514
232 1 2 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.266 0.126 19514
233 1 2 . 1 1 672 672 TRP C C 672 176.592 176.592 177.752 -1.160 19514
234 1 2 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.783 -1.427 19514
235 1 2 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.212 0.234 19514
236 1 2 . 1 1 672 672 TRP H H 672 8.013 8.013 7.702 0.311 19514
237 1 2 . 1 1 673 673 PHE N N 673 117.559 117.559 117.243 0.316 19514
238 1 2 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.583 -0.324 19514
239 1 2 . 1 1 673 673 PHE C C 673 175.068 175.068 175.477 -0.409 19514
240 1 2 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.860 0.003 19514
241 1 2 . 1 1 673 673 PHE CB C 673 39.298 39.298 36.778 2.520 19514
242 1 2 . 1 1 673 673 PHE H H 673 7.881 7.881 8.032 -0.151 19514
243 1 2 . 1 1 674 674 ASN N N 674 118.329 118.329 122.074 -3.745 19514
244 1 2 . 1 1 674 674 ASN HA H 674 4.569 4.569 5.043 -0.474 19514
245 1 2 . 1 1 674 674 ASN C C 674 175.956 175.956 176.037 -0.081 19514
246 1 2 . 1 1 674 674 ASN CA C 674 53.378 53.378 52.642 0.736 19514
247 1 2 . 1 1 674 674 ASN CB C 674 38.420 38.420 38.630 -0.210 19514
248 1 2 . 1 1 674 674 ASN H H 674 7.750 7.750 8.914 -1.164 19514
249 1 2 . 1 1 675 675 ILE N N 675 119.444 119.444 123.514 -4.070 19514
250 1 2 . 1 1 675 675 ILE HA H 675 3.727 3.727 1.558 2.169 19514
251 1 2 . 1 1 675 675 ILE C C 675 176.638 176.638 176.809 -0.171 19514
252 1 2 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.281 -1.177 19514
253 1 2 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.059 1.220 19514
254 1 2 . 1 1 675 675 ILE H H 675 8.015 8.015 7.947 0.068 19514
255 1 2 . 1 1 676 676 THR N N 676 114.109 114.109 115.138 -1.029 19514
256 1 2 . 1 1 676 676 THR HA H 676 3.913 3.913 3.804 0.109 19514
257 1 2 . 1 1 676 676 THR C C 676 175.587 175.587 176.368 -0.781 19514
258 1 2 . 1 1 676 676 THR CA C 676 65.121 65.121 66.459 -1.338 19514
259 1 2 . 1 1 676 676 THR CB C 676 68.794 68.794 68.184 0.610 19514
260 1 2 . 1 1 676 676 THR H H 676 7.889 7.889 8.192 -0.303 19514
261 1 2 . 1 1 677 677 ASN N N 677 118.858 118.858 119.633 -0.775 19514
262 1 2 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.552 0.028 19514
263 1 2 . 1 1 677 677 ASN C C 677 176.077 176.077 177.542 -1.465 19514
264 1 2 . 1 1 677 677 ASN CA C 677 54.605 54.605 56.091 -1.486 19514
265 1 2 . 1 1 677 677 ASN CB C 677 38.308 38.308 38.859 -0.551 19514
266 1 2 . 1 1 677 677 ASN H H 677 7.862 7.862 7.838 0.024 19514
267 1 2 . 1 1 678 678 TRP N N 678 119.189 119.189 118.281 0.908 19514
268 1 2 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.888 -0.271 19514
269 1 2 . 1 1 678 678 TRP C C 678 176.898 176.898 177.925 -1.027 19514
270 1 2 . 1 1 678 678 TRP CA C 678 58.582 58.582 57.539 1.043 19514
271 1 2 . 1 1 678 678 TRP CB C 678 29.597 29.597 28.939 0.658 19514
272 1 2 . 1 1 678 678 TRP H H 678 7.795 7.795 7.544 0.251 19514
273 1 2 . 1 1 679 679 LEU N N 679 117.805 117.805 121.657 -3.852 19514
274 1 2 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.199 -0.176 19514
275 1 2 . 1 1 679 679 LEU C C 679 177.463 177.463 178.983 -1.520 19514
276 1 2 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.385 -0.609 19514
277 1 2 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.234 0.541 19514
278 1 2 . 1 1 679 679 LEU H H 679 7.753 7.753 8.664 -0.911 19514
279 1 2 . 1 1 680 680 TRP N N 680 117.351 117.351 121.458 -4.107 19514
280 1 2 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.368 -0.036 19514
281 1 2 . 1 1 680 680 TRP C C 680 176.369 176.369 176.837 -0.468 19514
282 1 2 . 1 1 680 680 TRP CA C 680 58.967 58.967 59.668 -0.701 19514
283 1 2 . 1 1 680 680 TRP CB C 680 29.189 29.189 28.076 1.113 19514
284 1 2 . 1 1 680 680 TRP H H 680 7.542 7.542 8.137 -0.595 19514
285 1 2 . 1 1 681 681 TYR N N 681 116.232 116.232 118.515 -2.283 19514
286 1 2 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.087 0.048 19514
287 1 2 . 1 1 681 681 TYR C C 681 175.623 175.623 176.047 -0.424 19514
288 1 2 . 1 1 681 681 TYR CA C 681 59.749 59.749 55.573 4.176 19514
289 1 2 . 1 1 681 681 TYR CB C 681 39.096 39.096 37.625 1.471 19514
290 1 2 . 1 1 681 681 TYR H H 681 7.453 7.453 7.842 -0.389 19514
291 1 2 . 1 1 682 682 ILE N N 682 115.034 115.034 118.087 -3.053 19514
292 1 2 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.625 0.560 19514
293 1 2 . 1 1 682 682 ILE C C 682 174.299 174.299 176.301 -2.002 19514
294 1 2 . 1 1 682 682 ILE CA C 682 61.161 61.161 61.995 -0.834 19514
295 1 2 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.184 0.602 19514
296 1 2 . 1 1 682 682 ILE H H 682 7.477 7.477 8.160 -0.683 19514
297 1 3 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.601 -0.328 19514
298 1 3 . 1 1 658 658 LYS C C 658 175.560 175.560 175.624 -0.064 19514
299 1 3 . 1 1 658 658 LYS CA C 658 56.733 56.733 55.886 0.847 19514
300 1 3 . 1 1 658 658 LYS CB C 658 32.982 32.982 32.744 0.238 19514
301 1 3 . 1 1 659 659 ASP N N 659 121.529 121.529 120.839 0.690 19514
302 1 3 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.569 0.017 19514
303 1 3 . 1 1 659 659 ASP C C 659 176.458 176.458 177.657 -1.199 19514
304 1 3 . 1 1 659 659 ASP CA C 659 54.219 54.219 53.826 0.393 19514
305 1 3 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.729 -0.405 19514
306 1 3 . 1 1 659 659 ASP H H 659 8.329 8.329 7.980 0.349 19514
307 1 3 . 1 1 660 660 LEU N N 660 123.060 123.060 120.736 2.324 19514
308 1 3 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.376 -0.182 19514
309 1 3 . 1 1 660 660 LEU C C 660 177.101 177.101 177.431 -0.330 19514
310 1 3 . 1 1 660 660 LEU CA C 660 56.564 56.564 55.998 0.566 19514
311 1 3 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.494 -0.005 19514
312 1 3 . 1 1 660 660 LEU H H 660 8.490 8.490 8.451 0.039 19514
313 1 3 . 1 1 661 661 LEU N N 661 118.573 118.573 119.521 -0.948 19514
314 1 3 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.415 -0.066 19514
315 1 3 . 1 1 661 661 LEU C C 661 176.328 176.328 176.038 0.290 19514
316 1 3 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.119 0.700 19514
317 1 3 . 1 1 661 661 LEU CB C 661 41.778 41.778 40.168 1.610 19514
318 1 3 . 1 1 661 661 LEU H H 661 8.114 8.114 7.828 0.286 19514
319 1 3 . 1 1 662 662 ALA N N 662 122.836 122.836 123.008 -0.172 19514
320 1 3 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.210 0.195 19514
321 1 3 . 1 1 662 662 ALA C C 662 177.949 177.949 178.112 -0.163 19514
322 1 3 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.294 -0.157 19514
323 1 3 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.572 0.851 19514
324 1 3 . 1 1 662 662 ALA H H 662 7.849 7.849 7.705 0.144 19514
325 1 3 . 1 1 663 663 LEU N N 663 121.289 121.289 125.457 -4.168 19514
326 1 3 . 1 1 663 663 LEU HA H 663 4.185 4.185 3.884 0.301 19514
327 1 3 . 1 1 663 663 LEU C C 663 177.903 177.903 177.977 -0.074 19514
328 1 3 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.759 -1.102 19514
329 1 3 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.751 0.194 19514
330 1 3 . 1 1 663 663 LEU H H 663 8.302 8.302 8.722 -0.420 19514
331 1 3 . 1 1 664 664 ASP N N 664 118.100 118.100 117.931 0.169 19514
332 1 3 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.536 -0.117 19514
333 1 3 . 1 1 664 664 ASP C C 664 177.559 177.559 177.844 -0.285 19514
334 1 3 . 1 1 664 664 ASP CA C 664 56.307 56.307 56.909 -0.602 19514
335 1 3 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.314 0.576 19514
336 1 3 . 1 1 664 664 ASP H H 664 8.437 8.437 8.575 -0.138 19514
337 1 3 . 1 1 665 665 SER N N 665 113.890 113.890 113.620 0.270 19514
338 1 3 . 1 1 665 665 SER HA H 665 4.348 4.348 4.462 -0.114 19514
339 1 3 . 1 1 665 665 SER C C 665 175.610 175.610 176.538 -0.928 19514
340 1 3 . 1 1 665 665 SER CA C 665 59.988 59.988 59.529 0.459 19514
341 1 3 . 1 1 665 665 SER CB C 665 63.470 63.470 63.779 -0.309 19514
342 1 3 . 1 1 665 665 SER H H 665 7.894 7.894 8.092 -0.198 19514
343 1 3 . 1 1 666 666 TRP N N 666 122.515 122.515 123.645 -1.130 19514
344 1 3 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.168 0.312 19514
345 1 3 . 1 1 666 666 TRP C C 666 177.235 177.235 177.081 0.154 19514
346 1 3 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.629 -1.609 19514
347 1 3 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.356 0.082 19514
348 1 3 . 1 1 666 666 TRP H H 666 8.038 8.038 8.426 -0.388 19514
349 1 3 . 1 1 667 667 LYS N N 667 118.444 118.444 118.956 -0.512 19514
350 1 3 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.910 0.007 19514
351 1 3 . 1 1 667 667 LYS C C 667 177.985 177.985 178.317 -0.332 19514
352 1 3 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.816 -0.330 19514
353 1 3 . 1 1 667 667 LYS CB C 667 32.300 32.300 32.144 0.156 19514
354 1 3 . 1 1 667 667 LYS H H 667 7.882 7.882 8.163 -0.281 19514
355 1 3 . 1 1 668 668 ASN N N 668 116.413 116.413 117.026 -0.613 19514
356 1 3 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.532 0.096 19514
357 1 3 . 1 1 668 668 ASN C C 668 177.013 177.013 177.258 -0.245 19514
358 1 3 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.786 -0.747 19514
359 1 3 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.172 0.125 19514
360 1 3 . 1 1 668 668 ASN H H 668 8.045 8.045 7.642 0.403 19514
361 1 3 . 1 1 669 669 LEU N N 669 120.829 120.829 121.592 -0.763 19514
362 1 3 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.572 0.452 19514
363 1 3 . 1 1 669 669 LEU C C 669 177.559 177.559 178.135 -0.576 19514
364 1 3 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.705 0.236 19514
365 1 3 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.584 0.572 19514
366 1 3 . 1 1 669 669 LEU H H 669 7.804 7.804 7.617 0.187 19514
367 1 3 . 1 1 670 670 TRP N N 670 117.321 117.321 117.691 -0.370 19514
368 1 3 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.422 0.122 19514
369 1 3 . 1 1 670 670 TRP C C 670 177.194 177.194 177.647 -0.453 19514
370 1 3 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.722 0.281 19514
371 1 3 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.614 0.100 19514
372 1 3 . 1 1 670 670 TRP H H 670 7.887 7.887 7.863 0.024 19514
373 1 3 . 1 1 671 671 ASN N N 671 115.549 115.549 115.183 0.366 19514
374 1 3 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.950 -0.400 19514
375 1 3 . 1 1 671 671 ASN C C 671 176.520 176.520 176.903 -0.383 19514
376 1 3 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.721 0.296 19514
377 1 3 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.741 -0.083 19514
378 1 3 . 1 1 671 671 ASN H H 671 7.968 7.968 7.871 0.097 19514
379 1 3 . 1 1 672 672 TRP N N 672 120.350 120.350 121.364 -1.014 19514
380 1 3 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.256 0.136 19514
381 1 3 . 1 1 672 672 TRP C C 672 176.592 176.592 178.629 -2.037 19514
382 1 3 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.942 -1.586 19514
383 1 3 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.175 0.271 19514
384 1 3 . 1 1 672 672 TRP H H 672 8.013 8.013 7.722 0.291 19514
385 1 3 . 1 1 673 673 PHE N N 673 117.559 117.559 117.314 0.245 19514
386 1 3 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.551 -0.292 19514
387 1 3 . 1 1 673 673 PHE C C 673 175.068 175.068 175.101 -0.033 19514
388 1 3 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.115 0.748 19514
389 1 3 . 1 1 673 673 PHE CB C 673 39.298 39.298 36.605 2.692 19514
390 1 3 . 1 1 673 673 PHE H H 673 7.881 7.881 7.910 -0.029 19514
391 1 3 . 1 1 674 674 ASN N N 674 118.329 118.329 121.634 -3.305 19514
392 1 3 . 1 1 674 674 ASN HA H 674 4.569 4.569 5.030 -0.461 19514
393 1 3 . 1 1 674 674 ASN C C 674 175.956 175.956 176.097 -0.141 19514
394 1 3 . 1 1 674 674 ASN CA C 674 53.378 53.378 52.562 0.816 19514
395 1 3 . 1 1 674 674 ASN CB C 674 38.420 38.420 39.167 -0.747 19514
396 1 3 . 1 1 674 674 ASN H H 674 7.750 7.750 8.534 -0.784 19514
397 1 3 . 1 1 675 675 ILE N N 675 119.444 119.444 125.006 -5.562 19514
398 1 3 . 1 1 675 675 ILE HA H 675 3.727 3.727 3.853 -0.126 19514
399 1 3 . 1 1 675 675 ILE C C 675 176.638 176.638 177.815 -1.177 19514
400 1 3 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.574 -1.470 19514
401 1 3 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.852 0.428 19514
402 1 3 . 1 1 675 675 ILE H H 675 8.015 8.015 8.237 -0.222 19514
403 1 3 . 1 1 676 676 THR N N 676 114.109 114.109 114.683 -0.574 19514
404 1 3 . 1 1 676 676 THR HA H 676 3.913 3.913 4.020 -0.107 19514
405 1 3 . 1 1 676 676 THR C C 676 175.587 175.587 176.224 -0.637 19514
406 1 3 . 1 1 676 676 THR CA C 676 65.121 65.121 65.657 -0.536 19514
407 1 3 . 1 1 676 676 THR CB C 676 68.794 68.794 68.460 0.334 19514
408 1 3 . 1 1 676 676 THR H H 676 7.889 7.889 8.497 -0.608 19514
409 1 3 . 1 1 677 677 ASN N N 677 118.858 118.858 118.818 0.040 19514
410 1 3 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.889 -0.309 19514
411 1 3 . 1 1 677 677 ASN C C 677 176.077 176.077 176.801 -0.724 19514
412 1 3 . 1 1 677 677 ASN CA C 677 54.605 54.605 55.624 -1.019 19514
