data_19515
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19515
_Entry.PDB_ID 2ME4
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 19515
_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 4.292 4.292 4.234 0.058 19515
2 1 1 . 1 1 658 658 LYS C C 658 175.668 175.668 175.814 -0.146 19515
3 1 1 . 1 1 658 658 LYS CA C 658 56.747 56.747 56.530 0.217 19515
4 1 1 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.505 0.363 19515
5 1 1 . 1 1 659 659 ASP N N 659 120.320 120.320 124.429 -4.109 19515
6 1 1 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.857 -0.274 19515
7 1 1 . 1 1 659 659 ASP C C 659 176.214 176.214 176.722 -0.508 19515
8 1 1 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.601 0.741 19515
9 1 1 . 1 1 659 659 ASP CB C 659 41.140 41.140 42.613 -1.473 19515
10 1 1 . 1 1 659 659 ASP H H 659 8.360 8.360 8.465 -0.105 19515
11 1 1 . 1 1 660 660 LEU N N 660 121.445 121.445 124.299 -2.854 19515
12 1 1 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.345 -0.124 19515
13 1 1 . 1 1 660 660 LEU C C 660 177.071 177.071 178.164 -1.093 19515
14 1 1 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.409 -0.092 19515
15 1 1 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.507 -0.009 19515
16 1 1 . 1 1 660 660 LEU H H 660 8.388 8.388 8.930 -0.542 19515
17 1 1 . 1 1 661 661 LEU N N 661 118.164 118.164 118.995 -0.831 19515
18 1 1 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.589 -0.268 19515
19 1 1 . 1 1 661 661 LEU C C 661 176.473 176.473 176.314 0.159 19515
20 1 1 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.049 0.742 19515
21 1 1 . 1 1 661 661 LEU CB C 661 42.060 42.060 41.956 0.104 19515
22 1 1 . 1 1 661 661 LEU H H 661 8.114 8.114 8.032 0.082 19515
23 1 1 . 1 1 662 662 ALA N N 662 122.289 122.289 123.149 -0.860 19515
24 1 1 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.285 0.051 19515
25 1 1 . 1 1 662 662 ALA C C 662 177.849 177.849 178.930 -1.081 19515
26 1 1 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.715 -0.199 19515
27 1 1 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.741 1.472 19515
28 1 1 . 1 1 662 662 ALA H H 662 7.936 7.936 7.386 0.550 19515
29 1 1 . 1 1 663 663 LEU N N 663 119.570 119.570 126.395 -6.825 19515
30 1 1 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.144 0.056 19515
31 1 1 . 1 1 663 663 LEU C C 663 177.653 177.653 178.550 -0.897 19515
32 1 1 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.838 -1.322 19515
33 1 1 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.944 0.088 19515
34 1 1 . 1 1 663 663 LEU H H 663 8.210 8.210 8.384 -0.174 19515
35 1 1 . 1 1 664 664 ASP N N 664 117.320 117.320 117.315 0.005 19515
36 1 1 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.493 0.012 19515
37 1 1 . 1 1 664 664 ASP C C 664 177.568 177.568 177.545 0.023 19515
38 1 1 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.761 -1.082 19515
39 1 1 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.713 -0.245 19515
40 1 1 . 1 1 664 664 ASP H H 664 8.360 8.360 8.717 -0.357 19515
41 1 1 . 1 1 665 665 LYS N N 665 118.403 118.403 117.233 1.170 19515
42 1 1 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.424 -0.236 19515
43 1 1 . 1 1 665 665 LYS C C 665 177.428 177.428 178.430 -1.002 19515
44 1 1 . 1 1 665 665 LYS CA C 665 57.552 57.552 57.572 -0.020 19515
45 1 1 . 1 1 665 665 LYS CB C 665 32.253 32.253 32.972 -0.719 19515
46 1 1 . 1 1 665 665 LYS H H 665 7.957 7.957 8.296 -0.339 19515
47 1 1 . 1 1 666 666 TRP N N 666 119.008 119.008 121.038 -2.030 19515
48 1 1 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.452 0.066 19515
49 1 1 . 1 1 666 666 TRP C C 666 176.614 176.614 177.959 -1.345 19515
50 1 1 . 1 1 666 666 TRP CA C 666 58.613 58.613 60.635 -2.022 19515
51 1 1 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.399 -0.011 19515
52 1 1 . 1 1 666 666 TRP H H 666 8.018 8.018 7.480 0.538 19515
53 1 1 . 1 1 667 667 ASN N N 667 115.789 115.789 117.885 -2.096 19515
54 1 1 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.605 -0.200 19515
55 1 1 . 1 1 667 667 ASN C C 667 177.139 177.139 177.737 -0.598 19515
56 1 1 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.756 -1.118 19515
57 1 1 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.507 0.052 19515
58 1 1 . 1 1 667 667 ASN H H 667 8.177 8.177 8.128 0.049 19515
59 1 1 . 1 1 668 668 SER N N 668 114.122 114.122 115.242 -1.120 19515
60 1 1 . 1 1 668 668 SER HA H 668 4.339 4.339 4.440 -0.101 19515
61 1 1 . 1 1 668 668 SER C C 668 175.509 175.509 176.300 -0.791 19515
62 1 1 . 1 1 668 668 SER CA C 668 60.480 60.480 61.368 -0.888 19515
63 1 1 . 1 1 668 668 SER CB C 668 63.178 63.178 63.437 -0.259 19515
64 1 1 . 1 1 668 668 SER H H 668 8.113 8.113 7.711 0.402 19515
65 1 1 . 1 1 669 669 LEU N N 669 121.445 121.445 121.755 -0.310 19515
66 1 1 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.907 0.072 19515
67 1 1 . 1 1 669 669 LEU C C 669 177.357 177.357 177.409 -0.052 19515
68 1 1 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.461 0.047 19515
69 1 1 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.004 -0.018 19515
70 1 1 . 1 1 669 669 LEU H H 669 7.813 7.813 8.010 -0.197 19515
71 1 1 . 1 1 670 670 TRP N N 670 115.164 115.164 118.441 -3.277 19515
72 1 1 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.439 0.202 19515
73 1 1 . 1 1 670 670 TRP C C 670 177.139 177.139 177.676 -0.537 19515
74 1 1 . 1 1 670 670 TRP CA C 670 58.242 58.242 59.107 -0.865 19515
75 1 1 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.656 -0.125 19515
76 1 1 . 1 1 670 670 TRP H H 670 7.554 7.554 8.009 -0.455 19515
77 1 1 . 1 1 671 671 SER N N 671 111.992 111.992 114.941 -2.949 19515
78 1 1 . 1 1 671 671 SER HA H 671 4.396 4.396 4.511 -0.115 19515
79 1 1 . 1 1 671 671 SER C C 671 175.159 175.159 175.524 -0.365 19515
80 1 1 . 1 1 671 671 SER CA C 671 60.034 60.034 60.639 -0.605 19515
81 1 1 . 1 1 671 671 SER CB C 671 63.623 63.623 63.945 -0.322 19515
82 1 1 . 1 1 671 671 SER H H 671 7.988 7.988 7.766 0.222 19515
83 1 1 . 1 1 672 672 TRP N N 672 120.173 120.173 118.569 1.604 19515
84 1 1 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.826 -0.301 19515
85 1 1 . 1 1 672 672 TRP C C 672 176.153 176.153 176.255 -0.102 19515
86 1 1 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.161 2.476 19515
87 1 1 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.297 0.365 19515
88 1 1 . 1 1 672 672 TRP H H 672 7.872 7.872 6.973 0.899 19515
89 1 1 . 1 1 673 673 PHE N N 673 117.414 117.414 120.922 -3.508 19515
90 1 1 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.489 -0.111 19515
91 1 1 . 1 1 673 673 PHE C C 673 174.357 174.357 174.608 -0.251 19515
92 1 1 . 1 1 673 673 PHE CA C 673 58.139 58.139 57.142 0.998 19515
93 1 1 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.641 0.743 19515
94 1 1 . 1 1 673 673 PHE H H 673 7.783 7.783 7.101 0.682 19515
95 1 1 . 1 1 674 674 ASP N N 674 120.414 120.414 122.436 -2.022 19515
96 1 1 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.978 -0.346 19515
97 1 1 . 1 1 674 674 ASP C C 674 176.749 176.749 176.720 0.029 19515
98 1 1 . 1 1 674 674 ASP CA C 674 53.569 53.569 54.043 -0.474 19515
99 1 1 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.936 -0.281 19515
100 1 1 . 1 1 674 674 ASP H H 674 7.725 7.725 7.559 0.166 19515
101 1 1 . 1 1 675 675 ILE N N 675 120.320 120.320 126.220 -5.900 19515
102 1 1 . 1 1 675 675 ILE HA H 675 3.791 3.791 4.066 -0.275 19515
103 1 1 . 1 1 675 675 ILE C C 675 176.683 176.683 178.104 -1.421 19515
104 1 1 . 1 1 675 675 ILE CA C 675 63.208 63.208 60.681 2.527 19515
105 1 1 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.431 0.905 19515