413 1 3 . 1 1 677 677 ASN CB C 677 38.308 38.308 38.848 -0.540 19514
414 1 3 . 1 1 677 677 ASN H H 677 7.862 7.862 7.810 0.052 19514
415 1 3 . 1 1 678 678 TRP N N 678 119.189 119.189 120.923 -1.734 19514
416 1 3 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.636 -0.019 19514
417 1 3 . 1 1 678 678 TRP C C 678 176.898 176.898 178.323 -1.425 19514
418 1 3 . 1 1 678 678 TRP CA C 678 58.582 58.582 61.285 -2.703 19514
419 1 3 . 1 1 678 678 TRP CB C 678 29.597 29.597 30.033 -0.436 19514
420 1 3 . 1 1 678 678 TRP H H 678 7.795 7.795 8.439 -0.644 19514
421 1 3 . 1 1 679 679 LEU N N 679 117.805 117.805 119.214 -1.409 19514
422 1 3 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.157 -0.134 19514
423 1 3 . 1 1 679 679 LEU C C 679 177.463 177.463 178.845 -1.382 19514
424 1 3 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.209 -0.433 19514
425 1 3 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.202 0.573 19514
426 1 3 . 1 1 679 679 LEU H H 679 7.753 7.753 7.901 -0.148 19514
427 1 3 . 1 1 680 680 TRP N N 680 117.351 117.351 120.393 -3.042 19514
428 1 3 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.109 0.223 19514
429 1 3 . 1 1 680 680 TRP C C 680 176.369 176.369 177.306 -0.937 19514
430 1 3 . 1 1 680 680 TRP CA C 680 58.967 58.967 60.407 -1.440 19514
431 1 3 . 1 1 680 680 TRP CB C 680 29.189 29.189 28.838 0.351 19514
432 1 3 . 1 1 680 680 TRP H H 680 7.542 7.542 7.726 -0.184 19514
433 1 3 . 1 1 681 681 TYR N N 681 116.232 116.232 114.216 2.016 19514
434 1 3 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.523 -0.388 19514
435 1 3 . 1 1 681 681 TYR C C 681 175.623 175.623 176.511 -0.888 19514
436 1 3 . 1 1 681 681 TYR CA C 681 59.749 59.749 59.625 0.124 19514
437 1 3 . 1 1 681 681 TYR CB C 681 39.096 39.096 38.456 0.640 19514
438 1 3 . 1 1 681 681 TYR H H 681 7.453 7.453 7.177 0.276 19514
439 1 3 . 1 1 682 682 ILE N N 682 115.034 115.034 115.618 -0.584 19514
440 1 3 . 1 1 682 682 ILE HA H 682 4.185 4.185 4.246 -0.061 19514
441 1 3 . 1 1 682 682 ILE C C 682 174.299 174.299 176.078 -1.779 19514
442 1 3 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.579 0.582 19514
443 1 3 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.447 0.339 19514
444 1 3 . 1 1 682 682 ILE H H 682 7.477 7.477 7.861 -0.384 19514
445 1 4 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.493 -0.220 19514
446 1 4 . 1 1 658 658 LYS C C 658 175.560 175.560 175.362 0.198 19514
447 1 4 . 1 1 658 658 LYS CA C 658 56.733 56.733 55.877 0.856 19514
448 1 4 . 1 1 658 658 LYS CB C 658 32.982 32.982 33.133 -0.151 19514
449 1 4 . 1 1 659 659 ASP N N 659 121.529 121.529 120.428 1.101 19514
450 1 4 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.624 -0.038 19514
451 1 4 . 1 1 659 659 ASP C C 659 176.458 176.458 178.251 -1.793 19514
452 1 4 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.205 0.014 19514
453 1 4 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.905 -0.581 19514
454 1 4 . 1 1 659 659 ASP H H 659 8.329 8.329 8.078 0.251 19514
455 1 4 . 1 1 660 660 LEU N N 660 123.060 123.060 120.836 2.224 19514
456 1 4 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.241 -0.047 19514
457 1 4 . 1 1 660 660 LEU C C 660 177.101 177.101 178.169 -1.068 19514
458 1 4 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.554 0.010 19514
459 1 4 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.330 0.159 19514
460 1 4 . 1 1 660 660 LEU H H 660 8.490 8.490 8.317 0.173 19514
461 1 4 . 1 1 661 661 LEU N N 661 118.573 118.573 119.110 -0.537 19514
462 1 4 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.445 -0.096 19514
463 1 4 . 1 1 661 661 LEU C C 661 176.328 176.328 176.221 0.107 19514
464 1 4 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.350 0.469 19514
465 1 4 . 1 1 661 661 LEU CB C 661 41.778 41.778 39.933 1.845 19514
466 1 4 . 1 1 661 661 LEU H H 661 8.114 8.114 8.080 0.034 19514
467 1 4 . 1 1 662 662 ALA N N 662 122.836 122.836 122.815 0.021 19514
468 1 4 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.254 0.151 19514
469 1 4 . 1 1 662 662 ALA C C 662 177.949 177.949 178.684 -0.735 19514
470 1 4 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.526 -0.389 19514
471 1 4 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.599 0.824 19514
472 1 4 . 1 1 662 662 ALA H H 662 7.849 7.849 7.495 0.354 19514
473 1 4 . 1 1 663 663 LEU N N 663 121.289 121.289 124.644 -3.355 19514
474 1 4 . 1 1 663 663 LEU HA H 663 4.185 4.185 4.005 0.180 19514
475 1 4 . 1 1 663 663 LEU C C 663 177.903 177.903 178.418 -0.515 19514
476 1 4 . 1 1 663 663 LEU CA C 663 56.657 56.657 58.044 -1.387 19514
477 1 4 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.393 0.552 19514
478 1 4 . 1 1 663 663 LEU H H 663 8.302 8.302 8.364 -0.062 19514
479 1 4 . 1 1 664 664 ASP N N 664 118.100 118.100 118.578 -0.478 19514
480 1 4 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.529 -0.110 19514
481 1 4 . 1 1 664 664 ASP C C 664 177.559 177.559 178.041 -0.482 19514
482 1 4 . 1 1 664 664 ASP CA C 664 56.307 56.307 56.814 -0.507 19514
483 1 4 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.547 0.343 19514
484 1 4 . 1 1 664 664 ASP H H 664 8.437 8.437 8.631 -0.194 19514
485 1 4 . 1 1 665 665 SER N N 665 113.890 113.890 114.409 -0.519 19514
486 1 4 . 1 1 665 665 SER HA H 665 4.348 4.348 4.504 -0.156 19514
487 1 4 . 1 1 665 665 SER C C 665 175.610 175.610 176.200 -0.590 19514
488 1 4 . 1 1 665 665 SER CA C 665 59.988 59.988 60.477 -0.489 19514
489 1 4 . 1 1 665 665 SER CB C 665 63.470 63.470 63.883 -0.413 19514
490 1 4 . 1 1 665 665 SER H H 665 7.894 7.894 8.162 -0.268 19514
491 1 4 . 1 1 666 666 TRP N N 666 122.515 122.515 124.008 -1.493 19514
492 1 4 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.048 0.432 19514
493 1 4 . 1 1 666 666 TRP C C 666 177.235 177.235 177.383 -0.148 19514
494 1 4 . 1 1 666 666 TRP CA C 666 59.020 59.020 61.042 -2.022 19514
495 1 4 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.202 0.236 19514
496 1 4 . 1 1 666 666 TRP H H 666 8.038 8.038 8.592 -0.554 19514
497 1 4 . 1 1 667 667 LYS N N 667 118.444 118.444 118.549 -0.105 19514
498 1 4 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.956 -0.039 19514
499 1 4 . 1 1 667 667 LYS C C 667 177.985 177.985 178.626 -0.641 19514
500 1 4 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.671 -0.185 19514
501 1 4 . 1 1 667 667 LYS CB C 667 32.300 32.300 31.872 0.428 19514
502 1 4 . 1 1 667 667 LYS H H 667 7.882 7.882 8.163 -0.281 19514
503 1 4 . 1 1 668 668 ASN N N 668 116.413 116.413 117.239 -0.826 19514
504 1 4 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.549 0.079 19514
505 1 4 . 1 1 668 668 ASN C C 668 177.013 177.013 177.307 -0.294 19514
506 1 4 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.706 -0.667 19514
507 1 4 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.030 0.267 19514
508 1 4 . 1 1 668 668 ASN H H 668 8.045 8.045 7.648 0.397 19514
509 1 4 . 1 1 669 669 LEU N N 669 120.829 120.829 121.605 -0.776 19514
510 1 4 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.643 0.381 19514
511 1 4 . 1 1 669 669 LEU C C 669 177.559 177.559 178.272 -0.713 19514
512 1 4 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.801 0.140 19514
513 1 4 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.598 0.558 19514
514 1 4 . 1 1 669 669 LEU H H 669 7.804 7.804 7.592 0.212 19514
515 1 4 . 1 1 670 670 TRP N N 670 117.321 117.321 117.584 -0.263 19514
516 1 4 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.467 0.077 19514
517 1 4 . 1 1 670 670 TRP C C 670 177.194 177.194 177.866 -0.672 19514
518 1 4 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.865 0.138 19514
519 1 4 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.610 0.104 19514
520 1 4 . 1 1 670 670 TRP H H 670 7.887 7.887 7.861 0.026 19514
521 1 4 . 1 1 671 671 ASN N N 671 115.549 115.549 115.579 -0.030 19514
522 1 4 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.768 -0.218 19514
523 1 4 . 1 1 671 671 ASN C C 671 176.520 176.520 176.770 -0.250 19514
524 1 4 . 1 1 671 671 ASN CA C 671 55.017 55.017 55.257 -0.240 19514
525 1 4 . 1 1 671 671 ASN CB C 671 38.658 38.658 39.338 -0.680 19514
526 1 4 . 1 1 671 671 ASN H H 671 7.968 7.968 7.880 0.088 19514
527 1 4 . 1 1 672 672 TRP N N 672 120.350 120.350 120.489 -0.139 19514
528 1 4 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.235 0.157 19514
529 1 4 . 1 1 672 672 TRP C C 672 176.592 176.592 177.887 -1.295 19514
530 1 4 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.826 -1.470 19514
531 1 4 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.261 0.185 19514
532 1 4 . 1 1 672 672 TRP H H 672 8.013 8.013 7.680 0.333 19514
533 1 4 . 1 1 673 673 PHE N N 673 117.559 117.559 117.308 0.251 19514
534 1 4 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.613 -0.354 19514
535 1 4 . 1 1 673 673 PHE C C 673 175.068 175.068 175.241 -0.173 19514
536 1 4 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.407 0.456 19514
537 1 4 . 1 1 673 673 PHE CB C 673 39.298 39.298 36.838 2.460 19514
538 1 4 . 1 1 673 673 PHE H H 673 7.881 7.881 7.992 -0.111 19514
539 1 4 . 1 1 674 674 ASN N N 674 118.329 118.329 122.094 -3.765 19514
540 1 4 . 1 1 674 674 ASN HA H 674 4.569 4.569 5.029 -0.460 19514
541 1 4 . 1 1 674 674 ASN C C 674 175.956 175.956 176.656 -0.700 19514
542 1 4 . 1 1 674 674 ASN CA C 674 53.378 53.378 52.600 0.778 19514
543 1 4 . 1 1 674 674 ASN CB C 674 38.420 38.420 39.300 -0.881 19514
544 1 4 . 1 1 674 674 ASN H H 674 7.750 7.750 8.355 -0.605 19514
545 1 4 . 1 1 675 675 ILE N N 675 119.444 119.444 121.855 -2.411 19514
546 1 4 . 1 1 675 675 ILE HA H 675 3.727 3.727 2.359 1.368 19514
547 1 4 . 1 1 675 675 ILE C C 675 176.638 176.638 176.737 -0.099 19514
548 1 4 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.758 -1.655 19514
549 1 4 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.313 0.966 19514
550 1 4 . 1 1 675 675 ILE H H 675 8.015 8.015 8.022 -0.007 19514
551 1 4 . 1 1 676 676 THR N N 676 114.109 114.109 113.510 0.599 19514
552 1 4 . 1 1 676 676 THR HA H 676 3.913 3.913 3.844 0.069 19514
553 1 4 . 1 1 676 676 THR C C 676 175.587 175.587 176.364 -0.777 19514
554 1 4 . 1 1 676 676 THR CA C 676 65.121 65.121 65.513 -0.392 19514
555 1 4 . 1 1 676 676 THR CB C 676 68.794 68.794 68.362 0.432 19514
556 1 4 . 1 1 676 676 THR H H 676 7.889 7.889 8.108 -0.219 19514
557 1 4 . 1 1 677 677 ASN N N 677 118.858 118.858 119.347 -0.489 19514
558 1 4 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.564 0.016 19514
559 1 4 . 1 1 677 677 ASN C C 677 176.077 176.077 177.485 -1.408 19514
560 1 4 . 1 1 677 677 ASN CA C 677 54.605 54.605 56.051 -1.446 19514
561 1 4 . 1 1 677 677 ASN CB C 677 38.308 38.308 39.141 -0.833 19514
562 1 4 . 1 1 677 677 ASN H H 677 7.862 7.862 8.290 -0.428 19514
563 1 4 . 1 1 678 678 TRP N N 678 119.189 119.189 118.124 1.065 19514
564 1 4 . 1 1 678 678 TRP HA H 678 4.617 4.617 5.115 -0.498 19514
565 1 4 . 1 1 678 678 TRP C C 678 176.898 176.898 178.248 -1.350 19514
566 1 4 . 1 1 678 678 TRP CA C 678 58.582 58.582 58.119 0.463 19514
567 1 4 . 1 1 678 678 TRP CB C 678 29.597 29.597 29.273 0.324 19514
568 1 4 . 1 1 678 678 TRP H H 678 7.795 7.795 7.608 0.187 19514
569 1 4 . 1 1 679 679 LEU N N 679 117.805 117.805 121.679 -3.874 19514
570 1 4 . 1 1 679 679 LEU HA H 679 4.023 4.023 3.955 0.068 19514
571 1 4 . 1 1 679 679 LEU C C 679 177.463 177.463 179.193 -1.730 19514
572 1 4 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.135 -0.359 19514
573 1 4 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.265 0.510 19514
574 1 4 . 1 1 679 679 LEU H H 679 7.753 7.753 8.532 -0.779 19514
575 1 4 . 1 1 680 680 TRP N N 680 117.351 117.351 121.058 -3.707 19514
576 1 4 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.359 -0.027 19514
577 1 4 . 1 1 680 680 TRP C C 680 176.369 176.369 176.764 -0.395 19514
578 1 4 . 1 1 680 680 TRP CA C 680 58.967 58.967 59.829 -0.862 19514
579 1 4 . 1 1 680 680 TRP CB C 680 29.189 29.189 28.132 1.057 19514
580 1 4 . 1 1 680 680 TRP H H 680 7.542 7.542 8.135 -0.593 19514
581 1 4 . 1 1 681 681 TYR N N 681 116.232 116.232 119.914 -3.682 19514
582 1 4 . 1 1 681 681 TYR HA H 681 4.135 4.135 3.942 0.193 19514
583 1 4 . 1 1 681 681 TYR C C 681 175.623 175.623 174.973 0.650 19514
584 1 4 . 1 1 681 681 TYR CA C 681 59.749 59.749 58.285 1.464 19514
585 1 4 . 1 1 681 681 TYR CB C 681 39.096 39.096 39.121 -0.025 19514
586 1 4 . 1 1 681 681 TYR H H 681 7.453 7.453 7.621 -0.168 19514
587 1 4 . 1 1 682 682 ILE N N 682 115.034 115.034 115.330 -0.296 19514
588 1 4 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.753 0.432 19514
589 1 4 . 1 1 682 682 ILE C C 682 174.299 174.299 175.485 -1.186 19514
590 1 4 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.220 0.941 19514
591 1 4 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.148 0.638 19514
592 1 4 . 1 1 682 682 ILE H H 682 7.477 7.477 7.397 0.080 19514
593 1 5 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.522 -0.249 19514
594 1 5 . 1 1 658 658 LYS C C 658 175.560 175.560 175.248 0.312 19514
595 1 5 . 1 1 658 658 LYS CA C 658 56.733 56.733 55.758 0.975 19514
596 1 5 . 1 1 658 658 LYS CB C 658 32.982 32.982 33.983 -1.001 19514
597 1 5 . 1 1 659 659 ASP N N 659 121.529 121.529 120.168 1.361 19514
598 1 5 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.565 0.021 19514
599 1 5 . 1 1 659 659 ASP C C 659 176.458 176.458 176.807 -0.349 19514
600 1 5 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.390 -0.171 19514
601 1 5 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.563 -0.239 19514
602 1 5 . 1 1 659 659 ASP H H 659 8.329 8.329 8.232 0.097 19514
603 1 5 . 1 1 660 660 LEU N N 660 123.060 123.060 118.336 4.724 19514
604 1 5 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.378 -0.184 19514
605 1 5 . 1 1 660 660 LEU C C 660 177.101 177.101 177.994 -0.893 19514
606 1 5 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.065 0.499 19514
607 1 5 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.546 -0.057 19514
608 1 5 . 1 1 660 660 LEU H H 660 8.490 8.490 8.247 0.243 19514
609 1 5 . 1 1 661 661 LEU N N 661 118.573 118.573 119.162 -0.589 19514
610 1 5 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.585 -0.236 19514
611 1 5 . 1 1 661 661 LEU C C 661 176.328 176.328 176.071 0.257 19514
612 1 5 . 1 1 661 661 LEU CA C 661 54.819 54.819 53.985 0.834 19514
613 1 5 . 1 1 661 661 LEU CB C 661 41.778 41.778 41.317 0.461 19514
614 1 5 . 1 1 661 661 LEU H H 661 8.114 8.114 7.906 0.208 19514
615 1 5 . 1 1 662 662 ALA N N 662 122.836 122.836 122.277 0.559 19514
616 1 5 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.229 0.176 19514
617 1 5 . 1 1 662 662 ALA C C 662 177.949 177.949 178.654 -0.705 19514
618 1 5 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.357 -0.220 19514
619 1 5 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.844 0.579 19514
620 1 5 . 1 1 662 662 ALA H H 662 7.849 7.849 7.611 0.238 19514
621 1 5 . 1 1 663 663 LEU N N 663 121.289 121.289 126.388 -5.099 19514
622 1 5 . 1 1 663 663 LEU HA H 663 4.185 4.185 4.017 0.168 19514
623 1 5 . 1 1 663 663 LEU C C 663 177.903 177.903 178.298 -0.395 19514
624 1 5 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.837 -1.180 19514
625 1 5 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.652 0.293 19514
626 1 5 . 1 1 663 663 LEU H H 663 8.302 8.302 8.998 -0.696 19514
627 1 5 . 1 1 664 664 ASP N N 664 118.100 118.100 118.516 -0.416 19514
628 1 5 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.466 -0.047 19514
629 1 5 . 1 1 664 664 ASP C C 664 177.559 177.559 178.052 -0.493 19514
630 1 5 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.156 -0.849 19514
631 1 5 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.307 0.583 19514
632 1 5 . 1 1 664 664 ASP H H 664 8.437 8.437 8.608 -0.171 19514
633 1 5 . 1 1 665 665 SER N N 665 113.890 113.890 114.080 -0.190 19514
634 1 5 . 1 1 665 665 SER HA H 665 4.348 4.348 4.432 -0.084 19514
635 1 5 . 1 1 665 665 SER C C 665 175.610 175.610 175.922 -0.312 19514
636 1 5 . 1 1 665 665 SER CA C 665 59.988 59.988 59.701 0.287 19514
637 1 5 . 1 1 665 665 SER CB C 665 63.470 63.470 63.938 -0.468 19514
638 1 5 . 1 1 665 665 SER H H 665 7.894 7.894 8.323 -0.429 19514
639 1 5 . 1 1 666 666 TRP N N 666 122.515 122.515 122.368 0.147 19514
640 1 5 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.141 0.339 19514
641 1 5 . 1 1 666 666 TRP C C 666 177.235 177.235 177.325 -0.090 19514
642 1 5 . 1 1 666 666 TRP CA C 666 59.020 59.020 59.907 -0.887 19514
643 1 5 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.585 -0.147 19514
644 1 5 . 1 1 666 666 TRP H H 666 8.038 8.038 8.142 -0.104 19514
645 1 5 . 1 1 667 667 LYS N N 667 118.444 118.444 119.104 -0.660 19514
646 1 5 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.948 -0.031 19514
647 1 5 . 1 1 667 667 LYS C C 667 177.985 177.985 178.388 -0.403 19514
648 1 5 . 1 1 667 667 LYS CA C 667 59.486 59.486 60.026 -0.541 19514
649 1 5 . 1 1 667 667 LYS CB C 667 32.300 32.300 32.002 0.298 19514
650 1 5 . 1 1 667 667 LYS H H 667 7.882 7.882 8.781 -0.899 19514
651 1 5 . 1 1 668 668 ASN N N 668 116.413 116.413 116.801 -0.388 19514
652 1 5 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.517 0.111 19514
653 1 5 . 1 1 668 668 ASN C C 668 177.013 177.013 177.343 -0.330 19514
654 1 5 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.727 -0.688 19514
655 1 5 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.055 0.242 19514
656 1 5 . 1 1 668 668 ASN H H 668 8.045 8.045 7.600 0.445 19514
657 1 5 . 1 1 669 669 LEU N N 669 120.829 120.829 121.436 -0.607 19514
658 1 5 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.525 0.499 19514
659 1 5 . 1 1 669 669 LEU C C 669 177.559 177.559 178.085 -0.526 19514
660 1 5 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.607 0.334 19514
661 1 5 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.621 0.535 19514
662 1 5 . 1 1 669 669 LEU H H 669 7.804 7.804 7.548 0.256 19514
663 1 5 . 1 1 670 670 TRP N N 670 117.321 117.321 117.454 -0.133 19514
664 1 5 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.464 0.080 19514
665 1 5 . 1 1 670 670 TRP C C 670 177.194 177.194 177.720 -0.526 19514
666 1 5 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.801 0.202 19514
667 1 5 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.633 0.081 19514
668 1 5 . 1 1 670 670 TRP H H 670 7.887 7.887 8.038 -0.151 19514
669 1 5 . 1 1 671 671 ASN N N 671 115.549 115.549 115.183 0.366 19514
670 1 5 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.779 -0.229 19514
671 1 5 . 1 1 671 671 ASN C C 671 176.520 176.520 176.822 -0.302 19514
672 1 5 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.721 0.296 19514
673 1 5 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.887 -0.229 19514
674 1 5 . 1 1 671 671 ASN H H 671 7.968 7.968 7.870 0.098 19514
675 1 5 . 1 1 672 672 TRP N N 672 120.350 120.350 120.452 -0.102 19514
676 1 5 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.193 0.199 19514
677 1 5 . 1 1 672 672 TRP C C 672 176.592 176.592 177.224 -0.632 19514
678 1 5 . 1 1 672 672 TRP CA C 672 59.356 59.356 61.003 -1.647 19514
679 1 5 . 1 1 672 672 TRP CB C 672 29.446 29.446 28.890 0.556 19514
680 1 5 . 1 1 672 672 TRP H H 672 8.013 8.013 7.512 0.501 19514
681 1 5 . 1 1 673 673 PHE N N 673 117.559 117.559 117.183 0.376 19514
682 1 5 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.482 -0.223 19514
683 1 5 . 1 1 673 673 PHE C C 673 175.068 175.068 176.040 -0.972 19514
684 1 5 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.213 0.650 19514
685 1 5 . 1 1 673 673 PHE CB C 673 39.298 39.298 36.695 2.603 19514
686 1 5 . 1 1 673 673 PHE H H 673 7.881 7.881 7.637 0.244 19514
687 1 5 . 1 1 674 674 ASN N N 674 118.329 118.329 124.302 -5.973 19514
688 1 5 . 1 1 674 674 ASN HA H 674 4.569 4.569 4.948 -0.379 19514
689 1 5 . 1 1 674 674 ASN C C 674 175.956 175.956 176.026 -0.070 19514
690 1 5 . 1 1 674 674 ASN CA C 674 53.378 53.378 52.934 0.444 19514
691 1 5 . 1 1 674 674 ASN CB C 674 38.420 38.420 37.626 0.794 19514
692 1 5 . 1 1 674 674 ASN H H 674 7.750 7.750 8.712 -0.962 19514
693 1 5 . 1 1 675 675 ILE N N 675 119.444 119.444 122.422 -2.978 19514
694 1 5 . 1 1 675 675 ILE HA H 675 3.727 3.727 3.768 -0.040 19514
695 1 5 . 1 1 675 675 ILE C C 675 176.638 176.638 177.237 -0.599 19514
696 1 5 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.815 -1.711 19514
697 1 5 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.769 0.511 19514
698 1 5 . 1 1 675 675 ILE H H 675 8.015 8.015 7.858 0.157 19514
699 1 5 . 1 1 676 676 THR N N 676 114.109 114.109 114.099 0.010 19514
700 1 5 . 1 1 676 676 THR HA H 676 3.913 3.913 3.983 -0.070 19514
701 1 5 . 1 1 676 676 THR C C 676 175.587 175.587 176.190 -0.603 19514
702 1 5 . 1 1 676 676 THR CA C 676 65.121 65.121 65.923 -0.802 19514
703 1 5 . 1 1 676 676 THR CB C 676 68.794 68.794 68.085 0.709 19514
704 1 5 . 1 1 676 676 THR H H 676 7.889 7.889 8.606 -0.717 19514
705 1 5 . 1 1 677 677 ASN N N 677 118.858 118.858 118.137 0.721 19514
706 1 5 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.940 -0.360 19514
707 1 5 . 1 1 677 677 ASN C C 677 176.077 176.077 177.587 -1.510 19514
708 1 5 . 1 1 677 677 ASN CA C 677 54.605 54.605 55.057 -0.452 19514
709 1 5 . 1 1 677 677 ASN CB C 677 38.308 38.308 38.722 -0.414 19514
710 1 5 . 1 1 677 677 ASN H H 677 7.862 7.862 7.804 0.058 19514
711 1 5 . 1 1 678 678 TRP N N 678 119.189 119.189 122.501 -3.312 19514
712 1 5 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.667 -0.050 19514
713 1 5 . 1 1 678 678 TRP C C 678 176.898 176.898 178.162 -1.264 19514
714 1 5 . 1 1 678 678 TRP CA C 678 58.582 58.582 61.233 -2.651 19514
715 1 5 . 1 1 678 678 TRP CB C 678 29.597 29.597 29.899 -0.302 19514
716 1 5 . 1 1 678 678 TRP H H 678 7.795 7.795 8.433 -0.638 19514
717 1 5 . 1 1 679 679 LEU N N 679 117.805 117.805 119.162 -1.357 19514
718 1 5 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.163 -0.140 19514
719 1 5 . 1 1 679 679 LEU C C 679 177.463 177.463 178.081 -0.618 19514
720 1 5 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.022 -0.246 19514
721 1 5 . 1 1 679 679 LEU CB C 679 41.775 41.775 40.979 0.796 19514
722 1 5 . 1 1 679 679 LEU H H 679 7.753 7.753 7.989 -0.236 19514
723 1 5 . 1 1 680 680 TRP N N 680 117.351 117.351 120.072 -2.721 19514
724 1 5 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.176 0.156 19514
725 1 5 . 1 1 680 680 TRP C C 680 176.369 176.369 177.874 -1.505 19514
726 1 5 . 1 1 680 680 TRP CA C 680 58.967 58.967 60.818 -1.851 19514
727 1 5 . 1 1 680 680 TRP CB C 680 29.189 29.189 28.948 0.241 19514
728 1 5 . 1 1 680 680 TRP H H 680 7.542 7.542 7.648 -0.106 19514
729 1 5 . 1 1 681 681 TYR N N 681 116.232 116.232 115.238 0.994 19514
730 1 5 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.419 -0.284 19514
731 1 5 . 1 1 681 681 TYR C C 681 175.623 175.623 177.067 -1.444 19514
732 1 5 . 1 1 681 681 TYR CA C 681 59.749 59.749 60.266 -0.517 19514
733 1 5 . 1 1 681 681 TYR CB C 681 39.096 39.096 38.421 0.675 19514
734 1 5 . 1 1 681 681 TYR H H 681 7.453 7.453 7.228 0.225 19514
735 1 5 . 1 1 682 682 ILE N N 682 115.034 115.034 113.420 1.614 19514
736 1 5 . 1 1 682 682 ILE HA H 682 4.185 4.185 4.478 -0.293 19514
737 1 5 . 1 1 682 682 ILE C C 682 174.299 174.299 176.213 -1.914 19514
738 1 5 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.687 0.474 19514
739 1 5 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.875 -0.089 19514
740 1 5 . 1 1 682 682 ILE H H 682 7.477 7.477 7.795 -0.318 19514
741 1 6 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.541 -0.268 19514
742 1 6 . 1 1 658 658 LYS C C 658 175.560 175.560 175.394 0.166 19514
743 1 6 . 1 1 658 658 LYS CA C 658 56.733 56.733 56.467 0.267 19514
744 1 6 . 1 1 658 658 LYS CB C 658 32.982 32.982 33.161 -0.179 19514
745 1 6 . 1 1 659 659 ASP N N 659 121.529 121.529 122.537 -1.008 19514
746 1 6 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.587 -0.001 19514
747 1 6 . 1 1 659 659 ASP C C 659 176.458 176.458 178.361 -1.903 19514
748 1 6 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.225 -0.006 19514
749 1 6 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.673 -0.349 19514
750 1 6 . 1 1 659 659 ASP H H 659 8.329 8.329 8.383 -0.054 19514
751 1 6 . 1 1 660 660 LEU N N 660 123.060 123.060 121.168 1.892 19514
752 1 6 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.277 -0.083 19514
753 1 6 . 1 1 660 660 LEU C C 660 177.101 177.101 177.789 -0.688 19514
754 1 6 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.152 0.412 19514
755 1 6 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.348 0.141 19514
756 1 6 . 1 1 660 660 LEU H H 660 8.490 8.490 8.276 0.214 19514
757 1 6 . 1 1 661 661 LEU N N 661 118.573 118.573 119.406 -0.833 19514
758 1 6 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.418 -0.069 19514
759 1 6 . 1 1 661 661 LEU C C 661 176.328 176.328 176.152 0.176 19514
760 1 6 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.196 0.624 19514
761 1 6 . 1 1 661 661 LEU CB C 661 41.778 41.778 39.859 1.919 19514
762 1 6 . 1 1 661 661 LEU H H 661 8.114 8.114 8.069 0.045 19514
763 1 6 . 1 1 662 662 ALA N N 662 122.836 122.836 123.058 -0.222 19514
764 1 6 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.209 0.196 19514
765 1 6 . 1 1 662 662 ALA C C 662 177.949 177.949 178.142 -0.193 19514
766 1 6 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.367 -0.230 19514
767 1 6 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.588 0.835 19514
768 1 6 . 1 1 662 662 ALA H H 662 7.849 7.849 7.551 0.298 19514
769 1 6 . 1 1 663 663 LEU N N 663 121.289 121.289 125.808 -4.519 19514
770 1 6 . 1 1 663 663 LEU HA H 663 4.185 4.185 3.892 0.293 19514
771 1 6 . 1 1 663 663 LEU C C 663 177.903 177.903 178.062 -0.159 19514
772 1 6 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.730 -1.073 19514
773 1 6 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.596 0.349 19514