106 1 1 . 1 1 675 675 ILE H H 675 8.196 8.196 8.589 -0.393 19515
107 1 1 . 1 1 676 676 THR N N 676 111.977 111.977 117.001 -5.024 19515
108 1 1 . 1 1 676 676 THR HA H 676 3.903 3.903 4.028 -0.125 19515
109 1 1 . 1 1 676 676 THR C C 676 176.347 176.347 176.396 -0.049 19515
110 1 1 . 1 1 676 676 THR CA C 676 65.643 65.643 66.921 -1.278 19515
111 1 1 . 1 1 676 676 THR CB C 676 68.453 68.453 68.680 -0.226 19515
112 1 1 . 1 1 676 676 THR H H 676 8.114 8.114 8.388 -0.274 19515
113 1 1 . 1 1 677 677 LYS N N 677 119.101 119.101 120.062 -0.961 19515
114 1 1 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.196 -0.181 19515
115 1 1 . 1 1 677 677 LYS C C 677 177.394 177.394 178.811 -1.417 19515
116 1 1 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.363 -1.220 19515
117 1 1 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.185 -0.060 19515
118 1 1 . 1 1 677 677 LYS H H 677 7.512 7.512 8.285 -0.773 19515
119 1 1 . 1 1 678 678 TRP N N 678 116.945 116.945 119.641 -2.696 19515
120 1 1 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.627 0.058 19515
121 1 1 . 1 1 678 678 TRP C C 678 176.964 176.964 179.009 -2.045 19515
122 1 1 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.443 -2.185 19515
123 1 1 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.181 -0.362 19515
124 1 1 . 1 1 678 678 TRP H H 678 7.525 7.525 8.453 -0.928 19515
125 1 1 . 1 1 679 679 LEU N N 679 116.664 116.664 119.928 -3.264 19515
126 1 1 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.214 -0.132 19515
127 1 1 . 1 1 679 679 LEU C C 679 177.458 177.458 178.993 -1.535 19515
128 1 1 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.795 -0.956 19515
129 1 1 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.326 0.586 19515
130 1 1 . 1 1 679 679 LEU H H 679 7.786 7.786 8.578 -0.792 19515
131 1 1 . 1 1 680 680 TRP N N 680 116.195 116.195 121.072 -4.877 19515
132 1 1 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.488 -0.131 19515
133 1 1 . 1 1 680 680 TRP C C 680 176.394 176.394 178.078 -1.684 19515
134 1 1 . 1 1 680 680 TRP CA C 680 58.948 58.948 60.913 -1.965 19515
135 1 1 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.619 -0.483 19515
136 1 1 . 1 1 680 680 TRP H H 680 7.547 7.547 8.960 -1.413 19515
137 1 1 . 1 1 681 681 TYR N N 681 115.352 115.352 118.097 -2.745 19515
138 1 1 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.431 -0.281 19515
139 1 1 . 1 1 681 681 TYR C C 681 175.671 175.671 176.782 -1.111 19515
140 1 1 . 1 1 681 681 TYR CA C 681 59.780 59.780 60.993 -1.213 19515
141 1 1 . 1 1 681 681 TYR CB C 681 39.011 39.011 39.021 -0.010 19515
142 1 1 . 1 1 681 681 TYR H H 681 7.471 7.471 7.964 -0.493 19515
143 1 1 . 1 1 682 682 ILE N N 682 113.570 113.570 116.512 -2.942 19515
144 1 1 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.300 -0.089 19515
145 1 1 . 1 1 682 682 ILE C C 682 174.166 174.166 176.783 -2.617 19515
146 1 1 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.488 -0.324 19515
147 1 1 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.291 0.578 19515
148 1 1 . 1 1 682 682 ILE H H 682 7.471 7.471 7.583 -0.112 19515
149 1 2 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.593 -0.301 19515
150 1 2 . 1 1 658 658 LYS C C 658 175.668 175.668 174.921 0.747 19515
151 1 2 . 1 1 658 658 LYS CA C 658 56.747 56.747 55.887 0.860 19515
152 1 2 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.426 0.442 19515
153 1 2 . 1 1 659 659 ASP N N 659 120.320 120.320 121.619 -1.299 19515
154 1 2 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.837 -0.254 19515
155 1 2 . 1 1 659 659 ASP C C 659 176.214 176.214 177.863 -1.649 19515
156 1 2 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.263 1.079 19515
157 1 2 . 1 1 659 659 ASP CB C 659 41.140 41.140 42.902 -1.762 19515
158 1 2 . 1 1 659 659 ASP H H 659 8.360 8.360 8.468 -0.108 19515
159 1 2 . 1 1 660 660 LEU N N 660 121.445 121.445 122.645 -1.200 19515
160 1 2 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.140 0.081 19515
161 1 2 . 1 1 660 660 LEU C C 660 177.071 177.071 177.839 -0.768 19515
162 1 2 . 1 1 660 660 LEU CA C 660 56.317 56.317 57.105 -0.788 19515
163 1 2 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.339 0.159 19515
164 1 2 . 1 1 660 660 LEU H H 660 8.388 8.388 8.806 -0.418 19515
165 1 2 . 1 1 661 661 LEU N N 661 118.164 118.164 118.155 0.009 19515
166 1 2 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.631 -0.310 19515
167 1 2 . 1 1 661 661 LEU C C 661 176.473 176.473 176.319 0.154 19515
168 1 2 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.038 0.753 19515
169 1 2 . 1 1 661 661 LEU CB C 661 42.060 42.060 41.963 0.097 19515
170 1 2 . 1 1 661 661 LEU H H 661 8.114 8.114 7.969 0.145 19515
171 1 2 . 1 1 662 662 ALA N N 662 122.289 122.289 123.285 -0.996 19515
172 1 2 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.263 0.073 19515
173 1 2 . 1 1 662 662 ALA C C 662 177.849 177.849 178.372 -0.523 19515
174 1 2 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.400 0.116 19515
175 1 2 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.772 1.441 19515
176 1 2 . 1 1 662 662 ALA H H 662 7.936 7.936 8.093 -0.157 19515
177 1 2 . 1 1 663 663 LEU N N 663 119.570 119.570 126.604 -7.034 19515
178 1 2 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.141 0.059 19515
179 1 2 . 1 1 663 663 LEU C C 663 177.653 177.653 178.273 -0.620 19515
180 1 2 . 1 1 663 663 LEU CA C 663 56.516 56.516 58.126 -1.610 19515
181 1 2 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.637 0.395 19515
182 1 2 . 1 1 663 663 LEU H H 663 8.210 8.210 8.437 -0.227 19515
183 1 2 . 1 1 664 664 ASP N N 664 117.320 117.320 118.183 -0.863 19515
184 1 2 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.517 -0.012 19515
185 1 2 . 1 1 664 664 ASP C C 664 177.568 177.568 177.948 -0.380 19515
186 1 2 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.765 -1.086 19515
187 1 2 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.209 0.259 19515
188 1 2 . 1 1 664 664 ASP H H 664 8.360 8.360 8.591 -0.231 19515
189 1 2 . 1 1 665 665 LYS N N 665 118.403 118.403 117.277 1.126 19515
190 1 2 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.499 -0.311 19515
191 1 2 . 1 1 665 665 LYS C C 665 177.428 177.428 178.726 -1.298 19515
192 1 2 . 1 1 665 665 LYS CA C 665 57.552 57.552 56.358 1.194 19515
193 1 2 . 1 1 665 665 LYS CB C 665 32.253 32.253 33.339 -1.085 19515
194 1 2 . 1 1 665 665 LYS H H 665 7.957 7.957 8.338 -0.381 19515
195 1 2 . 1 1 666 666 TRP N N 666 119.008 119.008 121.970 -2.962 19515
196 1 2 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.485 0.033 19515
197 1 2 . 1 1 666 666 TRP C C 666 176.614 176.614 177.783 -1.169 19515
198 1 2 . 1 1 666 666 TRP CA C 666 58.613 58.613 60.428 -1.815 19515
199 1 2 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.437 -0.049 19515
200 1 2 . 1 1 666 666 TRP H H 666 8.018 8.018 7.442 0.576 19515
201 1 2 . 1 1 667 667 ASN N N 667 115.789 115.789 118.001 -2.212 19515
202 1 2 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.578 -0.173 19515
203 1 2 . 1 1 667 667 ASN C C 667 177.139 177.139 177.553 -0.414 19515
204 1 2 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.618 -0.980 19515
205 1 2 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.431 0.128 19515
206 1 2 . 1 1 667 667 ASN H H 667 8.177 8.177 8.008 0.169 19515
207 1 2 . 1 1 668 668 SER N N 668 114.122 114.122 115.083 -0.961 19515
208 1 2 . 1 1 668 668 SER HA H 668 4.339 4.339 4.436 -0.097 19515
209 1 2 . 1 1 668 668 SER C C 668 175.509 175.509 176.302 -0.793 19515
210 1 2 . 1 1 668 668 SER CA C 668 60.480 60.480 61.014 -0.534 19515
211 1 2 . 1 1 668 668 SER CB C 668 63.178 63.178 63.363 -0.185 19515
212 1 2 . 1 1 668 668 SER H H 668 8.113 8.113 7.601 0.512 19515
213 1 2 . 1 1 669 669 LEU N N 669 121.445 121.445 120.678 0.767 19515
214 1 2 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.859 0.120 19515
215 1 2 . 1 1 669 669 LEU C C 669 177.357 177.357 177.685 -0.328 19515
216 1 2 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.380 0.127 19515
217 1 2 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.039 -0.053 19515
218 1 2 . 1 1 669 669 LEU H H 669 7.813 7.813 7.999 -0.186 19515
219 1 2 . 1 1 670 670 TRP N N 670 115.164 115.164 118.165 -3.001 19515
220 1 2 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.458 0.183 19515
221 1 2 . 1 1 670 670 TRP C C 670 177.139 177.139 177.654 -0.515 19515
222 1 2 . 1 1 670 670 TRP CA C 670 58.242 58.242 59.316 -1.074 19515
223 1 2 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.656 -0.125 19515
224 1 2 . 1 1 670 670 TRP H H 670 7.554 7.554 7.834 -0.280 19515
225 1 2 . 1 1 671 671 SER N N 671 111.992 111.992 115.005 -3.013 19515
226 1 2 . 1 1 671 671 SER HA H 671 4.396 4.396 4.539 -0.143 19515
227 1 2 . 1 1 671 671 SER C C 671 175.159 175.159 175.525 -0.366 19515
228 1 2 . 1 1 671 671 SER CA C 671 60.034 60.034 60.996 -0.962 19515
229 1 2 . 1 1 671 671 SER CB C 671 63.623 63.623 63.759 -0.136 19515
230 1 2 . 1 1 671 671 SER H H 671 7.988 7.988 7.822 0.166 19515
231 1 2 . 1 1 672 672 TRP N N 672 120.173 120.173 118.145 2.028 19515
232 1 2 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.859 -0.334 19515
233 1 2 . 1 1 672 672 TRP C C 672 176.153 176.153 176.283 -0.130 19515
234 1 2 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.239 2.398 19515
235 1 2 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.333 0.330 19515
236 1 2 . 1 1 672 672 TRP H H 672 7.872 7.872 6.934 0.938 19515
237 1 2 . 1 1 673 673 PHE N N 673 117.414 117.414 120.869 -3.455 19515
238 1 2 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.478 -0.100 19515
239 1 2 . 1 1 673 673 PHE C C 673 174.357 174.357 174.689 -0.332 19515
240 1 2 . 1 1 673 673 PHE CA C 673 58.139 58.139 57.297 0.841 19515
241 1 2 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.744 0.640 19515
242 1 2 . 1 1 673 673 PHE H H 673 7.783 7.783 7.049 0.734 19515
243 1 2 . 1 1 674 674 ASP N N 674 120.414 120.414 121.927 -1.513 19515
244 1 2 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.861 -0.229 19515
245 1 2 . 1 1 674 674 ASP C C 674 176.749 176.749 176.014 0.735 19515
246 1 2 . 1 1 674 674 ASP CA C 674 53.569 53.569 53.350 0.219 19515
247 1 2 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.686 -0.031 19515
248 1 2 . 1 1 674 674 ASP H H 674 7.725 7.725 7.519 0.206 19515
249 1 2 . 1 1 675 675 ILE N N 675 120.320 120.320 124.736 -4.416 19515
250 1 2 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.914 -0.123 19515
251 1 2 . 1 1 675 675 ILE C C 675 176.683 176.683 177.927 -1.244 19515
252 1 2 . 1 1 675 675 ILE CA C 675 63.208 63.208 61.482 1.726 19515
253 1 2 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.422 0.914 19515
254 1 2 . 1 1 675 675 ILE H H 675 8.196 8.196 8.209 -0.013 19515
255 1 2 . 1 1 676 676 THR N N 676 111.977 111.977 114.407 -2.430 19515
256 1 2 . 1 1 676 676 THR HA H 676 3.903 3.903 3.986 -0.083 19515
257 1 2 . 1 1 676 676 THR C C 676 176.347 176.347 176.777 -0.430 19515
258 1 2 . 1 1 676 676 THR CA C 676 65.643 65.643 65.961 -0.318 19515
259 1 2 . 1 1 676 676 THR CB C 676 68.453 68.453 68.406 0.047 19515
260 1 2 . 1 1 676 676 THR H H 676 8.114 8.114 8.196 -0.082 19515
261 1 2 . 1 1 677 677 LYS N N 677 119.101 119.101 120.850 -1.749 19515
262 1 2 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.135 -0.120 19515
263 1 2 . 1 1 677 677 LYS C C 677 177.394 177.394 178.885 -1.491 19515
264 1 2 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.353 -1.210 19515
265 1 2 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.332 -0.207 19515
266 1 2 . 1 1 677 677 LYS H H 677 7.512 7.512 7.819 -0.307 19515
267 1 2 . 1 1 678 678 TRP N N 678 116.945 116.945 119.670 -2.725 19515
268 1 2 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.680 0.005 19515
269 1 2 . 1 1 678 678 TRP C C 678 176.964 176.964 179.002 -2.038 19515
270 1 2 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.466 -2.208 19515
271 1 2 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.161 -0.342 19515
272 1 2 . 1 1 678 678 TRP H H 678 7.525 7.525 8.441 -0.916 19515
273 1 2 . 1 1 679 679 LEU N N 679 116.664 116.664 119.873 -3.209 19515
274 1 2 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.190 -0.108 19515
275 1 2 . 1 1 679 679 LEU C C 679 177.458 177.458 178.971 -1.513 19515
276 1 2 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.811 -0.972 19515
277 1 2 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.302 0.610 19515
278 1 2 . 1 1 679 679 LEU H H 679 7.786 7.786 8.524 -0.738 19515
279 1 2 . 1 1 680 680 TRP N N 680 116.195 116.195 120.765 -4.570 19515
280 1 2 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.481 -0.124 19515
281 1 2 . 1 1 680 680 TRP C C 680 176.394 176.394 178.032 -1.638 19515
282 1 2 . 1 1 680 680 TRP CA C 680 58.948 58.948 60.682 -1.734 19515
283 1 2 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.522 -0.387 19515
284 1 2 . 1 1 680 680 TRP H H 680 7.547 7.547 8.785 -1.238 19515
285 1 2 . 1 1 681 681 TYR N N 681 115.352 115.352 118.068 -2.716 19515
286 1 2 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.450 -0.300 19515
287 1 2 . 1 1 681 681 TYR C C 681 175.671 175.671 176.753 -1.082 19515
288 1 2 . 1 1 681 681 TYR CA C 681 59.780 59.780 61.089 -1.309 19515
289 1 2 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.915 0.096 19515
290 1 2 . 1 1 681 681 TYR H H 681 7.471 7.471 7.879 -0.408 19515
291 1 2 . 1 1 682 682 ILE N N 682 113.570 113.570 116.795 -3.225 19515
292 1 2 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.272 -0.061 19515
293 1 2 . 1 1 682 682 ILE C C 682 174.166 174.166 176.660 -2.494 19515
294 1 2 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.604 -0.440 19515
295 1 2 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.159 0.710 19515
296 1 2 . 1 1 682 682 ILE H H 682 7.471 7.471 7.473 -0.002 19515
297 1 3 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.529 -0.237 19515
298 1 3 . 1 1 658 658 LYS C C 658 175.668 175.668 175.374 0.294 19515
299 1 3 . 1 1 658 658 LYS CA C 658 56.747 56.747 55.790 0.957 19515
300 1 3 . 1 1 658 658 LYS CB C 658 32.868 32.868 33.306 -0.438 19515
301 1 3 . 1 1 659 659 ASP N N 659 120.320 120.320 121.101 -0.781 19515
302 1 3 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.837 -0.254 19515
303 1 3 . 1 1 659 659 ASP C C 659 176.214 176.214 176.785 -0.571 19515
304 1 3 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.636 0.706 19515
305 1 3 . 1 1 659 659 ASP CB C 659 41.140 41.140 41.893 -0.753 19515
306 1 3 . 1 1 659 659 ASP H H 659 8.360 8.360 8.543 -0.183 19515
307 1 3 . 1 1 660 660 LEU N N 660 121.445 121.445 124.289 -2.844 19515
308 1 3 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.393 -0.172 19515
309 1 3 . 1 1 660 660 LEU C C 660 177.071 177.071 178.258 -1.187 19515
310 1 3 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.346 -0.029 19515
311 1 3 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.571 -0.073 19515
312 1 3 . 1 1 660 660 LEU H H 660 8.388 8.388 8.914 -0.526 19515
313 1 3 . 1 1 661 661 LEU N N 661 118.164 118.164 119.115 -0.951 19515
314 1 3 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.598 -0.277 19515
315 1 3 . 1 1 661 661 LEU C C 661 176.473 176.473 176.394 0.079 19515
316 1 3 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.119 0.672 19515
317 1 3 . 1 1 661 661 LEU CB C 661 42.060 42.060 41.950 0.110 19515