774 1 6 . 1 1 663 663 LEU H H 663 8.302 8.302 8.717 -0.415 19514
775 1 6 . 1 1 664 664 ASP N N 664 118.100 118.100 118.076 0.024 19514
776 1 6 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.502 -0.083 19514
777 1 6 . 1 1 664 664 ASP C C 664 177.559 177.559 177.960 -0.401 19514
778 1 6 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.054 -0.747 19514
779 1 6 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.322 0.568 19514
780 1 6 . 1 1 664 664 ASP H H 664 8.437 8.437 8.572 -0.135 19514
781 1 6 . 1 1 665 665 SER N N 665 113.890 113.890 113.982 -0.092 19514
782 1 6 . 1 1 665 665 SER HA H 665 4.348 4.348 4.460 -0.112 19514
783 1 6 . 1 1 665 665 SER C C 665 175.610 175.610 176.579 -0.969 19514
784 1 6 . 1 1 665 665 SER CA C 665 59.988 59.988 59.500 0.488 19514
785 1 6 . 1 1 665 665 SER CB C 665 63.470 63.470 63.823 -0.353 19514
786 1 6 . 1 1 665 665 SER H H 665 7.894 7.894 8.125 -0.231 19514
787 1 6 . 1 1 666 666 TRP N N 666 122.515 122.515 123.890 -1.375 19514
788 1 6 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.072 0.408 19514
789 1 6 . 1 1 666 666 TRP C C 666 177.235 177.235 177.416 -0.181 19514
790 1 6 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.928 -1.908 19514
791 1 6 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.266 0.172 19514
792 1 6 . 1 1 666 666 TRP H H 666 8.038 8.038 8.569 -0.531 19514
793 1 6 . 1 1 667 667 LYS N N 667 118.444 118.444 118.786 -0.342 19514
794 1 6 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.945 -0.028 19514
795 1 6 . 1 1 667 667 LYS C C 667 177.985 177.985 178.821 -0.836 19514
796 1 6 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.834 -0.348 19514
797 1 6 . 1 1 667 667 LYS CB C 667 32.300 32.300 31.987 0.313 19514
798 1 6 . 1 1 667 667 LYS H H 667 7.882 7.882 8.069 -0.187 19514
799 1 6 . 1 1 668 668 ASN N N 668 116.413 116.413 117.951 -1.538 19514
800 1 6 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.518 0.110 19514
801 1 6 . 1 1 668 668 ASN C C 668 177.013 177.013 177.414 -0.401 19514
802 1 6 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.819 -0.780 19514
803 1 6 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.278 0.019 19514
804 1 6 . 1 1 668 668 ASN H H 668 8.045 8.045 7.541 0.504 19514
805 1 6 . 1 1 669 669 LEU N N 669 120.829 120.829 121.821 -0.992 19514
806 1 6 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.428 0.596 19514
807 1 6 . 1 1 669 669 LEU C C 669 177.559 177.559 177.958 -0.399 19514
808 1 6 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.765 0.176 19514
809 1 6 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.519 0.637 19514
810 1 6 . 1 1 669 669 LEU H H 669 7.804 7.804 7.536 0.268 19514
811 1 6 . 1 1 670 670 TRP N N 670 117.321 117.321 117.408 -0.087 19514
812 1 6 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.501 0.043 19514
813 1 6 . 1 1 670 670 TRP C C 670 177.194 177.194 177.580 -0.386 19514
814 1 6 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.627 0.376 19514
815 1 6 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.559 0.155 19514
816 1 6 . 1 1 670 670 TRP H H 670 7.887 7.887 7.901 -0.014 19514
817 1 6 . 1 1 671 671 ASN N N 671 115.549 115.549 114.929 0.620 19514
818 1 6 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.818 -0.268 19514
819 1 6 . 1 1 671 671 ASN C C 671 176.520 176.520 176.238 0.282 19514
820 1 6 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.708 0.309 19514
821 1 6 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.750 -0.092 19514
822 1 6 . 1 1 671 671 ASN H H 671 7.968 7.968 7.862 0.106 19514
823 1 6 . 1 1 672 672 TRP N N 672 120.350 120.350 119.434 0.916 19514
824 1 6 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.228 0.164 19514
825 1 6 . 1 1 672 672 TRP C C 672 176.592 176.592 177.664 -1.072 19514
826 1 6 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.149 -0.793 19514
827 1 6 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.192 0.254 19514
828 1 6 . 1 1 672 672 TRP H H 672 8.013 8.013 7.549 0.464 19514
829 1 6 . 1 1 673 673 PHE N N 673 117.559 117.559 116.752 0.807 19514
830 1 6 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.347 -0.088 19514
831 1 6 . 1 1 673 673 PHE C C 673 175.068 175.068 176.537 -1.469 19514
832 1 6 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.840 0.023 19514
833 1 6 . 1 1 673 673 PHE CB C 673 39.298 39.298 37.319 1.979 19514
834 1 6 . 1 1 673 673 PHE H H 673 7.881 7.881 7.598 0.283 19514
835 1 6 . 1 1 674 674 ASN N N 674 118.329 118.329 124.928 -6.599 19514
836 1 6 . 1 1 674 674 ASN HA H 674 4.569 4.569 4.968 -0.399 19514
837 1 6 . 1 1 674 674 ASN C C 674 175.956 175.956 175.801 0.155 19514
838 1 6 . 1 1 674 674 ASN CA C 674 53.378 53.378 51.523 1.855 19514
839 1 6 . 1 1 674 674 ASN CB C 674 38.420 38.420 37.448 0.972 19514
840 1 6 . 1 1 674 674 ASN H H 674 7.750 7.750 8.634 -0.884 19514
841 1 6 . 1 1 675 675 ILE N N 675 119.444 119.444 121.076 -1.632 19514
842 1 6 . 1 1 675 675 ILE HA H 675 3.727 3.727 3.640 0.087 19514
843 1 6 . 1 1 675 675 ILE C C 675 176.638 176.638 177.680 -1.042 19514
844 1 6 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.621 -1.517 19514
845 1 6 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.991 0.289 19514
846 1 6 . 1 1 675 675 ILE H H 675 8.015 8.015 7.699 0.316 19514
847 1 6 . 1 1 676 676 THR N N 676 114.109 114.109 113.984 0.125 19514
848 1 6 . 1 1 676 676 THR HA H 676 3.913 3.913 4.271 -0.358 19514
849 1 6 . 1 1 676 676 THR C C 676 175.587 175.587 175.566 0.021 19514
850 1 6 . 1 1 676 676 THR CA C 676 65.121 65.121 66.185 -1.064 19514
851 1 6 . 1 1 676 676 THR CB C 676 68.794 68.794 68.652 0.142 19514
852 1 6 . 1 1 676 676 THR H H 676 7.889 7.889 8.342 -0.453 19514
853 1 6 . 1 1 677 677 ASN N N 677 118.858 118.858 119.728 -0.870 19514
854 1 6 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.792 -0.212 19514
855 1 6 . 1 1 677 677 ASN C C 677 176.077 176.077 177.990 -1.913 19514
856 1 6 . 1 1 677 677 ASN CA C 677 54.605 54.605 56.052 -1.447 19514
857 1 6 . 1 1 677 677 ASN CB C 677 38.308 38.308 39.371 -1.063 19514
858 1 6 . 1 1 677 677 ASN H H 677 7.862 7.862 8.427 -0.565 19514
859 1 6 . 1 1 678 678 TRP N N 678 119.189 119.189 120.271 -1.082 19514
860 1 6 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.847 -0.230 19514
861 1 6 . 1 1 678 678 TRP C C 678 176.898 176.898 177.812 -0.914 19514
862 1 6 . 1 1 678 678 TRP CA C 678 58.582 58.582 59.523 -0.941 19514
863 1 6 . 1 1 678 678 TRP CB C 678 29.597 29.597 28.223 1.374 19514
864 1 6 . 1 1 678 678 TRP H H 678 7.795 7.795 8.338 -0.543 19514
865 1 6 . 1 1 679 679 LEU N N 679 117.805 117.805 120.685 -2.880 19514
866 1 6 . 1 1 679 679 LEU HA H 679 4.023 4.023 3.252 0.771 19514
867 1 6 . 1 1 679 679 LEU C C 679 177.463 177.463 178.564 -1.101 19514
868 1 6 . 1 1 679 679 LEU CA C 679 56.776 56.776 55.891 0.885 19514
869 1 6 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.226 0.549 19514
870 1 6 . 1 1 679 679 LEU H H 679 7.753 7.753 7.468 0.285 19514
871 1 6 . 1 1 680 680 TRP N N 680 117.351 117.351 121.683 -4.332 19514
872 1 6 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.265 0.067 19514
873 1 6 . 1 1 680 680 TRP C C 680 176.369 176.369 177.288 -0.919 19514
874 1 6 . 1 1 680 680 TRP CA C 680 58.967 58.967 59.962 -0.994 19514
875 1 6 . 1 1 680 680 TRP CB C 680 29.189 29.189 27.729 1.460 19514
876 1 6 . 1 1 680 680 TRP H H 680 7.542 7.542 8.201 -0.659 19514
877 1 6 . 1 1 681 681 TYR N N 681 116.232 116.232 119.431 -3.199 19514
878 1 6 . 1 1 681 681 TYR HA H 681 4.135 4.135 3.419 0.716 19514
879 1 6 . 1 1 681 681 TYR C C 681 175.623 175.623 175.324 0.299 19514
880 1 6 . 1 1 681 681 TYR CA C 681 59.749 59.749 58.621 1.128 19514
881 1 6 . 1 1 681 681 TYR CB C 681 39.096 39.096 37.987 1.109 19514
882 1 6 . 1 1 681 681 TYR H H 681 7.453 7.453 6.992 0.461 19514
883 1 6 . 1 1 682 682 ILE N N 682 115.034 115.034 115.157 -0.123 19514
884 1 6 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.771 0.414 19514
885 1 6 . 1 1 682 682 ILE C C 682 174.299 174.299 176.614 -2.315 19514
886 1 6 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.431 0.730 19514
887 1 6 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.022 0.764 19514
888 1 6 . 1 1 682 682 ILE H H 682 7.477 7.477 7.266 0.211 19514
889 1 7 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.482 -0.209 19514
890 1 7 . 1 1 658 658 LYS C C 658 175.560 175.560 174.828 0.732 19514
891 1 7 . 1 1 658 658 LYS CA C 658 56.733 56.733 55.468 1.266 19514
892 1 7 . 1 1 658 658 LYS CB C 658 32.982 32.982 34.223 -1.241 19514
893 1 7 . 1 1 659 659 ASP N N 659 121.529 121.529 121.737 -0.208 19514
894 1 7 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.725 -0.139 19514
895 1 7 . 1 1 659 659 ASP C C 659 176.458 176.458 177.229 -0.771 19514
896 1 7 . 1 1 659 659 ASP CA C 659 54.219 54.219 53.664 0.555 19514
897 1 7 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.865 -0.541 19514
898 1 7 . 1 1 659 659 ASP H H 659 8.329 8.329 8.435 -0.106 19514
899 1 7 . 1 1 660 660 LEU N N 660 123.060 123.060 119.809 3.251 19514
900 1 7 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.362 -0.168 19514
901 1 7 . 1 1 660 660 LEU C C 660 177.101 177.101 178.171 -1.070 19514
902 1 7 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.191 0.373 19514
903 1 7 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.301 0.188 19514
904 1 7 . 1 1 660 660 LEU H H 660 8.490 8.490 8.238 0.252 19514
905 1 7 . 1 1 661 661 LEU N N 661 118.573 118.573 118.461 0.112 19514
906 1 7 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.368 -0.019 19514
907 1 7 . 1 1 661 661 LEU C C 661 176.328 176.328 176.067 0.261 19514
908 1 7 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.209 0.610 19514
909 1 7 . 1 1 661 661 LEU CB C 661 41.778 41.778 40.668 1.110 19514
910 1 7 . 1 1 661 661 LEU H H 661 8.114 8.114 8.127 -0.013 19514
911 1 7 . 1 1 662 662 ALA N N 662 122.836 122.836 122.387 0.449 19514
912 1 7 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.223 0.182 19514
913 1 7 . 1 1 662 662 ALA C C 662 177.949 177.949 178.419 -0.470 19514
914 1 7 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.273 -0.136 19514
915 1 7 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.596 0.827 19514
916 1 7 . 1 1 662 662 ALA H H 662 7.849 7.849 7.659 0.190 19514
917 1 7 . 1 1 663 663 LEU N N 663 121.289 121.289 124.925 -3.636 19514
918 1 7 . 1 1 663 663 LEU HA H 663 4.185 4.185 4.011 0.174 19514
919 1 7 . 1 1 663 663 LEU C C 663 177.903 177.903 178.326 -0.423 19514
920 1 7 . 1 1 663 663 LEU CA C 663 56.657 56.657 58.032 -1.375 19514
921 1 7 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.357 0.588 19514
922 1 7 . 1 1 663 663 LEU H H 663 8.302 8.302 8.410 -0.108 19514
923 1 7 . 1 1 664 664 ASP N N 664 118.100 118.100 118.996 -0.896 19514
924 1 7 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.515 -0.096 19514
925 1 7 . 1 1 664 664 ASP C C 664 177.559 177.559 177.942 -0.383 19514
926 1 7 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.206 -0.899 19514
927 1 7 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.390 0.500 19514
928 1 7 . 1 1 664 664 ASP H H 664 8.437 8.437 8.716 -0.279 19514
929 1 7 . 1 1 665 665 SER N N 665 113.890 113.890 114.958 -1.068 19514
930 1 7 . 1 1 665 665 SER HA H 665 4.348 4.348 4.461 -0.113 19514
931 1 7 . 1 1 665 665 SER C C 665 175.610 175.610 175.950 -0.340 19514
932 1 7 . 1 1 665 665 SER CA C 665 59.988 59.988 60.573 -0.585 19514
933 1 7 . 1 1 665 665 SER CB C 665 63.470 63.470 63.670 -0.200 19514
934 1 7 . 1 1 665 665 SER H H 665 7.894 7.894 8.180 -0.286 19514
935 1 7 . 1 1 666 666 TRP N N 666 122.515 122.515 123.473 -0.958 19514
936 1 7 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.117 0.363 19514
937 1 7 . 1 1 666 666 TRP C C 666 177.235 177.235 177.689 -0.454 19514
938 1 7 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.438 -1.418 19514
939 1 7 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.301 0.137 19514
940 1 7 . 1 1 666 666 TRP H H 666 8.038 8.038 8.533 -0.495 19514
941 1 7 . 1 1 667 667 LYS N N 667 118.444 118.444 119.339 -0.895 19514
942 1 7 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.966 -0.049 19514
943 1 7 . 1 1 667 667 LYS C C 667 177.985 177.985 178.578 -0.593 19514
944 1 7 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.618 -0.132 19514
945 1 7 . 1 1 667 667 LYS CB C 667 32.300 32.300 31.650 0.650 19514
946 1 7 . 1 1 667 667 LYS H H 667 7.882 7.882 8.200 -0.318 19514
947 1 7 . 1 1 668 668 ASN N N 668 116.413 116.413 117.550 -1.137 19514
948 1 7 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.637 -0.009 19514
949 1 7 . 1 1 668 668 ASN C C 668 177.013 177.013 177.481 -0.468 19514
950 1 7 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.857 -0.818 19514
951 1 7 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.511 -0.214 19514
952 1 7 . 1 1 668 668 ASN H H 668 8.045 8.045 7.511 0.534 19514
953 1 7 . 1 1 669 669 LEU N N 669 120.829 120.829 121.076 -0.247 19514