318 1 3 . 1 1 661 661 LEU H H 661 8.114 8.114 8.016 0.098 19515
319 1 3 . 1 1 662 662 ALA N N 662 122.289 122.289 122.846 -0.557 19515
320 1 3 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.243 0.093 19515
321 1 3 . 1 1 662 662 ALA C C 662 177.849 177.849 178.558 -0.709 19515
322 1 3 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.487 0.029 19515
323 1 3 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.626 1.587 19515
324 1 3 . 1 1 662 662 ALA H H 662 7.936 7.936 7.471 0.465 19515
325 1 3 . 1 1 663 663 LEU N N 663 119.570 119.570 126.519 -6.949 19515
326 1 3 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.173 0.027 19515
327 1 3 . 1 1 663 663 LEU C C 663 177.653 177.653 178.078 -0.425 19515
328 1 3 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.888 -1.372 19515
329 1 3 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.800 0.232 19515
330 1 3 . 1 1 663 663 LEU H H 663 8.210 8.210 8.466 -0.256 19515
331 1 3 . 1 1 664 664 ASP N N 664 117.320 117.320 118.311 -0.991 19515
332 1 3 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.510 -0.005 19515
333 1 3 . 1 1 664 664 ASP C C 664 177.568 177.568 178.022 -0.454 19515
334 1 3 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.803 -1.124 19515
335 1 3 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.121 0.346 19515
336 1 3 . 1 1 664 664 ASP H H 664 8.360 8.360 8.604 -0.244 19515
337 1 3 . 1 1 665 665 LYS N N 665 118.403 118.403 117.260 1.143 19515
338 1 3 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.509 -0.321 19515
339 1 3 . 1 1 665 665 LYS C C 665 177.428 177.428 178.656 -1.228 19515
340 1 3 . 1 1 665 665 LYS CA C 665 57.552 57.552 55.976 1.576 19515
341 1 3 . 1 1 665 665 LYS CB C 665 32.253 32.253 33.290 -1.037 19515
342 1 3 . 1 1 665 665 LYS H H 665 7.957 7.957 8.327 -0.370 19515
343 1 3 . 1 1 666 666 TRP N N 666 119.008 119.008 121.867 -2.859 19515
344 1 3 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.441 0.077 19515
345 1 3 . 1 1 666 666 TRP C C 666 176.614 176.614 177.918 -1.304 19515
346 1 3 . 1 1 666 666 TRP CA C 666 58.613 58.613 60.615 -2.002 19515
347 1 3 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.493 -0.105 19515
348 1 3 . 1 1 666 666 TRP H H 666 8.018 8.018 7.458 0.560 19515
349 1 3 . 1 1 667 667 ASN N N 667 115.789 115.789 118.329 -2.540 19515
350 1 3 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.617 -0.212 19515
351 1 3 . 1 1 667 667 ASN C C 667 177.139 177.139 176.915 0.224 19515
352 1 3 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.940 -1.302 19515
353 1 3 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.701 -0.142 19515
354 1 3 . 1 1 667 667 ASN H H 667 8.177 8.177 8.108 0.069 19515
355 1 3 . 1 1 668 668 SER N N 668 114.122 114.122 114.852 -0.730 19515
356 1 3 . 1 1 668 668 SER HA H 668 4.339 4.339 4.429 -0.090 19515
357 1 3 . 1 1 668 668 SER C C 668 175.509 175.509 176.304 -0.795 19515
358 1 3 . 1 1 668 668 SER CA C 668 60.480 60.480 60.708 -0.228 19515
359 1 3 . 1 1 668 668 SER CB C 668 63.178 63.178 63.430 -0.252 19515
360 1 3 . 1 1 668 668 SER H H 668 8.113 8.113 7.598 0.515 19515
361 1 3 . 1 1 669 669 LEU N N 669 121.445 121.445 121.142 0.303 19515
362 1 3 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.890 0.089 19515
363 1 3 . 1 1 669 669 LEU C C 669 177.357 177.357 177.862 -0.505 19515
364 1 3 . 1 1 669 669 LEU CA C 669 57.507 57.507 56.929 0.578 19515
365 1 3 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.020 -0.034 19515
366 1 3 . 1 1 669 669 LEU H H 669 7.813 7.813 7.876 -0.063 19515
367 1 3 . 1 1 670 670 TRP N N 670 115.164 115.164 115.988 -0.824 19515
368 1 3 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.430 0.211 19515
369 1 3 . 1 1 670 670 TRP C C 670 177.139 177.139 176.833 0.306 19515
370 1 3 . 1 1 670 670 TRP CA C 670 58.242 58.242 58.131 0.111 19515
371 1 3 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.540 -0.009 19515
372 1 3 . 1 1 670 670 TRP H H 670 7.554 7.554 7.451 0.103 19515
373 1 3 . 1 1 671 671 SER N N 671 111.992 111.992 112.398 -0.406 19515
374 1 3 . 1 1 671 671 SER HA H 671 4.396 4.396 4.508 -0.112 19515
375 1 3 . 1 1 671 671 SER C C 671 175.159 175.159 175.464 -0.305 19515
376 1 3 . 1 1 671 671 SER CA C 671 60.034 60.034 60.413 -0.378 19515
377 1 3 . 1 1 671 671 SER CB C 671 63.623 63.623 63.429 0.194 19515
378 1 3 . 1 1 671 671 SER H H 671 7.988 7.988 7.666 0.322 19515
379 1 3 . 1 1 672 672 TRP N N 672 120.173 120.173 117.852 2.321 19515
380 1 3 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.948 -0.423 19515
381 1 3 . 1 1 672 672 TRP C C 672 176.153 176.153 176.717 -0.564 19515
382 1 3 . 1 1 672 672 TRP CA C 672 58.637 58.637 57.496 1.141 19515
383 1 3 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.720 -0.057 19515
384 1 3 . 1 1 672 672 TRP H H 672 7.872 7.872 7.096 0.776 19515
385 1 3 . 1 1 673 673 PHE N N 673 117.414 117.414 121.752 -4.338 19515
386 1 3 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.586 -0.208 19515
387 1 3 . 1 1 673 673 PHE C C 673 174.357 174.357 174.258 0.099 19515
388 1 3 . 1 1 673 673 PHE CA C 673 58.139 58.139 56.318 1.821 19515
389 1 3 . 1 1 673 673 PHE CB C 673 39.384 39.384 37.870 1.514 19515
390 1 3 . 1 1 673 673 PHE H H 673 7.783 7.783 6.769 1.014 19515
391 1 3 . 1 1 674 674 ASP N N 674 120.414 120.414 122.060 -1.646 19515
392 1 3 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.919 -0.287 19515
393 1 3 . 1 1 674 674 ASP C C 674 176.749 176.749 176.941 -0.192 19515
394 1 3 . 1 1 674 674 ASP CA C 674 53.569 53.569 54.467 -0.898 19515
395 1 3 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.840 -0.186 19515
396 1 3 . 1 1 674 674 ASP H H 674 7.725 7.725 7.533 0.192 19515
397 1 3 . 1 1 675 675 ILE N N 675 120.320 120.320 126.161 -5.841 19515
398 1 3 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.866 -0.075 19515
399 1 3 . 1 1 675 675 ILE C C 675 176.683 176.683 177.673 -0.990 19515
400 1 3 . 1 1 675 675 ILE CA C 675 63.208 63.208 61.778 1.430 19515
401 1 3 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.322 1.014 19515
402 1 3 . 1 1 675 675 ILE H H 675 8.196 8.196 8.289 -0.093 19515
403 1 3 . 1 1 676 676 THR N N 676 111.977 111.977 113.274 -1.297 19515
404 1 3 . 1 1 676 676 THR HA H 676 3.903 3.903 4.024 -0.121 19515
405 1 3 . 1 1 676 676 THR C C 676 176.347 176.347 176.668 -0.321 19515
406 1 3 . 1 1 676 676 THR CA C 676 65.643 65.643 65.879 -0.236 19515
407 1 3 . 1 1 676 676 THR CB C 676 68.453 68.453 68.455 -0.002 19515
408 1 3 . 1 1 676 676 THR H H 676 8.114 8.114 8.323 -0.209 19515
409 1 3 . 1 1 677 677 LYS N N 677 119.101 119.101 120.945 -1.844 19515
410 1 3 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.155 -0.140 19515
411 1 3 . 1 1 677 677 LYS C C 677 177.394 177.394 178.476 -1.082 19515
412 1 3 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.184 -1.041 19515
413 1 3 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.109 0.016 19515
414 1 3 . 1 1 677 677 LYS H H 677 7.512 7.512 8.051 -0.539 19515
415 1 3 . 1 1 678 678 TRP N N 678 116.945 116.945 119.592 -2.647 19515
416 1 3 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.551 0.134 19515
417 1 3 . 1 1 678 678 TRP C C 678 176.964 176.964 178.925 -1.961 19515
418 1 3 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.342 -2.084 19515
419 1 3 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.138 -0.319 19515
420 1 3 . 1 1 678 678 TRP H H 678 7.525 7.525 8.408 -0.883 19515
421 1 3 . 1 1 679 679 LEU N N 679 116.664 116.664 119.885 -3.221 19515
422 1 3 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.183 -0.101 19515
423 1 3 . 1 1 679 679 LEU C C 679 177.458 177.458 178.926 -1.468 19515
424 1 3 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.804 -0.965 19515
425 1 3 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.278 0.634 19515
426 1 3 . 1 1 679 679 LEU H H 679 7.786 7.786 8.509 -0.723 19515
427 1 3 . 1 1 680 680 TRP N N 680 116.195 116.195 120.997 -4.802 19515
428 1 3 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.522 -0.166 19515
429 1 3 . 1 1 680 680 TRP C C 680 176.394 176.394 178.231 -1.837 19515
430 1 3 . 1 1 680 680 TRP CA C 680 58.948 58.948 60.797 -1.849 19515
431 1 3 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.625 -0.490 19515
432 1 3 . 1 1 680 680 TRP H H 680 7.547 7.547 8.836 -1.289 19515
433 1 3 . 1 1 681 681 TYR N N 681 115.352 115.352 118.210 -2.858 19515
434 1 3 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.434 -0.284 19515
435 1 3 . 1 1 681 681 TYR C C 681 175.671 175.671 176.762 -1.091 19515
436 1 3 . 1 1 681 681 TYR CA C 681 59.780 59.780 61.045 -1.266 19515
437 1 3 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.881 0.130 19515
438 1 3 . 1 1 681 681 TYR H H 681 7.471 7.471 7.963 -0.492 19515
439 1 3 . 1 1 682 682 ILE N N 682 113.570 113.570 116.477 -2.907 19515
440 1 3 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.275 -0.064 19515
441 1 3 . 1 1 682 682 ILE C C 682 174.166 174.166 176.717 -2.551 19515
442 1 3 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.351 -0.187 19515
443 1 3 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.437 0.432 19515
444 1 3 . 1 1 682 682 ILE H H 682 7.471 7.471 7.628 -0.157 19515
445 1 4 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.217 0.075 19515
446 1 4 . 1 1 658 658 LYS C C 658 175.668 175.668 175.799 -0.131 19515
447 1 4 . 1 1 658 658 LYS CA C 658 56.747 56.747 56.719 0.028 19515
448 1 4 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.931 -0.063 19515
449 1 4 . 1 1 659 659 ASP N N 659 120.320 120.320 124.164 -3.844 19515
450 1 4 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.805 -0.222 19515
451 1 4 . 1 1 659 659 ASP C C 659 176.214 176.214 176.208 0.006 19515
452 1 4 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.722 0.620 19515
453 1 4 . 1 1 659 659 ASP CB C 659 41.140 41.140 42.401 -1.261 19515
454 1 4 . 1 1 659 659 ASP H H 659 8.360 8.360 8.473 -0.113 19515
455 1 4 . 1 1 660 660 LEU N N 660 121.445 121.445 123.687 -2.242 19515
456 1 4 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.425 -0.204 19515
457 1 4 . 1 1 660 660 LEU C C 660 177.071 177.071 178.311 -1.240 19515
458 1 4 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.053 0.265 19515
459 1 4 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.705 -0.207 19515
460 1 4 . 1 1 660 660 LEU H H 660 8.388 8.388 8.812 -0.424 19515
461 1 4 . 1 1 661 661 LEU N N 661 118.164 118.164 119.151 -0.987 19515
462 1 4 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.542 -0.221 19515
463 1 4 . 1 1 661 661 LEU C C 661 176.473 176.473 176.357 0.116 19515
464 1 4 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.065 0.726 19515
465 1 4 . 1 1 661 661 LEU CB C 661 42.060 42.060 41.972 0.088 19515
466 1 4 . 1 1 661 661 LEU H H 661 8.114 8.114 7.995 0.118 19515
467 1 4 . 1 1 662 662 ALA N N 662 122.289 122.289 122.943 -0.654 19515
468 1 4 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.270 0.066 19515
469 1 4 . 1 1 662 662 ALA C C 662 177.849 177.849 178.979 -1.130 19515
470 1 4 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.670 -0.155 19515
471 1 4 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.701 1.512 19515
472 1 4 . 1 1 662 662 ALA H H 662 7.936 7.936 7.427 0.509 19515
473 1 4 . 1 1 663 663 LEU N N 663 119.570 119.570 127.035 -7.465 19515
474 1 4 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.079 0.121 19515
475 1 4 . 1 1 663 663 LEU C C 663 177.653 177.653 178.397 -0.744 19515
476 1 4 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.784 -1.268 19515
477 1 4 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.783 0.249 19515
478 1 4 . 1 1 663 663 LEU H H 663 8.210 8.210 8.449 -0.239 19515
479 1 4 . 1 1 664 664 ASP N N 664 117.320 117.320 117.767 -0.447 19515
480 1 4 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.428 0.077 19515
481 1 4 . 1 1 664 664 ASP C C 664 177.568 177.568 177.598 -0.030 19515
482 1 4 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.874 -1.195 19515
483 1 4 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.636 -0.168 19515
484 1 4 . 1 1 664 664 ASP H H 664 8.360 8.360 8.621 -0.261 19515
485 1 4 . 1 1 665 665 LYS N N 665 118.403 118.403 116.936 1.467 19515
486 1 4 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.376 -0.188 19515
487 1 4 . 1 1 665 665 LYS C C 665 177.428 177.428 178.747 -1.319 19515
488 1 4 . 1 1 665 665 LYS CA C 665 57.552 57.552 56.980 0.572 19515
489 1 4 . 1 1 665 665 LYS CB C 665 32.253 32.253 33.151 -0.899 19515
490 1 4 . 1 1 665 665 LYS H H 665 7.957 7.957 8.212 -0.255 19515
491 1 4 . 1 1 666 666 TRP N N 666 119.008 119.008 121.253 -2.245 19515
492 1 4 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.091 0.427 19515
493 1 4 . 1 1 666 666 TRP C C 666 176.614 176.614 177.113 -0.499 19515
494 1 4 . 1 1 666 666 TRP CA C 666 58.613 58.613 59.929 -1.316 19515
495 1 4 . 1 1 666 666 TRP CB C 666 29.388 29.388 28.966 0.422 19515
496 1 4 . 1 1 666 666 TRP H H 666 8.018 8.018 7.336 0.682 19515
497 1 4 . 1 1 667 667 ASN N N 667 115.789 115.789 117.495 -1.706 19515
498 1 4 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.283 0.122 19515
499 1 4 . 1 1 667 667 ASN C C 667 177.139 177.139 177.263 -0.124 19515
500 1 4 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.514 -0.876 19515
501 1 4 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.069 0.490 19515
502 1 4 . 1 1 667 667 ASN H H 667 8.177 8.177 8.053 0.124 19515
503 1 4 . 1 1 668 668 SER N N 668 114.122 114.122 114.729 -0.607 19515
504 1 4 . 1 1 668 668 SER HA H 668 4.339 4.339 4.403 -0.064 19515
505 1 4 . 1 1 668 668 SER C C 668 175.509 175.509 176.184 -0.675 19515
506 1 4 . 1 1 668 668 SER CA C 668 60.480 60.480 60.928 -0.448 19515
507 1 4 . 1 1 668 668 SER CB C 668 63.178 63.178 63.319 -0.141 19515
508 1 4 . 1 1 668 668 SER H H 668 8.113 8.113 7.539 0.574 19515
509 1 4 . 1 1 669 669 LEU N N 669 121.445 121.445 121.774 -0.329 19515
510 1 4 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.915 0.064 19515
511 1 4 . 1 1 669 669 LEU C C 669 177.357 177.357 177.556 -0.199 19515
512 1 4 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.789 -0.282 19515
513 1 4 . 1 1 669 669 LEU CB C 669 41.986 41.986 41.747 0.239 19515
514 1 4 . 1 1 669 669 LEU H H 669 7.813 7.813 7.714 0.099 19515
515 1 4 . 1 1 670 670 TRP N N 670 115.164 115.164 118.009 -2.845 19515
516 1 4 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.451 0.190 19515
517 1 4 . 1 1 670 670 TRP C C 670 177.139 177.139 177.643 -0.504 19515
518 1 4 . 1 1 670 670 TRP CA C 670 58.242 58.242 58.097 0.145 19515
519 1 4 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.676 -0.145 19515
520 1 4 . 1 1 670 670 TRP H H 670 7.554 7.554 7.693 -0.139 19515
521 1 4 . 1 1 671 671 SER N N 671 111.992 111.992 115.345 -3.353 19515
522 1 4 . 1 1 671 671 SER HA H 671 4.396 4.396 4.515 -0.119 19515
523 1 4 . 1 1 671 671 SER C C 671 175.159 175.159 175.636 -0.477 19515
524 1 4 . 1 1 671 671 SER CA C 671 60.034 60.034 60.522 -0.488 19515
525 1 4 . 1 1 671 671 SER CB C 671 63.623 63.623 63.778 -0.155 19515
526 1 4 . 1 1 671 671 SER H H 671 7.988 7.988 7.818 0.170 19515
527 1 4 . 1 1 672 672 TRP N N 672 120.173 120.173 119.327 0.846 19515
528 1 4 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.850 -0.325 19515
529 1 4 . 1 1 672 672 TRP C C 672 176.153 176.153 176.805 -0.652 19515