954 1 7 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.621 0.403 19514
955 1 7 . 1 1 669 669 LEU C C 669 177.559 177.559 177.491 0.068 19514
956 1 7 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.143 0.798 19514
957 1 7 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.821 0.335 19514
958 1 7 . 1 1 669 669 LEU H H 669 7.804 7.804 7.794 0.010 19514
959 1 7 . 1 1 670 670 TRP N N 670 117.321 117.321 118.539 -1.218 19514
960 1 7 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.441 0.103 19514
961 1 7 . 1 1 670 670 TRP C C 670 177.194 177.194 177.291 -0.097 19514
962 1 7 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.780 0.223 19514
963 1 7 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.785 -0.071 19514
964 1 7 . 1 1 670 670 TRP H H 670 7.887 7.887 7.855 0.032 19514
965 1 7 . 1 1 671 671 ASN N N 671 115.549 115.549 115.078 0.471 19514
966 1 7 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.715 -0.165 19514
967 1 7 . 1 1 671 671 ASN C C 671 176.520 176.520 176.354 0.166 19514
968 1 7 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.481 0.535 19514
969 1 7 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.528 0.130 19514
970 1 7 . 1 1 671 671 ASN H H 671 7.968 7.968 7.938 0.030 19514
971 1 7 . 1 1 672 672 TRP N N 672 120.350 120.350 120.960 -0.610 19514
972 1 7 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.268 0.124 19514
973 1 7 . 1 1 672 672 TRP C C 672 176.592 176.592 177.026 -0.434 19514
974 1 7 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.039 -0.684 19514
975 1 7 . 1 1 672 672 TRP CB C 672 29.446 29.446 28.999 0.447 19514
976 1 7 . 1 1 672 672 TRP H H 672 8.013 8.013 7.340 0.673 19514
977 1 7 . 1 1 673 673 PHE N N 673 117.559 117.559 115.161 2.398 19514
978 1 7 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.504 -0.245 19514
979 1 7 . 1 1 673 673 PHE C C 673 175.068 175.068 176.476 -1.408 19514
980 1 7 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.427 0.436 19514
981 1 7 . 1 1 673 673 PHE CB C 673 39.298 39.298 39.114 0.184 19514
982 1 7 . 1 1 673 673 PHE H H 673 7.881 7.881 7.556 0.325 19514
983 1 7 . 1 1 674 674 ASN N N 674 118.329 118.329 121.549 -3.220 19514
984 1 7 . 1 1 674 674 ASN HA H 674 4.569 4.569 4.893 -0.324 19514
985 1 7 . 1 1 674 674 ASN C C 674 175.956 175.956 175.966 -0.010 19514
986 1 7 . 1 1 674 674 ASN CA C 674 53.378 53.378 52.422 0.956 19514
987 1 7 . 1 1 674 674 ASN CB C 674 38.420 38.420 37.797 0.623 19514
988 1 7 . 1 1 674 674 ASN H H 674 7.750 7.750 8.958 -1.208 19514
989 1 7 . 1 1 675 675 ILE N N 675 119.444 119.444 120.155 -0.711 19514
990 1 7 . 1 1 675 675 ILE HA H 675 3.727 3.727 3.974 -0.247 19514
991 1 7 . 1 1 675 675 ILE C C 675 176.638 176.638 177.716 -1.078 19514
992 1 7 . 1 1 675 675 ILE CA C 675 63.104 63.104 63.097 0.007 19514
993 1 7 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.070 1.210 19514
994 1 7 . 1 1 675 675 ILE H H 675 8.015 8.015 7.613 0.402 19514
995 1 7 . 1 1 676 676 THR N N 676 114.109 114.109 116.002 -1.893 19514
996 1 7 . 1 1 676 676 THR HA H 676 3.913 3.913 4.003 -0.090 19514
997 1 7 . 1 1 676 676 THR C C 676 175.587 175.587 175.722 -0.135 19514
998 1 7 . 1 1 676 676 THR CA C 676 65.121 65.121 66.625 -1.504 19514
999 1 7 . 1 1 676 676 THR CB C 676 68.794 68.794 68.322 0.472 19514
1000 1 7 . 1 1 676 676 THR H H 676 7.889 7.889 8.632 -0.743 19514
1001 1 7 . 1 1 677 677 ASN N N 677 118.858 118.858 118.208 0.650 19514
1002 1 7 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.605 -0.025 19514
1003 1 7 . 1 1 677 677 ASN C C 677 176.077 176.077 176.202 -0.125 19514
1004 1 7 . 1 1 677 677 ASN CA C 677 54.605 54.605 54.706 -0.101 19514
1005 1 7 . 1 1 677 677 ASN CB C 677 38.308 38.308 38.828 -0.520 19514
1006 1 7 . 1 1 677 677 ASN H H 677 7.862 7.862 7.797 0.065 19514
1007 1 7 . 1 1 678 678 TRP N N 678 119.189 119.189 119.933 -0.744 19514
1008 1 7 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.887 -0.270 19514
1009 1 7 . 1 1 678 678 TRP C C 678 176.898 176.898 178.273 -1.375 19514
1010 1 7 . 1 1 678 678 TRP CA C 678 58.582 58.582 60.358 -1.776 19514
1011 1 7 . 1 1 678 678 TRP CB C 678 29.597 29.597 30.719 -1.122 19514
1012 1 7 . 1 1 678 678 TRP H H 678 7.795 7.795 8.338 -0.543 19514
1013 1 7 . 1 1 679 679 LEU N N 679 117.805 117.805 119.273 -1.468 19514
1014 1 7 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.271 -0.248 19514
1015 1 7 . 1 1 679 679 LEU C C 679 177.463 177.463 178.096 -0.633 19514
1016 1 7 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.466 -0.690 19514
1017 1 7 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.329 0.446 19514
1018 1 7 . 1 1 679 679 LEU H H 679 7.753 7.753 8.251 -0.498 19514
1019 1 7 . 1 1 680 680 TRP N N 680 117.351 117.351 120.688 -3.337 19514
1020 1 7 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.373 -0.041 19514
1021 1 7 . 1 1 680 680 TRP C C 680 176.369 176.369 176.509 -0.140 19514
1022 1 7 . 1 1 680 680 TRP CA C 680 58.967 58.967 59.253 -0.286 19514
1023 1 7 . 1 1 680 680 TRP CB C 680 29.189 29.189 28.212 0.977 19514
1024 1 7 . 1 1 680 680 TRP H H 680 7.542 7.542 8.347 -0.805 19514
1025 1 7 . 1 1 681 681 TYR N N 681 116.232 116.232 120.047 -3.815 19514
1026 1 7 . 1 1 681 681 TYR HA H 681 4.135 4.135 3.890 0.245 19514
1027 1 7 . 1 1 681 681 TYR C C 681 175.623 175.623 175.281 0.342 19514
1028 1 7 . 1 1 681 681 TYR CA C 681 59.749 59.749 58.560 1.189 19514
1029 1 7 . 1 1 681 681 TYR CB C 681 39.096 39.096 38.578 0.518 19514
1030 1 7 . 1 1 681 681 TYR H H 681 7.453 7.453 7.480 -0.027 19514
1031 1 7 . 1 1 682 682 ILE N N 682 115.034 115.034 114.741 0.293 19514
1032 1 7 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.809 0.376 19514
1033 1 7 . 1 1 682 682 ILE C C 682 174.299 174.299 175.817 -1.518 19514
1034 1 7 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.167 0.994 19514
1035 1 7 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.426 0.360 19514
1036 1 7 . 1 1 682 682 ILE H H 682 7.477 7.477 6.880 0.597 19514
1037 1 8 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.041 0.232 19514
1038 1 8 . 1 1 658 658 LYS C C 658 175.560 175.560 175.533 0.027 19514
1039 1 8 . 1 1 658 658 LYS CA C 658 56.733 56.733 57.005 -0.272 19514
1040 1 8 . 1 1 658 658 LYS CB C 658 32.982 32.982 32.476 0.506 19514
1041 1 8 . 1 1 659 659 ASP N N 659 121.529 121.529 119.247 2.282 19514
1042 1 8 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.601 -0.015 19514
1043 1 8 . 1 1 659 659 ASP C C 659 176.458 176.458 177.974 -1.516 19514
1044 1 8 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.637 -0.418 19514
1045 1 8 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.250 0.074 19514
1046 1 8 . 1 1 659 659 ASP H H 659 8.329 8.329 8.280 0.049 19514
1047 1 8 . 1 1 660 660 LEU N N 660 123.060 123.060 120.707 2.353 19514
1048 1 8 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.363 -0.169 19514
1049 1 8 . 1 1 660 660 LEU C C 660 177.101 177.101 177.927 -0.826 19514
1050 1 8 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.329 0.235 19514
1051 1 8 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.507 -0.018 19514
1052 1 8 . 1 1 660 660 LEU H H 660 8.490 8.490 8.312 0.178 19514
1053 1 8 . 1 1 661 661 LEU N N 661 118.573 118.573 119.738 -1.165 19514
1054 1 8 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.423 -0.074 19514
1055 1 8 . 1 1 661 661 LEU C C 661 176.328 176.328 176.248 0.080 19514
1056 1 8 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.342 0.477 19514
1057 1 8 . 1 1 661 661 LEU CB C 661 41.778 41.778 40.051 1.727 19514
1058 1 8 . 1 1 661 661 LEU H H 661 8.114 8.114 8.121 -0.007 19514
1059 1 8 . 1 1 662 662 ALA N N 662 122.836 122.836 122.716 0.120 19514
1060 1 8 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.230 0.175 19514
1061 1 8 . 1 1 662 662 ALA C C 662 177.949 177.949 178.283 -0.334 19514
1062 1 8 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.249 -0.112 19514
1063 1 8 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.698 0.726 19514
1064 1 8 . 1 1 662 662 ALA H H 662 7.849 7.849 7.755 0.094 19514
1065 1 8 . 1 1 663 663 LEU N N 663 121.289 121.289 124.489 -3.200 19514
1066 1 8 . 1 1 663 663 LEU HA H 663 4.185 4.185 4.014 0.171 19514
1067 1 8 . 1 1 663 663 LEU C C 663 177.903 177.903 178.214 -0.311 19514
1068 1 8 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.896 -1.239 19514
1069 1 8 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.271 0.674 19514
1070 1 8 . 1 1 663 663 LEU H H 663 8.302 8.302 8.410 -0.108 19514
1071 1 8 . 1 1 664 664 ASP N N 664 118.100 118.100 118.646 -0.546 19514
1072 1 8 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.512 -0.093 19514
1073 1 8 . 1 1 664 664 ASP C C 664 177.559 177.559 178.115 -0.556 19514
1074 1 8 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.246 -0.939 19514
1075 1 8 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.385 0.505 19514
1076 1 8 . 1 1 664 664 ASP H H 664 8.437 8.437 8.737 -0.300 19514
1077 1 8 . 1 1 665 665 SER N N 665 113.890 113.890 114.012 -0.122 19514
1078 1 8 . 1 1 665 665 SER HA H 665 4.348 4.348 4.424 -0.076 19514
1079 1 8 . 1 1 665 665 SER C C 665 175.610 175.610 176.383 -0.773 19514
1080 1 8 . 1 1 665 665 SER CA C 665 59.988 59.988 59.916 0.072 19514
1081 1 8 . 1 1 665 665 SER CB C 665 63.470 63.470 63.910 -0.440 19514
1082 1 8 . 1 1 665 665 SER H H 665 7.894 7.894 8.111 -0.217 19514
1083 1 8 . 1 1 666 666 TRP N N 666 122.515 122.515 123.694 -1.179 19514
1084 1 8 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.193 0.287 19514
1085 1 8 . 1 1 666 666 TRP C C 666 177.235 177.235 177.949 -0.714 19514
1086 1 8 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.385 -1.365 19514
1087 1 8 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.417 0.021 19514
1088 1 8 . 1 1 666 666 TRP H H 666 8.038 8.038 8.243 -0.205 19514
1089 1 8 . 1 1 667 667 LYS N N 667 118.444 118.444 119.702 -1.258 19514
1090 1 8 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.890 0.027 19514
1091 1 8 . 1 1 667 667 LYS C C 667 177.985 177.985 177.994 -0.009 19514
1092 1 8 . 1 1 667 667 LYS CA C 667 59.486 59.486 60.050 -0.564 19514
1093 1 8 . 1 1 667 667 LYS CB C 667 32.300 32.300 32.032 0.268 19514
1094 1 8 . 1 1 667 667 LYS H H 667 7.882 7.882 8.232 -0.350 19514
1095 1 8 . 1 1 668 668 ASN N N 668 116.413 116.413 116.577 -0.164 19514
1096 1 8 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.680 -0.052 19514
1097 1 8 . 1 1 668 668 ASN C C 668 177.013 177.013 177.238 -0.225 19514
1098 1 8 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.457 -0.418 19514
1099 1 8 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.294 0.003 19514
1100 1 8 . 1 1 668 668 ASN H H 668 8.045 8.045 7.627 0.418 19514
1101 1 8 . 1 1 669 669 LEU N N 669 120.829 120.829 120.858 -0.029 19514
1102 1 8 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.595 0.429 19514
1103 1 8 . 1 1 669 669 LEU C C 669 177.559 177.559 177.756 -0.197 19514
1104 1 8 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.124 0.817 19514
1105 1 8 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.821 0.335 19514
1106 1 8 . 1 1 669 669 LEU H H 669 7.804 7.804 7.789 0.015 19514
1107 1 8 . 1 1 670 670 TRP N N 670 117.321 117.321 118.431 -1.110 19514
1108 1 8 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.501 0.043 19514
1109 1 8 . 1 1 670 670 TRP C C 670 177.194 177.194 177.287 -0.093 19514
1110 1 8 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.764 0.239 19514
1111 1 8 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.715 -0.001 19514
1112 1 8 . 1 1 670 670 TRP H H 670 7.887 7.887 7.862 0.025 19514
1113 1 8 . 1 1 671 671 ASN N N 671 115.549 115.549 114.822 0.727 19514
1114 1 8 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.720 -0.170 19514
1115 1 8 . 1 1 671 671 ASN C C 671 176.520 176.520 176.293 0.227 19514
1116 1 8 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.615 0.402 19514
1117 1 8 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.700 -0.042 19514
1118 1 8 . 1 1 671 671 ASN H H 671 7.968 7.968 7.917 0.051 19514
1119 1 8 . 1 1 672 672 TRP N N 672 120.350 120.350 120.756 -0.406 19514
1120 1 8 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.261 0.131 19514
1121 1 8 . 1 1 672 672 TRP C C 672 176.592 176.592 177.587 -0.995 19514
1122 1 8 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.320 -0.964 19514
1123 1 8 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.095 0.351 19514
1124 1 8 . 1 1 672 672 TRP H H 672 8.013 8.013 7.476 0.537 19514
1125 1 8 . 1 1 673 673 PHE N N 673 117.559 117.559 116.879 0.680 19514
1126 1 8 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.367 -0.108 19514
1127 1 8 . 1 1 673 673 PHE C C 673 175.068 175.068 176.640 -1.572 19514
1128 1 8 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.767 0.096 19514
1129 1 8 . 1 1 673 673 PHE CB C 673 39.298 39.298 37.582 1.716 19514
1130 1 8 . 1 1 673 673 PHE H H 673 7.881 7.881 7.707 0.174 19514
1131 1 8 . 1 1 674 674 ASN N N 674 118.329 118.329 125.033 -6.704 19514
1132 1 8 . 1 1 674 674 ASN HA H 674 4.569 4.569 4.812 -0.243 19514
1133 1 8 . 1 1 674 674 ASN C C 674 175.956 175.956 176.198 -0.242 19514
1134 1 8 . 1 1 674 674 ASN CA C 674 53.378 53.378 52.376 1.002 19514
1135 1 8 . 1 1 674 674 ASN CB C 674 38.420 38.420 37.644 0.776 19514
1136 1 8 . 1 1 674 674 ASN H H 674 7.750 7.750 8.683 -0.933 19514
1137 1 8 . 1 1 675 675 ILE N N 675 119.444 119.444 117.960 1.484 19514
1138 1 8 . 1 1 675 675 ILE HA H 675 3.727 3.727 4.053 -0.326 19514
1139 1 8 . 1 1 675 675 ILE C C 675 176.638 176.638 177.329 -0.691 19514
1140 1 8 . 1 1 675 675 ILE CA C 675 63.104 63.104 63.987 -0.883 19514
1141 1 8 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.859 0.421 19514
1142 1 8 . 1 1 675 675 ILE H H 675 8.015 8.015 8.239 -0.224 19514
1143 1 8 . 1 1 676 676 THR N N 676 114.109 114.109 116.034 -1.925 19514
1144 1 8 . 1 1 676 676 THR HA H 676 3.913 3.913 3.987 -0.074 19514
1145 1 8 . 1 1 676 676 THR C C 676 175.587 175.587 176.009 -0.422 19514
1146 1 8 . 1 1 676 676 THR CA C 676 65.121 65.121 66.552 -1.431 19514
1147 1 8 . 1 1 676 676 THR CB C 676 68.794 68.794 68.013 0.781 19514
1148 1 8 . 1 1 676 676 THR H H 676 7.889 7.889 8.539 -0.650 19514
1149 1 8 . 1 1 677 677 ASN N N 677 118.858 118.858 117.788 1.070 19514
1150 1 8 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.609 -0.029 19514
1151 1 8 . 1 1 677 677 ASN C C 677 176.077 176.077 176.190 -0.113 19514
1152 1 8 . 1 1 677 677 ASN CA C 677 54.605 54.605 54.751 -0.145 19514
1153 1 8 . 1 1 677 677 ASN CB C 677 38.308 38.308 38.901 -0.593 19514
1154 1 8 . 1 1 677 677 ASN H H 677 7.862 7.862 7.744 0.118 19514
1155 1 8 . 1 1 678 678 TRP N N 678 119.189 119.189 119.754 -0.565 19514
1156 1 8 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.744 -0.127 19514
1157 1 8 . 1 1 678 678 TRP C C 678 176.898 176.898 178.376 -1.478 19514
1158 1 8 . 1 1 678 678 TRP CA C 678 58.582 58.582 60.165 -1.583 19514
1159 1 8 . 1 1 678 678 TRP CB C 678 29.597 29.597 30.616 -1.019 19514
1160 1 8 . 1 1 678 678 TRP H H 678 7.795 7.795 8.260 -0.465 19514
1161 1 8 . 1 1 679 679 LEU N N 679 117.805 117.805 120.054 -2.249 19514
1162 1 8 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.500 -0.477 19514
1163 1 8 . 1 1 679 679 LEU C C 679 177.463 177.463 179.102 -1.639 19514
1164 1 8 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.394 -0.618 19514
1165 1 8 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.330 0.445 19514
1166 1 8 . 1 1 679 679 LEU H H 679 7.753 7.753 8.303 -0.550 19514
1167 1 8 . 1 1 680 680 TRP N N 680 117.351 117.351 122.075 -4.724 19514
1168 1 8 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.388 -0.056 19514
1169 1 8 . 1 1 680 680 TRP C C 680 176.369 176.369 176.574 -0.205 19514
1170 1 8 . 1 1 680 680 TRP CA C 680 58.967 58.967 59.708 -0.741 19514
1171 1 8 . 1 1 680 680 TRP CB C 680 29.189 29.189 27.732 1.457 19514
1172 1 8 . 1 1 680 680 TRP H H 680 7.542 7.542 8.635 -1.093 19514
1173 1 8 . 1 1 681 681 TYR N N 681 116.232 116.232 116.953 -0.721 19514
1174 1 8 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.207 -0.072 19514
1175 1 8 . 1 1 681 681 TYR C C 681 175.623 175.623 176.056 -0.433 19514
1176 1 8 . 1 1 681 681 TYR CA C 681 59.749 59.749 55.264 4.485 19514
1177 1 8 . 1 1 681 681 TYR CB C 681 39.096 39.096 37.760 1.336 19514
1178 1 8 . 1 1 681 681 TYR H H 681 7.453 7.453 7.583 -0.130 19514
1179 1 8 . 1 1 682 682 ILE N N 682 115.034 115.034 116.857 -1.823 19514
1180 1 8 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.613 0.572 19514
1181 1 8 . 1 1 682 682 ILE C C 682 174.299 174.299 176.572 -2.273 19514
1182 1 8 . 1 1 682 682 ILE CA C 682 61.161 61.161 61.927 -0.766 19514
1183 1 8 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.375 0.411 19514
1184 1 8 . 1 1 682 682 ILE H H 682 7.477 7.477 8.144 -0.667 19514
1185 1 9 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.041 0.232 19514
1186 1 9 . 1 1 658 658 LYS C C 658 175.560 175.560 175.428 0.132 19514
1187 1 9 . 1 1 658 658 LYS CA C 658 56.733 56.733 56.908 -0.175 19514
1188 1 9 . 1 1 658 658 LYS CB C 658 32.982 32.982 32.550 0.432 19514
1189 1 9 . 1 1 659 659 ASP N N 659 121.529 121.529 118.879 2.650 19514
1190 1 9 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.587 -0.001 19514
1191 1 9 . 1 1 659 659 ASP C C 659 176.458 176.458 178.504 -2.046 19514
1192 1 9 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.723 -0.504 19514
1193 1 9 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.291 0.033 19514
1194 1 9 . 1 1 659 659 ASP H H 659 8.329 8.329 8.299 0.030 19514
1195 1 9 . 1 1 660 660 LEU N N 660 123.060 123.060 120.854 2.206 19514
1196 1 9 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.215 -0.021 19514
1197 1 9 . 1 1 660 660 LEU C C 660 177.101 177.101 178.204 -1.103 19514
1198 1 9 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.846 -0.282 19514
1199 1 9 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.251 0.238 19514
1200 1 9 . 1 1 660 660 LEU H H 660 8.490 8.490 8.368 0.122 19514
1201 1 9 . 1 1 661 661 LEU N N 661 118.573 118.573 118.986 -0.413 19514
1202 1 9 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.410 -0.061 19514
1203 1 9 . 1 1 661 661 LEU C C 661 176.328 176.328 176.206 0.122 19514
1204 1 9 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.251 0.568 19514
1205 1 9 . 1 1 661 661 LEU CB C 661 41.778 41.778 39.855 1.923 19514
1206 1 9 . 1 1 661 661 LEU H H 661 8.114 8.114 8.039 0.075 19514
1207 1 9 . 1 1 662 662 ALA N N 662 122.836 122.836 123.013 -0.177 19514
1208 1 9 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.203 0.202 19514
1209 1 9 . 1 1 662 662 ALA C C 662 177.949 177.949 178.103 -0.154 19514
1210 1 9 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.287 -0.150 19514
1211 1 9 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.581 0.842 19514
1212 1 9 . 1 1 662 662 ALA H H 662 7.849 7.849 7.480 0.369 19514
1213 1 9 . 1 1 663 663 LEU N N 663 121.289 121.289 125.926 -4.637 19514
1214 1 9 . 1 1 663 663 LEU HA H 663 4.185 4.185 3.922 0.263 19514
1215 1 9 . 1 1 663 663 LEU C C 663 177.903 177.903 178.297 -0.394 19514
1216 1 9 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.810 -1.153 19514
1217 1 9 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.721 0.223 19514
1218 1 9 . 1 1 663 663 LEU H H 663 8.302 8.302 8.560 -0.258 19514
1219 1 9 . 1 1 664 664 ASP N N 664 118.100 118.100 117.968 0.132 19514
1220 1 9 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.528 -0.109 19514
1221 1 9 . 1 1 664 664 ASP C C 664 177.559 177.559 177.616 -0.057 19514
1222 1 9 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.052 -0.745 19514
1223 1 9 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.343 0.547 19514
1224 1 9 . 1 1 664 664 ASP H H 664 8.437 8.437 8.688 -0.251 19514
1225 1 9 . 1 1 665 665 SER N N 665 113.890 113.890 113.768 0.122 19514
1226 1 9 . 1 1 665 665 SER HA H 665 4.348 4.348 4.459 -0.111 19514
1227 1 9 . 1 1 665 665 SER C C 665 175.610 175.610 176.135 -0.525 19514
1228 1 9 . 1 1 665 665 SER CA C 665 59.988 59.988 59.947 0.041 19514
1229 1 9 . 1 1 665 665 SER CB C 665 63.470 63.470 63.918 -0.448 19514
1230 1 9 . 1 1 665 665 SER H H 665 7.894 7.894 8.098 -0.204 19514
1231 1 9 . 1 1 666 666 TRP N N 666 122.515 122.515 123.875 -1.360 19514
1232 1 9 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.080 0.400 19514
1233 1 9 . 1 1 666 666 TRP C C 666 177.235 177.235 177.669 -0.434 19514
1234 1 9 . 1 1 666 666 TRP CA C 666 59.020 59.020 61.056 -2.036 19514
1235 1 9 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.300 0.138 19514
1236 1 9 . 1 1 666 666 TRP H H 666 8.038 8.038 8.292 -0.254 19514
1237 1 9 . 1 1 667 667 LYS N N 667 118.444 118.444 118.759 -0.315 19514
1238 1 9 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.929 -0.012 19514
1239 1 9 . 1 1 667 667 LYS C C 667 177.985 177.985 178.799 -0.814 19514
1240 1 9 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.867 -0.381 19514
1241 1 9 . 1 1 667 667 LYS CB C 667 32.300 32.300 31.931 0.369 19514
1242 1 9 . 1 1 667 667 LYS H H 667 7.882 7.882 8.071 -0.189 19514
1243 1 9 . 1 1 668 668 ASN N N 668 116.413 116.413 117.966 -1.553 19514
1244 1 9 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.542 0.086 19514
1245 1 9 . 1 1 668 668 ASN C C 668 177.013 177.013 177.403 -0.390 19514
1246 1 9 . 1 1 668 668 ASN CA C 668 55.039 55.039 56.092 -1.053 19514
1247 1 9 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.505 -0.208 19514
1248 1 9 . 1 1 668 668 ASN H H 668 8.045 8.045 7.548 0.497 19514
1249 1 9 . 1 1 669 669 LEU N N 669 120.829 120.829 121.836 -1.007 19514
1250 1 9 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.548 0.476 19514
1251 1 9 . 1 1 669 669 LEU C C 669 177.559 177.559 177.949 -0.390 19514
1252 1 9 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.755 0.186 19514
1253 1 9 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.476 0.680 19514
1254 1 9 . 1 1 669 669 LEU H H 669 7.804 7.804 7.555 0.249 19514
1255 1 9 . 1 1 670 670 TRP N N 670 117.321 117.321 117.365 -0.044 19514
1256 1 9 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.314 0.230 19514
1257 1 9 . 1 1 670 670 TRP C C 670 177.194 177.194 177.453 -0.259 19514
1258 1 9 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.626 0.377 19514
1259 1 9 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.445 0.269 19514
1260 1 9 . 1 1 670 670 TRP H H 670 7.887 7.887 7.891 -0.004 19514
1261 1 9 . 1 1 671 671 ASN N N 671 115.549 115.549 115.134 0.415 19514
1262 1 9 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.880 -0.330 19514
1263 1 9 . 1 1 671 671 ASN C C 671 176.520 176.520 176.502 0.018 19514
1264 1 9 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.923 0.094 19514
1265 1 9 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.837 -0.179 19514
1266 1 9 . 1 1 671 671 ASN H H 671 7.968 7.968 7.791 0.177 19514
1267 1 9 . 1 1 672 672 TRP N N 672 120.350 120.350 120.681 -0.331 19514
1268 1 9 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.451 -0.059 19514
1269 1 9 . 1 1 672 672 TRP C C 672 176.592 176.592 178.114 -1.522 19514
1270 1 9 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.319 -0.963 19514
1271 1 9 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.594 -0.148 19514
1272 1 9 . 1 1 672 672 TRP H H 672 8.013 8.013 7.749 0.264 19514
1273 1 9 . 1 1 673 673 PHE N N 673 117.559 117.559 117.029 0.530 19514
1274 1 9 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.440 -0.181 19514
1275 1 9 . 1 1 673 673 PHE C C 673 175.068 175.068 176.305 -1.237 19514
1276 1 9 . 1 1 673 673 PHE CA C 673 58.863 58.863 59.231 -0.368 19514
1277 1 9 . 1 1 673 673 PHE CB C 673 39.298 39.298 39.154 0.145 19514
1278 1 9 . 1 1 673 673 PHE H H 673 7.881 7.881 8.299 -0.418 19514
1279 1 9 . 1 1 674 674 ASN N N 674 118.329 118.329 123.074 -4.745 19514
1280 1 9 . 1 1 674 674 ASN HA H 674 4.569 4.569 4.957 -0.388 19514
1281 1 9 . 1 1 674 674 ASN C C 674 175.956 175.956 176.100 -0.144 19514
1282 1 9 . 1 1 674 674 ASN CA C 674 53.378 53.378 51.999 1.379 19514
1283 1 9 . 1 1 674 674 ASN CB C 674 38.420 38.420 37.250 1.170 19514
1284 1 9 . 1 1 674 674 ASN H H 674 7.750 7.750 8.846 -1.096 19514
1285 1 9 . 1 1 675 675 ILE N N 675 119.444 119.444 120.186 -0.742 19514
1286 1 9 . 1 1 675 675 ILE HA H 675 3.727 3.727 3.866 -0.139 19514
1287 1 9 . 1 1 675 675 ILE C C 675 176.638 176.638 177.322 -0.684 19514
1288 1 9 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.356 -1.252 19514
1289 1 9 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.867 0.413 19514
1290 1 9 . 1 1 675 675 ILE H H 675 8.015 8.015 7.462 0.553 19514
1291 1 9 . 1 1 676 676 THR N N 676 114.109 114.109 114.068 0.041 19514
1292 1 9 . 1 1 676 676 THR HA H 676 3.913 3.913 4.002 -0.089 19514
1293 1 9 . 1 1 676 676 THR C C 676 175.587 175.587 176.453 -0.866 19514
1294 1 9 . 1 1 676 676 THR CA C 676 65.121 65.121 66.097 -0.976 19514
1295 1 9 . 1 1 676 676 THR CB C 676 68.794 68.794 68.810 -0.016 19514
1296 1 9 . 1 1 676 676 THR H H 676 7.889 7.889 8.652 -0.763 19514
1297 1 9 . 1 1 677 677 ASN N N 677 118.858 118.858 118.998 -0.140 19514
1298 1 9 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.973 -0.393 19514
1299 1 9 . 1 1 677 677 ASN C C 677 176.077 176.077 176.580 -0.503 19514
1300 1 9 . 1 1 677 677 ASN CA C 677 54.605 54.605 55.831 -1.226 19514
1301 1 9 . 1 1 677 677 ASN CB C 677 38.308 38.308 38.818 -0.510 19514
1302 1 9 . 1 1 677 677 ASN H H 677 7.862 7.862 7.792 0.070 19514
1303 1 9 . 1 1 678 678 TRP N N 678 119.189 119.189 119.719 -0.530 19514
1304 1 9 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.695 -0.078 19514
1305 1 9 . 1 1 678 678 TRP C C 678 176.898 176.898 178.162 -1.264 19514
1306 1 9 . 1 1 678 678 TRP CA C 678 58.582 58.582 60.524 -1.942 19514
1307 1 9 . 1 1 678 678 TRP CB C 678 29.597 29.597 30.475 -0.878 19514
1308 1 9 . 1 1 678 678 TRP H H 678 7.795 7.795 8.325 -0.530 19514
1309 1 9 . 1 1 679 679 LEU N N 679 117.805 117.805 118.721 -0.916 19514