530 1 4 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.531 2.106 19515
531 1 4 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.820 -0.157 19515
532 1 4 . 1 1 672 672 TRP H H 672 7.872 7.872 7.066 0.806 19515
533 1 4 . 1 1 673 673 PHE N N 673 117.414 117.414 120.547 -3.133 19515
534 1 4 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.554 -0.176 19515
535 1 4 . 1 1 673 673 PHE C C 673 174.357 174.357 174.919 -0.562 19515
536 1 4 . 1 1 673 673 PHE CA C 673 58.139 58.139 57.101 1.038 19515
537 1 4 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.950 0.433 19515
538 1 4 . 1 1 673 673 PHE H H 673 7.783 7.783 7.272 0.511 19515
539 1 4 . 1 1 674 674 ASP N N 674 120.414 120.414 122.547 -2.133 19515
540 1 4 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.676 -0.044 19515
541 1 4 . 1 1 674 674 ASP C C 674 176.749 176.749 176.308 0.441 19515
542 1 4 . 1 1 674 674 ASP CA C 674 53.569 53.569 54.027 -0.458 19515
543 1 4 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.057 0.598 19515
544 1 4 . 1 1 674 674 ASP H H 674 7.725 7.725 8.266 -0.541 19515
545 1 4 . 1 1 675 675 ILE N N 675 120.320 120.320 124.841 -4.521 19515
546 1 4 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.947 -0.156 19515
547 1 4 . 1 1 675 675 ILE C C 675 176.683 176.683 178.016 -1.333 19515
548 1 4 . 1 1 675 675 ILE CA C 675 63.208 63.208 61.142 2.066 19515
549 1 4 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.201 1.135 19515
550 1 4 . 1 1 675 675 ILE H H 675 8.196 8.196 7.894 0.302 19515
551 1 4 . 1 1 676 676 THR N N 676 111.977 111.977 114.563 -2.586 19515
552 1 4 . 1 1 676 676 THR HA H 676 3.903 3.903 3.920 -0.017 19515
553 1 4 . 1 1 676 676 THR C C 676 176.347 176.347 176.656 -0.309 19515
554 1 4 . 1 1 676 676 THR CA C 676 65.643 65.643 66.199 -0.556 19515
555 1 4 . 1 1 676 676 THR CB C 676 68.453 68.453 68.153 0.299 19515
556 1 4 . 1 1 676 676 THR H H 676 8.114 8.114 8.315 -0.201 19515
557 1 4 . 1 1 677 677 LYS N N 677 119.101 119.101 120.804 -1.703 19515
558 1 4 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.146 -0.131 19515
559 1 4 . 1 1 677 677 LYS C C 677 177.394 177.394 178.705 -1.311 19515
560 1 4 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.202 -1.059 19515
561 1 4 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.319 -0.194 19515
562 1 4 . 1 1 677 677 LYS H H 677 7.512 7.512 8.176 -0.664 19515
563 1 4 . 1 1 678 678 TRP N N 678 116.945 116.945 119.612 -2.667 19515
564 1 4 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.654 0.031 19515
565 1 4 . 1 1 678 678 TRP C C 678 176.964 176.964 178.963 -1.999 19515
566 1 4 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.395 -2.137 19515
567 1 4 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.192 -0.372 19515
568 1 4 . 1 1 678 678 TRP H H 678 7.525 7.525 8.445 -0.920 19515
569 1 4 . 1 1 679 679 LEU N N 679 116.664 116.664 119.892 -3.228 19515
570 1 4 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.183 -0.101 19515
571 1 4 . 1 1 679 679 LEU C C 679 177.458 177.458 178.914 -1.456 19515
572 1 4 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.772 -0.933 19515
573 1 4 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.274 0.638 19515
574 1 4 . 1 1 679 679 LEU H H 679 7.786 7.786 8.476 -0.690 19515
575 1 4 . 1 1 680 680 TRP N N 680 116.195 116.195 120.999 -4.804 19515
576 1 4 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.324 0.033 19515
577 1 4 . 1 1 680 680 TRP C C 680 176.394 176.394 177.661 -1.267 19515
578 1 4 . 1 1 680 680 TRP CA C 680 58.948 58.948 61.169 -2.220 19515
579 1 4 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.599 -0.464 19515
580 1 4 . 1 1 680 680 TRP H H 680 7.547 7.547 8.912 -1.365 19515
581 1 4 . 1 1 681 681 TYR N N 681 115.352 115.352 118.169 -2.817 19515
582 1 4 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.415 -0.265 19515
583 1 4 . 1 1 681 681 TYR C C 681 175.671 175.671 176.771 -1.100 19515
584 1 4 . 1 1 681 681 TYR CA C 681 59.780 59.780 60.968 -1.188 19515
585 1 4 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.980 0.032 19515
586 1 4 . 1 1 681 681 TYR H H 681 7.471 7.471 7.914 -0.443 19515
587 1 4 . 1 1 682 682 ILE N N 682 113.570 113.570 116.480 -2.910 19515
588 1 4 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.293 -0.082 19515
589 1 4 . 1 1 682 682 ILE C C 682 174.166 174.166 176.759 -2.593 19515
590 1 4 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.457 -0.293 19515
591 1 4 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.292 0.577 19515
592 1 4 . 1 1 682 682 ILE H H 682 7.471 7.471 7.603 -0.132 19515
593 1 5 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.496 -0.204 19515
594 1 5 . 1 1 658 658 LYS C C 658 175.668 175.668 174.929 0.739 19515
595 1 5 . 1 1 658 658 LYS CA C 658 56.747 56.747 55.678 1.069 19515
596 1 5 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.344 0.524 19515
597 1 5 . 1 1 659 659 ASP N N 659 120.320 120.320 120.964 -0.644 19515
598 1 5 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.566 0.017 19515
599 1 5 . 1 1 659 659 ASP C C 659 176.214 176.214 177.131 -0.917 19515
600 1 5 . 1 1 659 659 ASP CA C 659 54.342 54.342 55.201 -0.859 19515
601 1 5 . 1 1 659 659 ASP CB C 659 41.140 41.140 41.510 -0.370 19515
602 1 5 . 1 1 659 659 ASP H H 659 8.360 8.360 8.268 0.092 19515
603 1 5 . 1 1 660 660 LEU N N 660 121.445 121.445 123.768 -2.323 19515
604 1 5 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.137 0.084 19515
605 1 5 . 1 1 660 660 LEU C C 660 177.071 177.071 177.318 -0.247 19515
606 1 5 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.725 -0.408 19515
607 1 5 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.229 0.269 19515
608 1 5 . 1 1 660 660 LEU H H 660 8.388 8.388 8.391 -0.003 19515
609 1 5 . 1 1 661 661 LEU N N 661 118.164 118.164 118.818 -0.654 19515
610 1 5 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.663 -0.343 19515
611 1 5 . 1 1 661 661 LEU C C 661 176.473 176.473 176.185 0.288 19515
612 1 5 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.753 0.038 19515
613 1 5 . 1 1 661 661 LEU CB C 661 42.060 42.060 42.272 -0.212 19515
614 1 5 . 1 1 661 661 LEU H H 661 8.114 8.114 7.822 0.292 19515
615 1 5 . 1 1 662 662 ALA N N 662 122.289 122.289 122.771 -0.482 19515
616 1 5 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.329 0.007 19515
617 1 5 . 1 1 662 662 ALA C C 662 177.849 177.849 178.798 -0.949 19515
618 1 5 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.633 -0.117 19515
619 1 5 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.411 1.802 19515
620 1 5 . 1 1 662 662 ALA H H 662 7.936 7.936 8.103 -0.167 19515
621 1 5 . 1 1 663 663 LEU N N 663 119.570 119.570 125.018 -5.448 19515
622 1 5 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.165 0.035 19515
623 1 5 . 1 1 663 663 LEU C C 663 177.653 177.653 178.035 -0.382 19515
624 1 5 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.706 -1.190 19515
625 1 5 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.934 0.098 19515
626 1 5 . 1 1 663 663 LEU H H 663 8.210 8.210 8.118 0.092 19515
627 1 5 . 1 1 664 664 ASP N N 664 117.320 117.320 116.331 0.989 19515
628 1 5 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.422 0.083 19515
629 1 5 . 1 1 664 664 ASP C C 664 177.568 177.568 177.714 -0.146 19515
630 1 5 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.454 -0.775 19515
631 1 5 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.257 0.211 19515
632 1 5 . 1 1 664 664 ASP H H 664 8.360 8.360 8.533 -0.173 19515
633 1 5 . 1 1 665 665 LYS N N 665 118.403 118.403 118.371 0.032 19515
634 1 5 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.469 -0.281 19515
635 1 5 . 1 1 665 665 LYS C C 665 177.428 177.428 178.248 -0.820 19515
636 1 5 . 1 1 665 665 LYS CA C 665 57.552 57.552 56.545 1.007 19515
637 1 5 . 1 1 665 665 LYS CB C 665 32.253 32.253 32.758 -0.505 19515
638 1 5 . 1 1 665 665 LYS H H 665 7.957 7.957 8.094 -0.137 19515
639 1 5 . 1 1 666 666 TRP N N 666 119.008 119.008 121.457 -2.449 19515
640 1 5 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.302 0.216 19515
641 1 5 . 1 1 666 666 TRP C C 666 176.614 176.614 177.741 -1.127 19515
642 1 5 . 1 1 666 666 TRP CA C 666 58.613 58.613 61.219 -2.606 19515
643 1 5 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.261 0.128 19515
644 1 5 . 1 1 666 666 TRP H H 666 8.018 8.018 7.847 0.171 19515
645 1 5 . 1 1 667 667 ASN N N 667 115.789 115.789 117.860 -2.071 19515
646 1 5 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.626 -0.221 19515
647 1 5 . 1 1 667 667 ASN C C 667 177.139 177.139 177.591 -0.452 19515
648 1 5 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.585 -0.947 19515
649 1 5 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.475 0.084 19515
650 1 5 . 1 1 667 667 ASN H H 667 8.177 8.177 8.188 -0.011 19515
651 1 5 . 1 1 668 668 SER N N 668 114.122 114.122 115.349 -1.227 19515
652 1 5 . 1 1 668 668 SER HA H 668 4.339 4.339 4.443 -0.104 19515
653 1 5 . 1 1 668 668 SER C C 668 175.509 175.509 176.195 -0.686 19515
654 1 5 . 1 1 668 668 SER CA C 668 60.480 60.480 61.418 -0.938 19515
655 1 5 . 1 1 668 668 SER CB C 668 63.178 63.178 63.450 -0.272 19515
656 1 5 . 1 1 668 668 SER H H 668 8.113 8.113 7.721 0.392 19515
657 1 5 . 1 1 669 669 LEU N N 669 121.445 121.445 121.623 -0.178 19515
658 1 5 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.819 0.160 19515
659 1 5 . 1 1 669 669 LEU C C 669 177.357 177.357 177.360 -0.003 19515
660 1 5 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.451 0.056 19515
661 1 5 . 1 1 669 669 LEU CB C 669 41.986 41.986 41.963 0.023 19515
662 1 5 . 1 1 669 669 LEU H H 669 7.813 7.813 7.867 -0.054 19515
663 1 5 . 1 1 670 670 TRP N N 670 115.164 115.164 118.254 -3.090 19515
664 1 5 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.477 0.164 19515
665 1 5 . 1 1 670 670 TRP C C 670 177.139 177.139 177.742 -0.603 19515
666 1 5 . 1 1 670 670 TRP CA C 670 58.242 58.242 58.995 -0.753 19515
667 1 5 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.679 -0.148 19515
668 1 5 . 1 1 670 670 TRP H H 670 7.554 7.554 7.909 -0.355 19515
669 1 5 . 1 1 671 671 SER N N 671 111.992 111.992 115.356 -3.364 19515
670 1 5 . 1 1 671 671 SER HA H 671 4.396 4.396 4.521 -0.125 19515
671 1 5 . 1 1 671 671 SER C C 671 175.159 175.159 175.716 -0.557 19515
672 1 5 . 1 1 671 671 SER CA C 671 60.034 60.034 60.779 -0.745 19515
673 1 5 . 1 1 671 671 SER CB C 671 63.623 63.623 63.621 0.002 19515
674 1 5 . 1 1 671 671 SER H H 671 7.988 7.988 7.834 0.154 19515
675 1 5 . 1 1 672 672 TRP N N 672 120.173 120.173 118.593 1.580 19515
676 1 5 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.828 -0.303 19515
677 1 5 . 1 1 672 672 TRP C C 672 176.153 176.153 176.415 -0.262 19515
678 1 5 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.484 2.153 19515
679 1 5 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.649 0.014 19515
680 1 5 . 1 1 672 672 TRP H H 672 7.872 7.872 6.987 0.885 19515
681 1 5 . 1 1 673 673 PHE N N 673 117.414 117.414 120.689 -3.275 19515
682 1 5 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.496 -0.118 19515
683 1 5 . 1 1 673 673 PHE C C 673 174.357 174.357 174.743 -0.386 19515
684 1 5 . 1 1 673 673 PHE CA C 673 58.139 58.139 56.456 1.683 19515
685 1 5 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.934 0.450 19515
686 1 5 . 1 1 673 673 PHE H H 673 7.783 7.783 7.136 0.647 19515
687 1 5 . 1 1 674 674 ASP N N 674 120.414 120.414 120.079 0.335 19515
688 1 5 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.814 -0.182 19515
689 1 5 . 1 1 674 674 ASP C C 674 176.749 176.749 176.475 0.274 19515
690 1 5 . 1 1 674 674 ASP CA C 674 53.569 53.569 53.993 -0.424 19515
691 1 5 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.288 0.367 19515
692 1 5 . 1 1 674 674 ASP H H 674 7.725 7.725 8.073 -0.348 19515
693 1 5 . 1 1 675 675 ILE N N 675 120.320 120.320 123.991 -3.671 19515
694 1 5 . 1 1 675 675 ILE HA H 675 3.791 3.791 4.018 -0.227 19515
695 1 5 . 1 1 675 675 ILE C C 675 176.683 176.683 177.901 -1.218 19515
696 1 5 . 1 1 675 675 ILE CA C 675 63.208 63.208 60.991 2.217 19515
697 1 5 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.156 1.180 19515
698 1 5 . 1 1 675 675 ILE H H 675 8.196 8.196 8.098 0.098 19515
699 1 5 . 1 1 676 676 THR N N 676 111.977 111.977 113.392 -1.415 19515
700 1 5 . 1 1 676 676 THR HA H 676 3.903 3.903 4.033 -0.130 19515
701 1 5 . 1 1 676 676 THR C C 676 176.347 176.347 176.733 -0.386 19515
702 1 5 . 1 1 676 676 THR CA C 676 65.643 65.643 66.016 -0.373 19515
703 1 5 . 1 1 676 676 THR CB C 676 68.453 68.453 68.495 -0.042 19515
704 1 5 . 1 1 676 676 THR H H 676 8.114 8.114 8.456 -0.342 19515
705 1 5 . 1 1 677 677 LYS N N 677 119.101 119.101 120.943 -1.842 19515
706 1 5 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.174 -0.159 19515
707 1 5 . 1 1 677 677 LYS C C 677 177.394 177.394 178.550 -1.156 19515
708 1 5 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.229 -1.086 19515
709 1 5 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.179 -0.054 19515
710 1 5 . 1 1 677 677 LYS H H 677 7.512 7.512 8.127 -0.615 19515
711 1 5 . 1 1 678 678 TRP N N 678 116.945 116.945 119.676 -2.731 19515
712 1 5 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.687 -0.002 19515
713 1 5 . 1 1 678 678 TRP C C 678 176.964 176.964 178.997 -2.033 19515
714 1 5 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.448 -2.190 19515
715 1 5 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.225 -0.406 19515
716 1 5 . 1 1 678 678 TRP H H 678 7.525 7.525 8.484 -0.959 19515
717 1 5 . 1 1 679 679 LEU N N 679 116.664 116.664 119.925 -3.261 19515
718 1 5 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.210 -0.128 19515
719 1 5 . 1 1 679 679 LEU C C 679 177.458 177.458 178.949 -1.491 19515
720 1 5 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.815 -0.976 19515
721 1 5 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.305 0.607 19515
722 1 5 . 1 1 679 679 LEU H H 679 7.786 7.786 8.549 -0.763 19515
723 1 5 . 1 1 680 680 TRP N N 680 116.195 116.195 121.105 -4.910 19515
724 1 5 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.370 -0.013 19515
725 1 5 . 1 1 680 680 TRP C C 680 176.394 176.394 177.993 -1.599 19515
726 1 5 . 1 1 680 680 TRP CA C 680 58.948 58.948 60.900 -1.952 19515
727 1 5 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.543 -0.408 19515
728 1 5 . 1 1 680 680 TRP H H 680 7.547 7.547 8.867 -1.320 19515
729 1 5 . 1 1 681 681 TYR N N 681 115.352 115.352 118.168 -2.816 19515
730 1 5 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.432 -0.282 19515
731 1 5 . 1 1 681 681 TYR C C 681 175.671 175.671 176.781 -1.110 19515
732 1 5 . 1 1 681 681 TYR CA C 681 59.780 59.780 61.042 -1.262 19515
733 1 5 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.967 0.044 19515
734 1 5 . 1 1 681 681 TYR H H 681 7.471 7.471 7.922 -0.451 19515
735 1 5 . 1 1 682 682 ILE N N 682 113.570 113.570 116.218 -2.648 19515
736 1 5 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.320 -0.109 19515
737 1 5 . 1 1 682 682 ILE C C 682 174.166 174.166 176.838 -2.672 19515
738 1 5 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.370 -0.206 19515
739 1 5 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.417 0.452 19515
740 1 5 . 1 1 682 682 ILE H H 682 7.471 7.471 7.591 -0.120 19515
741 1 6 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.510 -0.218 19515