1310 1 9 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.175 -0.152 19514
1311 1 9 . 1 1 679 679 LEU C C 679 177.463 177.463 178.211 -0.748 19514
1312 1 9 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.501 -0.725 19514
1313 1 9 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.229 0.546 19514
1314 1 9 . 1 1 679 679 LEU H H 679 7.753 7.753 8.203 -0.450 19514
1315 1 9 . 1 1 680 680 TRP N N 680 117.351 117.351 119.774 -2.423 19514
1316 1 9 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.340 -0.008 19514
1317 1 9 . 1 1 680 680 TRP C C 680 176.369 176.369 178.052 -1.683 19514
1318 1 9 . 1 1 680 680 TRP CA C 680 58.967 58.967 60.187 -1.220 19514
1319 1 9 . 1 1 680 680 TRP CB C 680 29.189 29.189 29.498 -0.310 19514
1320 1 9 . 1 1 680 680 TRP H H 680 7.542 7.542 8.315 -0.773 19514
1321 1 9 . 1 1 681 681 TYR N N 681 116.232 116.232 117.417 -1.185 19514
1322 1 9 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.634 -0.499 19514
1323 1 9 . 1 1 681 681 TYR C C 681 175.623 175.623 175.455 0.168 19514
1324 1 9 . 1 1 681 681 TYR CA C 681 59.749 59.749 59.091 0.658 19514
1325 1 9 . 1 1 681 681 TYR CB C 681 39.096 39.096 39.500 -0.404 19514
1326 1 9 . 1 1 681 681 TYR H H 681 7.453 7.453 7.865 -0.412 19514
1327 1 9 . 1 1 682 682 ILE N N 682 115.034 115.034 115.000 0.034 19514
1328 1 9 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.874 0.311 19514
1329 1 9 . 1 1 682 682 ILE C C 682 174.299 174.299 176.111 -1.812 19514
1330 1 9 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.304 0.857 19514
1331 1 9 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.192 0.594 19514
1332 1 9 . 1 1 682 682 ILE H H 682 7.477 7.477 7.240 0.237 19514
1333 1 10 . 1 1 658 658 LYS HA H 658 4.273 4.273 4.471 -0.198 19514
1334 1 10 . 1 1 658 658 LYS C C 658 175.560 175.560 175.106 0.454 19514
1335 1 10 . 1 1 658 658 LYS CA C 658 56.733 56.733 56.305 0.428 19514
1336 1 10 . 1 1 658 658 LYS CB C 658 32.982 32.982 32.888 0.094 19514
1337 1 10 . 1 1 659 659 ASP N N 659 121.529 121.529 120.640 0.889 19514
1338 1 10 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.625 -0.039 19514
1339 1 10 . 1 1 659 659 ASP C C 659 176.458 176.458 176.839 -0.381 19514
1340 1 10 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.303 -0.084 19514
1341 1 10 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.565 -0.241 19514
1342 1 10 . 1 1 659 659 ASP H H 659 8.329 8.329 7.844 0.485 19514
1343 1 10 . 1 1 660 660 LEU N N 660 123.060 123.060 120.097 2.963 19514
1344 1 10 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.391 -0.197 19514
1345 1 10 . 1 1 660 660 LEU C C 660 177.101 177.101 177.874 -0.773 19514
1346 1 10 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.450 0.114 19514
1347 1 10 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.369 0.120 19514
1348 1 10 . 1 1 660 660 LEU H H 660 8.490 8.490 8.131 0.359 19514
1349 1 10 . 1 1 661 661 LEU N N 661 118.573 118.573 119.725 -1.152 19514
1350 1 10 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.415 -0.066 19514
1351 1 10 . 1 1 661 661 LEU C C 661 176.328 176.328 176.455 -0.127 19514
1352 1 10 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.805 0.014 19514
1353 1 10 . 1 1 661 661 LEU CB C 661 41.778 41.778 40.381 1.397 19514
1354 1 10 . 1 1 661 661 LEU H H 661 8.114 8.114 8.030 0.084 19514
1355 1 10 . 1 1 662 662 ALA N N 662 122.836 122.836 122.352 0.484 19514
1356 1 10 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.246 0.159 19514
1357 1 10 . 1 1 662 662 ALA C C 662 177.949 177.949 178.529 -0.580 19514
1358 1 10 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.265 -0.128 19514
1359 1 10 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.496 0.927 19514
1360 1 10 . 1 1 662 662 ALA H H 662 7.849 7.849 8.106 -0.257 19514
1361 1 10 . 1 1 663 663 LEU N N 663 121.289 121.289 123.649 -2.360 19514
1362 1 10 . 1 1 663 663 LEU HA H 663 4.185 4.185 4.012 0.173 19514
1363 1 10 . 1 1 663 663 LEU C C 663 177.903 177.903 177.811 0.092 19514
1364 1 10 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.968 -1.311 19514
1365 1 10 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.209 0.736 19514
1366 1 10 . 1 1 663 663 LEU H H 663 8.302 8.302 8.494 -0.192 19514
1367 1 10 . 1 1 664 664 ASP N N 664 118.100 118.100 118.843 -0.743 19514
1368 1 10 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.472 -0.053 19514
1369 1 10 . 1 1 664 664 ASP C C 664 177.559 177.559 178.236 -0.677 19514
1370 1 10 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.371 -1.064 19514
1371 1 10 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.142 0.747 19514
1372 1 10 . 1 1 664 664 ASP H H 664 8.437 8.437 8.641 -0.204 19514
1373 1 10 . 1 1 665 665 SER N N 665 113.890 113.890 114.040 -0.150 19514
1374 1 10 . 1 1 665 665 SER HA H 665 4.348 4.348 4.471 -0.123 19514
1375 1 10 . 1 1 665 665 SER C C 665 175.610 175.610 176.380 -0.770 19514
1376 1 10 . 1 1 665 665 SER CA C 665 59.988 59.988 60.030 -0.042 19514
1377 1 10 . 1 1 665 665 SER CB C 665 63.470 63.470 63.830 -0.360 19514
1378 1 10 . 1 1 665 665 SER H H 665 7.894 7.894 8.122 -0.228 19514
1379 1 10 . 1 1 666 666 TRP N N 666 122.515 122.515 123.518 -1.003 19514
1380 1 10 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.146 0.334 19514
1381 1 10 . 1 1 666 666 TRP C C 666 177.235 177.235 177.199 0.036 19514
1382 1 10 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.657 -1.637 19514
1383 1 10 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.373 0.064 19514
1384 1 10 . 1 1 666 666 TRP H H 666 8.038 8.038 8.442 -0.404 19514
1385 1 10 . 1 1 667 667 LYS N N 667 118.444 118.444 118.858 -0.414 19514
1386 1 10 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.955 -0.038 19514
1387 1 10 . 1 1 667 667 LYS C C 667 177.985 177.985 178.826 -0.841 19514
1388 1 10 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.858 -0.372 19514
1389 1 10 . 1 1 667 667 LYS CB C 667 32.300 32.300 32.002 0.298 19514
1390 1 10 . 1 1 667 667 LYS H H 667 7.882 7.882 8.239 -0.357 19514
1391 1 10 . 1 1 668 668 ASN N N 668 116.413 116.413 117.937 -1.524 19514
1392 1 10 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.534 0.094 19514
1393 1 10 . 1 1 668 668 ASN C C 668 177.013 177.013 177.413 -0.400 19514
1394 1 10 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.992 -0.953 19514
1395 1 10 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.414 -0.117 19514
1396 1 10 . 1 1 668 668 ASN H H 668 8.045 8.045 7.562 0.483 19514
1397 1 10 . 1 1 669 669 LEU N N 669 120.829 120.829 121.839 -1.010 19514
1398 1 10 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.500 0.524 19514
1399 1 10 . 1 1 669 669 LEU C C 669 177.559 177.559 178.010 -0.451 19514
1400 1 10 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.774 0.167 19514
1401 1 10 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.564 0.592 19514
1402 1 10 . 1 1 669 669 LEU H H 669 7.804 7.804 7.585 0.219 19514
1403 1 10 . 1 1 670 670 TRP N N 670 117.321 117.321 117.468 -0.147 19514
1404 1 10 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.530 0.014 19514
1405 1 10 . 1 1 670 670 TRP C C 670 177.194 177.194 177.600 -0.406 19514
1406 1 10 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.680 0.323 19514
1407 1 10 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.601 0.113 19514
1408 1 10 . 1 1 670 670 TRP H H 670 7.887 7.887 7.945 -0.058 19514
1409 1 10 . 1 1 671 671 ASN N N 671 115.549 115.549 114.813 0.736 19514
1410 1 10 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.871 -0.321 19514
1411 1 10 . 1 1 671 671 ASN C C 671 176.520 176.520 176.637 -0.117 19514
1412 1 10 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.798 0.219 19514
1413 1 10 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.761 -0.103 19514
1414 1 10 . 1 1 671 671 ASN H H 671 7.968 7.968 7.870 0.098 19514
1415 1 10 . 1 1 672 672 TRP N N 672 120.350 120.350 120.827 -0.477 19514
1416 1 10 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.291 0.101 19514
1417 1 10 . 1 1 672 672 TRP C C 672 176.592 176.592 177.364 -0.772 19514
1418 1 10 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.745 -1.389 19514
1419 1 10 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.165 0.281 19514
1420 1 10 . 1 1 672 672 TRP H H 672 8.013 8.013 7.684 0.329 19514
1421 1 10 . 1 1 673 673 PHE N N 673 117.559 117.559 117.023 0.536 19514
1422 1 10 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.509 -0.250 19514
1423 1 10 . 1 1 673 673 PHE C C 673 175.068 175.068 175.989 -0.921 19514
1424 1 10 . 1 1 673 673 PHE CA C 673 58.863 58.863 59.246 -0.383 19514
1425 1 10 . 1 1 673 673 PHE CB C 673 39.298 39.298 37.273 2.025 19514
1426 1 10 . 1 1 673 673 PHE H H 673 7.881 7.881 7.712 0.169 19514
1427 1 10 . 1 1 674 674 ASN N N 674 118.329 118.329 125.165 -6.836 19514
1428 1 10 . 1 1 674 674 ASN HA H 674 4.569 4.569 5.108 -0.539 19514
1429 1 10 . 1 1 674 674 ASN C C 674 175.956 175.956 175.382 0.574 19514
1430 1 10 . 1 1 674 674 ASN CA C 674 53.378 53.378 51.973 1.405 19514
1431 1 10 . 1 1 674 674 ASN CB C 674 38.420 38.420 38.081 0.339 19514
1432 1 10 . 1 1 674 674 ASN H H 674 7.750 7.750 8.687 -0.937 19514
1433 1 10 . 1 1 675 675 ILE N N 675 119.444 119.444 122.276 -2.832 19514
1434 1 10 . 1 1 675 675 ILE HA H 675 3.727 3.727 2.216 1.511 19514
1435 1 10 . 1 1 675 675 ILE C C 675 176.638 176.638 176.958 -0.320 19514
1436 1 10 . 1 1 675 675 ILE CA C 675 63.104 63.104 63.524 -0.420 19514
1437 1 10 . 1 1 675 675 ILE CB C 675 38.280 38.280 36.123 2.157 19514
1438 1 10 . 1 1 675 675 ILE H H 675 8.015 8.015 8.073 -0.058 19514
1439 1 10 . 1 1 676 676 THR N N 676 114.109 114.109 115.029 -0.920 19514
1440 1 10 . 1 1 676 676 THR HA H 676 3.913 3.913 3.635 0.278 19514
1441 1 10 . 1 1 676 676 THR C C 676 175.587 175.587 176.539 -0.952 19514
1442 1 10 . 1 1 676 676 THR CA C 676 65.121 65.121 66.424 -1.303 19514
1443 1 10 . 1 1 676 676 THR CB C 676 68.794 68.794 68.193 0.601 19514
1444 1 10 . 1 1 676 676 THR H H 676 7.889 7.889 8.092 -0.203 19514
1445 1 10 . 1 1 677 677 ASN N N 677 118.858 118.858 120.142 -1.284 19514
1446 1 10 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.823 -0.243 19514
1447 1 10 . 1 1 677 677 ASN C C 677 176.077 176.077 176.960 -0.883 19514
1448 1 10 . 1 1 677 677 ASN CA C 677 54.605 54.605 56.164 -1.560 19514
1449 1 10 . 1 1 677 677 ASN CB C 677 38.308 38.308 39.172 -0.864 19514
1450 1 10 . 1 1 677 677 ASN H H 677 7.862 7.862 8.261 -0.399 19514
1451 1 10 . 1 1 678 678 TRP N N 678 119.189 119.189 117.042 2.147 19514
1452 1 10 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.938 -0.321 19514
1453 1 10 . 1 1 678 678 TRP C C 678 176.898 176.898 178.355 -1.457 19514
1454 1 10 . 1 1 678 678 TRP CA C 678 58.582 58.582 57.453 1.129 19514
1455 1 10 . 1 1 678 678 TRP CB C 678 29.597 29.597 29.394 0.203 19514
1456 1 10 . 1 1 678 678 TRP H H 678 7.795 7.795 7.581 0.214 19514
1457 1 10 . 1 1 679 679 LEU N N 679 117.805 117.805 121.538 -3.733 19514
1458 1 10 . 1 1 679 679 LEU HA H 679 4.023 4.023 3.866 0.157 19514
1459 1 10 . 1 1 679 679 LEU C C 679 177.463 177.463 179.205 -1.742 19514
1460 1 10 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.417 -0.641 19514
1461 1 10 . 1 1 679 679 LEU CB C 679 41.775 41.775 40.906 0.869 19514
1462 1 10 . 1 1 679 679 LEU H H 679 7.753 7.753 8.556 -0.803 19514
1463 1 10 . 1 1 680 680 TRP N N 680 117.351 117.351 119.640 -2.289 19514
1464 1 10 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.305 0.027 19514
1465 1 10 . 1 1 680 680 TRP C C 680 176.369 176.369 177.966 -1.597 19514
1466 1 10 . 1 1 680 680 TRP CA C 680 58.967 58.967 60.034 -1.067 19514
1467 1 10 . 1 1 680 680 TRP CB C 680 29.189 29.189 29.508 -0.319 19514
1468 1 10 . 1 1 680 680 TRP H H 680 7.542 7.542 7.807 -0.265 19514
1469 1 10 . 1 1 681 681 TYR N N 681 116.232 116.232 117.893 -1.661 19514
1470 1 10 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.647 -0.512 19514
1471 1 10 . 1 1 681 681 TYR C C 681 175.623 175.623 175.573 0.050 19514
1472 1 10 . 1 1 681 681 TYR CA C 681 59.749 59.749 59.496 0.253 19514
1473 1 10 . 1 1 681 681 TYR CB C 681 39.096 39.096 39.309 -0.213 19514
1474 1 10 . 1 1 681 681 TYR H H 681 7.453 7.453 7.976 -0.523 19514
1475 1 10 . 1 1 682 682 ILE N N 682 115.034 115.034 115.473 -0.439 19514
1476 1 10 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.837 0.348 19514
1477 1 10 . 1 1 682 682 ILE C C 682 174.299 174.299 175.545 -1.246 19514
1478 1 10 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.372 0.789 19514
1479 1 10 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.208 0.578 19514
1480 1 10 . 1 1 682 682 ILE H H 682 7.477 7.477 7.487 -0.010 19514
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 24 2.316 0.716 2.250 19514
2 1 1 "Average Difference" HA 25 0.379 -0.067 0.380 19514
3 1 1 "Average Difference" C 25 0.964 0.685 0.692 19514
4 1 1 "Average Difference" CA 25 1.244 0.125 1.264 19514
5 1 1 "Average Difference" CB 25 0.781 -0.474 0.633 19514
6 1 1 "Average Difference" HN 24 0.439 0.100 0.437 19514
7 1 2 "Average Difference" N 24 2.174 1.081 1.926 19514
8 1 2 "Average Difference" HA 25 0.490 -0.103 0.489 19514
9 1 2 "Average Difference" C 25 0.856 0.635 0.586 19514
10 1 2 "Average Difference" CA 25 1.161 0.205 1.166 19514
11 1 2 "Average Difference" CB 25 0.849 -0.484 0.712 19514
12 1 2 "Average Difference" HN 24 0.423 0.148 0.405 19514
13 1 3 "Average Difference" N 24 1.925 0.824 1.778 19514
14 1 3 "Average Difference" HA 25 0.241 0.050 0.240 19514
15 1 3 "Average Difference" C 25 0.866 0.630 0.606 19514
16 1 3 "Average Difference" CA 25 0.982 0.307 0.952 19514
17 1 3 "Average Difference" CB 25 0.749 -0.304 0.699 19514
18 1 3 "Average Difference" HN 24 0.336 0.095 0.330 19514
19 1 4 "Average Difference" N 24 1.893 0.895 1.704 19514
20 1 4 "Average Difference" HA 25 0.361 -0.054 0.365 19514
21 1 4 "Average Difference" C 25 0.870 0.642 0.599 19514
22 1 4 "Average Difference" CA 25 0.900 0.254 0.882 19514
23 1 4 "Average Difference" CB 25 0.818 -0.333 0.762 19514
24 1 4 "Average Difference" HN 24 0.334 0.089 0.329 19514
25 1 5 "Average Difference" N 24 2.247 0.569 2.221 19514
26 1 5 "Average Difference" HA 25 0.223 0.046 0.222 19514
27 1 5 "Average Difference" C 25 0.833 0.635 0.550 19514
28 1 5 "Average Difference" CA 25 0.981 0.377 0.925 19514
29 1 5 "Average Difference" CB 25 0.712 -0.280 0.668 19514
30 1 5 "Average Difference" HN 24 0.427 0.111 0.422 19514
31 1 6 "Average Difference" N 24 2.222 1.139 1.949 19514
32 1 6 "Average Difference" HA 25 0.319 -0.067 0.319 19514
33 1 6 "Average Difference" C 25 0.959 0.646 0.724 19514
34 1 6 "Average Difference" CA 25 0.924 0.183 0.924 19514
35 1 6 "Average Difference" CB 25 0.848 -0.479 0.715 19514
36 1 6 "Average Difference" HN 24 0.398 0.051 0.404 19514
37 1 7 "Average Difference" N 24 1.829 0.768 1.695 19514
38 1 7 "Average Difference" HA 25 0.210 0.020 0.213 19514
39 1 7 "Average Difference" C 25 0.691 0.414 0.564 19514
40 1 7 "Average Difference" CA 25 0.874 0.098 0.887 19514
41 1 7 "Average Difference" CB 25 0.646 -0.232 0.615 19514
42 1 7 "Average Difference" HN 24 0.465 0.097 0.465 19514
43 1 8 "Average Difference" N 24 2.156 0.799 2.046 19514
44 1 8 "Average Difference" HA 25 0.223 0.004 0.228 19514
45 1 8 "Average Difference" C 25 0.877 0.611 0.641 19514
46 1 8 "Average Difference" CA 25 1.185 0.185 1.195 19514
47 1 8 "Average Difference" CB 25 0.774 -0.417 0.666 19514
48 1 8 "Average Difference" HN 24 0.428 0.177 0.398 19514
49 1 9 "Average Difference" N 24 1.721 0.600 1.647 19514
50 1 9 "Average Difference" HA 25 0.244 0.017 0.249 19514
51 1 9 "Average Difference" C 25 0.911 0.664 0.637 19514
52 1 9 "Average Difference" CA 25 0.941 0.440 0.849 19514
53 1 9 "Average Difference" CB 25 0.616 -0.218 0.588 19514
54 1 9 "Average Difference" HN 24 0.429 0.123 0.420 19514
55 1 10 "Average Difference" N 24 2.110 0.884 1.957 19514
56 1 10 "Average Difference" HA 25 0.398 -0.033 0.404 19514
57 1 10 "Average Difference" C 25 0.811 0.568 0.590 19514
58 1 10 "Average Difference" CA 25 0.868 0.301 0.831 19514
59 1 10 "Average Difference" CB 25 0.798 -0.397 0.707 19514
60 1 10 "Average Difference" HN 24 0.377 0.102 0.370 19514
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 19514
_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 1 658 658 LYS HA H 658 4.273 4.273 4.375 -0.102 19514
2 1 . 1 1 658 658 LYS C C 658 175.560 175.560 175.304 0.256 19514
3 1 . 1 1 658 658 LYS CA C 658 56.733 56.733 56.277 0.456 19514
4 1 . 1 1 658 658 LYS CB C 658 32.982 32.982 33.047 -0.065 19514
5 1 . 1 1 659 659 ASP N N 659 121.529 121.529 120.359 1.170 19514
6 1 . 1 1 659 659 ASP HA H 659 4.586 4.586 4.605 -0.019 19514
7 1 . 1 1 659 659 ASP C C 659 176.458 176.458 177.793 -1.335 19514
8 1 . 1 1 659 659 ASP CA C 659 54.219 54.219 54.235 -0.015 19514
9 1 . 1 1 659 659 ASP CB C 659 41.324 41.324 41.619 -0.295 19514
10 1 . 1 1 659 659 ASP H H 659 8.329 8.329 8.177 0.152 19514
11 1 . 1 1 660 660 LEU N N 660 123.060 123.060 120.429 2.631 19514
12 1 . 1 1 660 660 LEU HA H 660 4.194 4.194 4.324 -0.130 19514
13 1 . 1 1 660 660 LEU C C 660 177.101 177.101 177.898 -0.797 19514
14 1 . 1 1 660 660 LEU CA C 660 56.564 56.564 56.300 0.264 19514
15 1 . 1 1 660 660 LEU CB C 660 42.489 42.489 42.326 0.162 19514
16 1 . 1 1 660 660 LEU H H 660 8.490 8.490 8.349 0.141 19514
17 1 . 1 1 661 661 LEU N N 661 118.573 118.573 119.213 -0.640 19514
18 1 . 1 1 661 661 LEU HA H 661 4.349 4.349 4.432 -0.083 19514
19 1 . 1 1 661 661 LEU C C 661 176.328 176.328 176.154 0.174 19514
20 1 . 1 1 661 661 LEU CA C 661 54.819 54.819 54.240 0.579 19514
21 1 . 1 1 661 661 LEU CB C 661 41.778 41.778 40.238 1.540 19514
22 1 . 1 1 661 661 LEU H H 661 8.114 8.114 7.988 0.126 19514
23 1 . 1 1 662 662 ALA N N 662 122.836 122.836 122.749 0.087 19514
24 1 . 1 1 662 662 ALA HA H 662 4.405 4.405 4.225 0.180 19514
25 1 . 1 1 662 662 ALA C C 662 177.949 177.949 178.355 -0.406 19514
26 1 . 1 1 662 662 ALA CA C 662 52.137 52.137 52.346 -0.209 19514
27 1 . 1 1 662 662 ALA CB C 662 19.423 19.423 18.614 0.809 19514
28 1 . 1 1 662 662 ALA H H 662 7.849 7.849 7.641 0.208 19514
29 1 . 1 1 663 663 LEU N N 663 121.289 121.289 125.322 -4.033 19514
30 1 . 1 1 663 663 LEU HA H 663 4.185 4.185 3.956 0.229 19514
31 1 . 1 1 663 663 LEU C C 663 177.903 177.903 178.211 -0.308 19514
32 1 . 1 1 663 663 LEU CA C 663 56.657 56.657 57.831 -1.174 19514
33 1 . 1 1 663 663 LEU CB C 663 41.945 41.945 41.523 0.422 19514
34 1 . 1 1 663 663 LEU H H 663 8.302 8.302 8.612 -0.310 19514
35 1 . 1 1 664 664 ASP N N 664 118.100 118.100 118.399 -0.299 19514
36 1 . 1 1 664 664 ASP HA H 664 4.419 4.419 4.509 -0.090 19514
37 1 . 1 1 664 664 ASP C C 664 177.559 177.559 177.959 -0.400 19514
38 1 . 1 1 664 664 ASP CA C 664 56.307 56.307 57.086 -0.779 19514
39 1 . 1 1 664 664 ASP CB C 664 40.890 40.890 40.394 0.496 19514
40 1 . 1 1 664 664 ASP H H 664 8.437 8.437 8.620 -0.183 19514
41 1 . 1 1 665 665 SER N N 665 113.890 113.890 114.096 -0.206 19514
42 1 . 1 1 665 665 SER HA H 665 4.348 4.348 4.458 -0.110 19514
43 1 . 1 1 665 665 SER C C 665 175.610 175.610 176.349 -0.739 19514
44 1 . 1 1 665 665 SER CA C 665 59.988 59.988 59.869 0.119 19514
45 1 . 1 1 665 665 SER CB C 665 63.470 63.470 63.840 -0.370 19514
46 1 . 1 1 665 665 SER H H 665 7.894 7.894 8.139 -0.245 19514
47 1 . 1 1 666 666 TRP N N 666 122.515 122.515 123.627 -1.112 19514
48 1 . 1 1 666 666 TRP HA H 666 4.480 4.480 4.123 0.357 19514
49 1 . 1 1 666 666 TRP C C 666 177.235 177.235 177.441 -0.206 19514
50 1 . 1 1 666 666 TRP CA C 666 59.020 59.020 60.648 -1.628 19514
51 1 . 1 1 666 666 TRP CB C 666 29.438 29.438 29.346 0.092 19514
52 1 . 1 1 666 666 TRP H H 666 8.038 8.038 8.422 -0.384 19514
53 1 . 1 1 667 667 LYS N N 667 118.444 118.444 118.953 -0.509 19514
54 1 . 1 1 667 667 LYS HA H 667 3.917 3.917 3.940 -0.023 19514
55 1 . 1 1 667 667 LYS C C 667 177.985 177.985 178.573 -0.588 19514
56 1 . 1 1 667 667 LYS CA C 667 59.486 59.486 59.832 -0.346 19514
57 1 . 1 1 667 667 LYS CB C 667 32.300 32.300 31.953 0.347 19514
58 1 . 1 1 667 667 LYS H H 667 7.882 7.882 8.214 -0.332 19514
59 1 . 1 1 668 668 ASN N N 668 116.413 116.413 117.417 -1.004 19514
60 1 . 1 1 668 668 ASN HA H 668 4.628 4.628 4.557 0.071 19514
61 1 . 1 1 668 668 ASN C C 668 177.013 177.013 177.360 -0.347 19514
62 1 . 1 1 668 668 ASN CA C 668 55.039 55.039 55.796 -0.757 19514
63 1 . 1 1 668 668 ASN CB C 668 38.297 38.297 38.251 0.046 19514
64 1 . 1 1 668 668 ASN H H 668 8.045 8.045 7.586 0.459 19514
65 1 . 1 1 669 669 LEU N N 669 120.829 120.829 121.549 -0.720 19514
66 1 . 1 1 669 669 LEU HA H 669 4.024 4.024 3.550 0.474 19514
67 1 . 1 1 669 669 LEU C C 669 177.559 177.559 177.990 -0.431 19514
68 1 . 1 1 669 669 LEU CA C 669 57.941 57.941 57.628 0.313 19514
69 1 . 1 1 669 669 LEU CB C 669 42.156 42.156 41.612 0.544 19514
70 1 . 1 1 669 669 LEU H H 669 7.804 7.804 7.615 0.189 19514
71 1 . 1 1 670 670 TRP N N 670 117.321 117.321 117.686 -0.365 19514
72 1 . 1 1 670 670 TRP HA H 670 4.544 4.544 4.463 0.081 19514
73 1 . 1 1 670 670 TRP C C 670 177.194 177.194 177.574 -0.380 19514
74 1 . 1 1 670 670 TRP CA C 670 59.003 59.003 58.740 0.263 19514
75 1 . 1 1 670 670 TRP CB C 670 29.714 29.714 29.613 0.101 19514
76 1 . 1 1 670 670 TRP H H 670 7.887 7.887 7.896 -0.009 19514
77 1 . 1 1 671 671 ASN N N 671 115.549 115.549 115.059 0.490 19514
78 1 . 1 1 671 671 ASN HA H 671 4.550 4.550 4.811 -0.261 19514
79 1 . 1 1 671 671 ASN C C 671 176.520 176.520 176.541 -0.021 19514
80 1 . 1 1 671 671 ASN CA C 671 55.017 55.017 54.934 0.082 19514
81 1 . 1 1 671 671 ASN CB C 671 38.658 38.658 38.891 -0.233 19514
82 1 . 1 1 671 671 ASN H H 671 7.968 7.968 7.877 0.091 19514
83 1 . 1 1 672 672 TRP N N 672 120.350 120.350 120.500 -0.150 19514
84 1 . 1 1 672 672 TRP HA H 672 4.392 4.392 4.271 0.121 19514
85 1 . 1 1 672 672 TRP C C 672 176.592 176.592 177.681 -1.089 19514
86 1 . 1 1 672 672 TRP CA C 672 59.356 59.356 60.544 -1.188 19514
87 1 . 1 1 672 672 TRP CB C 672 29.446 29.446 29.187 0.259 19514
88 1 . 1 1 672 672 TRP H H 672 8.013 8.013 7.598 0.415 19514
89 1 . 1 1 673 673 PHE N N 673 117.559 117.559 116.977 0.582 19514
90 1 . 1 1 673 673 PHE HA H 673 4.259 4.259 4.494 -0.235 19514
91 1 . 1 1 673 673 PHE C C 673 175.068 175.068 176.030 -0.962 19514
92 1 . 1 1 673 673 PHE CA C 673 58.863 58.863 58.692 0.171 19514
93 1 . 1 1 673 673 PHE CB C 673 39.298 39.298 37.523 1.775 19514
94 1 . 1 1 673 673 PHE H H 673 7.881 7.881 7.813 0.068 19514
95 1 . 1 1 674 674 ASN N N 674 118.329 118.329 123.489 -5.159 19514
96 1 . 1 1 674 674 ASN HA H 674 4.569 4.569 4.974 -0.405 19514
97 1 . 1 1 674 674 ASN C C 674 175.956 175.956 176.010 -0.054 19514
98 1 . 1 1 674 674 ASN CA C 674 53.378 53.378 52.267 1.111 19514
99 1 . 1 1 674 674 ASN CB C 674 38.420 38.420 38.018 0.402 19514
100 1 . 1 1 674 674 ASN H H 674 7.750 7.750 8.703 -0.953 19514
101 1 . 1 1 675 675 ILE N N 675 119.444 119.444 121.088 -1.644 19514
102 1 . 1 1 675 675 ILE HA H 675 3.727 3.727 3.158 0.570 19514
103 1 . 1 1 675 675 ILE C C 675 176.638 176.638 177.242 -0.604 19514
104 1 . 1 1 675 675 ILE CA C 675 63.104 63.104 64.248 -1.144 19514
105 1 . 1 1 675 675 ILE CB C 675 38.280 38.280 37.377 0.903 19514
106 1 . 1 1 675 675 ILE H H 675 8.015 8.015 7.856 0.159 19514
107 1 . 1 1 676 676 THR N N 676 114.109 114.109 114.563 -0.454 19514
108 1 . 1 1 676 676 THR HA H 676 3.913 3.913 3.934 -0.021 19514
109 1 . 1 1 676 676 THR C C 676 175.587 175.587 176.210 -0.623 19514
110 1 . 1 1 676 676 THR CA C 676 65.121 65.121 66.201 -1.080 19514
111 1 . 1 1 676 676 THR CB C 676 68.794 68.794 68.355 0.439 19514
112 1 . 1 1 676 676 THR H H 676 7.889 7.889 8.392 -0.503 19514
113 1 . 1 1 677 677 ASN N N 677 118.858 118.858 118.994 -0.136 19514
114 1 . 1 1 677 677 ASN HA H 677 4.580 4.580 4.731 -0.151 19514
115 1 . 1 1 677 677 ASN C C 677 176.077 176.077 177.094 -1.017 19514
116 1 . 1 1 677 677 ASN CA C 677 54.605 54.605 55.636 -1.031 19514
117 1 . 1 1 677 677 ASN CB C 677 38.308 38.308 38.970 -0.662 19514
118 1 . 1 1 677 677 ASN H H 677 7.862 7.862 7.995 -0.133 19514
119 1 . 1 1 678 678 TRP N N 678 119.189 119.189 119.496 -0.307 19514
120 1 . 1 1 678 678 TRP HA H 678 4.617 4.617 4.838 -0.221 19514
121 1 . 1 1 678 678 TRP C C 678 176.898 176.898 178.186 -1.288 19514
122 1 . 1 1 678 678 TRP CA C 678 58.582 58.582 59.428 -0.846 19514
123 1 . 1 1 678 678 TRP CB C 678 29.597 29.597 29.661 -0.064 19514
124 1 . 1 1 678 678 TRP H H 678 7.795 7.795 8.051 -0.256 19514
125 1 . 1 1 679 679 LEU N N 679 117.805 117.805 120.351 -2.546 19514
126 1 . 1 1 679 679 LEU HA H 679 4.023 4.023 4.069 -0.046 19514
127 1 . 1 1 679 679 LEU C C 679 177.463 177.463 178.728 -1.266 19514
128 1 . 1 1 679 679 LEU CA C 679 56.776 56.776 57.168 -0.392 19514
129 1 . 1 1 679 679 LEU CB C 679 41.775 41.775 41.188 0.587 19514
130 1 . 1 1 679 679 LEU H H 679 7.753 7.753 8.248 -0.495 19514
131 1 . 1 1 680 680 TRP N N 680 117.351 117.351 120.821 -3.470 19514
132 1 . 1 1 680 680 TRP HA H 680 4.332 4.332 4.314 0.018 19514
133 1 . 1 1 680 680 TRP C C 680 176.369 176.369 177.211 -0.842 19514
134 1 . 1 1 680 680 TRP CA C 680 58.967 58.967 59.946 -0.979 19514
135 1 . 1 1 680 680 TRP CB C 680 29.189 29.189 28.480 0.709 19514
136 1 . 1 1 680 680 TRP H H 680 7.542 7.542 8.113 -0.571 19514
137 1 . 1 1 681 681 TYR N N 681 116.232 116.232 117.705 -1.473 19514
138 1 . 1 1 681 681 TYR HA H 681 4.135 4.135 4.194 -0.059 19514
139 1 . 1 1 681 681 TYR C C 681 175.623 175.623 175.840 -0.217 19514
140 1 . 1 1 681 681 TYR CA C 681 59.749 59.749 58.015 1.734 19514
141 1 . 1 1 681 681 TYR CB C 681 39.096 39.096 38.468 0.628 19514
142 1 . 1 1 681 681 TYR H H 681 7.453 7.453 7.548 -0.096 19514
143 1 . 1 1 682 682 ILE N N 682 115.034 115.034 115.627 -0.593 19514
144 1 . 1 1 682 682 ILE HA H 682 4.185 4.185 3.863 0.322 19514
145 1 . 1 1 682 682 ILE C C 682 174.299 174.299 176.137 -1.838 19514
146 1 . 1 1 682 682 ILE CA C 682 61.161 61.161 60.871 0.289 19514
147 1 . 1 1 682 682 ILE CB C 682 38.786 38.786 38.314 0.472 19514
148 1 . 1 1 682 682 ILE H H 682 7.477 7.477 7.636 -0.159 19514
stop_
save_