742 1 6 . 1 1 658 658 LYS C C 658 175.668 175.668 174.486 1.182 19515
743 1 6 . 1 1 658 658 LYS CA C 658 56.747 56.747 56.112 0.635 19515
744 1 6 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.891 -0.023 19515
745 1 6 . 1 1 659 659 ASP N N 659 120.320 120.320 120.777 -0.457 19515
746 1 6 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.779 -0.196 19515
747 1 6 . 1 1 659 659 ASP C C 659 176.214 176.214 176.812 -0.598 19515
748 1 6 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.882 0.460 19515
749 1 6 . 1 1 659 659 ASP CB C 659 41.140 41.140 41.512 -0.372 19515
750 1 6 . 1 1 659 659 ASP H H 659 8.360 8.360 8.041 0.319 19515
751 1 6 . 1 1 660 660 LEU N N 660 121.445 121.445 124.320 -2.875 19515
752 1 6 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.348 -0.127 19515
753 1 6 . 1 1 660 660 LEU C C 660 177.071 177.071 178.136 -1.065 19515
754 1 6 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.301 0.016 19515
755 1 6 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.522 -0.023 19515
756 1 6 . 1 1 660 660 LEU H H 660 8.388 8.388 8.854 -0.466 19515
757 1 6 . 1 1 661 661 LEU N N 661 118.164 118.164 119.105 -0.941 19515
758 1 6 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.644 -0.323 19515
759 1 6 . 1 1 661 661 LEU C C 661 176.473 176.473 176.411 0.062 19515
760 1 6 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.163 0.628 19515
761 1 6 . 1 1 661 661 LEU CB C 661 42.060 42.060 42.074 -0.014 19515
762 1 6 . 1 1 661 661 LEU H H 661 8.114 8.114 7.999 0.115 19515
763 1 6 . 1 1 662 662 ALA N N 662 122.289 122.289 123.294 -1.005 19515
764 1 6 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.290 0.046 19515
765 1 6 . 1 1 662 662 ALA C C 662 177.849 177.849 178.775 -0.926 19515
766 1 6 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.612 -0.096 19515
767 1 6 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.416 1.797 19515
768 1 6 . 1 1 662 662 ALA H H 662 7.936 7.936 7.377 0.559 19515
769 1 6 . 1 1 663 663 LEU N N 663 119.570 119.570 125.040 -5.470 19515
770 1 6 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.138 0.062 19515
771 1 6 . 1 1 663 663 LEU C C 663 177.653 177.653 178.077 -0.424 19515
772 1 6 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.693 -1.177 19515
773 1 6 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.657 0.375 19515
774 1 6 . 1 1 663 663 LEU H H 663 8.210 8.210 8.105 0.105 19515
775 1 6 . 1 1 664 664 ASP N N 664 117.320 117.320 116.179 1.141 19515
776 1 6 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.391 0.114 19515
777 1 6 . 1 1 664 664 ASP C C 664 177.568 177.568 177.618 -0.050 19515
778 1 6 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.471 -0.792 19515
779 1 6 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.238 0.230 19515
780 1 6 . 1 1 664 664 ASP H H 664 8.360 8.360 8.586 -0.226 19515
781 1 6 . 1 1 665 665 LYS N N 665 118.403 118.403 118.131 0.272 19515
782 1 6 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.481 -0.293 19515
783 1 6 . 1 1 665 665 LYS C C 665 177.428 177.428 178.332 -0.904 19515
784 1 6 . 1 1 665 665 LYS CA C 665 57.552 57.552 57.244 0.308 19515
785 1 6 . 1 1 665 665 LYS CB C 665 32.253 32.253 33.066 -0.813 19515
786 1 6 . 1 1 665 665 LYS H H 665 7.957 7.957 8.080 -0.123 19515
787 1 6 . 1 1 666 666 TRP N N 666 119.008 119.008 121.885 -2.877 19515
788 1 6 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.445 0.073 19515
789 1 6 . 1 1 666 666 TRP C C 666 176.614 176.614 177.726 -1.112 19515
790 1 6 . 1 1 666 666 TRP CA C 666 58.613 58.613 61.059 -2.446 19515
791 1 6 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.484 -0.096 19515
792 1 6 . 1 1 666 666 TRP H H 666 8.018 8.018 7.798 0.220 19515
793 1 6 . 1 1 667 667 ASN N N 667 115.789 115.789 118.061 -2.272 19515
794 1 6 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.493 -0.088 19515
795 1 6 . 1 1 667 667 ASN C C 667 177.139 177.139 177.536 -0.397 19515
796 1 6 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.704 -1.066 19515
797 1 6 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.420 0.139 19515
798 1 6 . 1 1 667 667 ASN H H 667 8.177 8.177 8.032 0.145 19515
799 1 6 . 1 1 668 668 SER N N 668 114.122 114.122 115.516 -1.394 19515
800 1 6 . 1 1 668 668 SER HA H 668 4.339 4.339 4.439 -0.100 19515
801 1 6 . 1 1 668 668 SER C C 668 175.509 175.509 176.030 -0.521 19515
802 1 6 . 1 1 668 668 SER CA C 668 60.480 60.480 61.355 -0.875 19515
803 1 6 . 1 1 668 668 SER CB C 668 63.178 63.178 63.561 -0.383 19515
804 1 6 . 1 1 668 668 SER H H 668 8.113 8.113 7.661 0.452 19515
805 1 6 . 1 1 669 669 LEU N N 669 121.445 121.445 120.915 0.530 19515
806 1 6 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.833 0.146 19515
807 1 6 . 1 1 669 669 LEU C C 669 177.357 177.357 177.590 -0.233 19515
808 1 6 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.119 0.388 19515
809 1 6 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.178 -0.192 19515
810 1 6 . 1 1 669 669 LEU H H 669 7.813 7.813 7.960 -0.147 19515
811 1 6 . 1 1 670 670 TRP N N 670 115.164 115.164 115.565 -0.401 19515
812 1 6 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.473 0.168 19515
813 1 6 . 1 1 670 670 TRP C C 670 177.139 177.139 176.653 0.486 19515
814 1 6 . 1 1 670 670 TRP CA C 670 58.242 58.242 59.242 -1.000 19515
815 1 6 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.486 0.045 19515
816 1 6 . 1 1 670 670 TRP H H 670 7.554 7.554 7.762 -0.208 19515
817 1 6 . 1 1 671 671 SER N N 671 111.992 111.992 113.060 -1.068 19515
818 1 6 . 1 1 671 671 SER HA H 671 4.396 4.396 4.543 -0.147 19515
819 1 6 . 1 1 671 671 SER C C 671 175.159 175.159 175.469 -0.310 19515
820 1 6 . 1 1 671 671 SER CA C 671 60.034 60.034 60.456 -0.422 19515
821 1 6 . 1 1 671 671 SER CB C 671 63.623 63.623 63.877 -0.253 19515
822 1 6 . 1 1 671 671 SER H H 671 7.988 7.988 7.722 0.266 19515
823 1 6 . 1 1 672 672 TRP N N 672 120.173 120.173 118.420 1.753 19515
824 1 6 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.856 -0.331 19515
825 1 6 . 1 1 672 672 TRP C C 672 176.153 176.153 176.425 -0.272 19515
826 1 6 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.423 2.214 19515
827 1 6 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.232 0.431 19515
828 1 6 . 1 1 672 672 TRP H H 672 7.872 7.872 6.962 0.910 19515
829 1 6 . 1 1 673 673 PHE N N 673 117.414 117.414 120.843 -3.429 19515
830 1 6 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.455 -0.077 19515
831 1 6 . 1 1 673 673 PHE C C 673 174.357 174.357 174.453 -0.096 19515
832 1 6 . 1 1 673 673 PHE CA C 673 58.139 58.139 57.099 1.040 19515
833 1 6 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.539 0.845 19515
834 1 6 . 1 1 673 673 PHE H H 673 7.783 7.783 6.956 0.827 19515
835 1 6 . 1 1 674 674 ASP N N 674 120.414 120.414 122.249 -1.835 19515
836 1 6 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.724 -0.092 19515
837 1 6 . 1 1 674 674 ASP C C 674 176.749 176.749 176.636 0.113 19515
838 1 6 . 1 1 674 674 ASP CA C 674 53.569 53.569 54.087 -0.518 19515
839 1 6 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.956 -0.301 19515
840 1 6 . 1 1 674 674 ASP H H 674 7.725 7.725 7.463 0.262 19515
841 1 6 . 1 1 675 675 ILE N N 675 120.320 120.320 126.010 -5.690 19515
842 1 6 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.923 -0.132 19515
843 1 6 . 1 1 675 675 ILE C C 675 176.683 176.683 177.971 -1.288 19515
844 1 6 . 1 1 675 675 ILE CA C 675 63.208 63.208 60.337 2.871 19515
845 1 6 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.287 1.049 19515
846 1 6 . 1 1 675 675 ILE H H 675 8.196 8.196 8.331 -0.135 19515
847 1 6 . 1 1 676 676 THR N N 676 111.977 111.977 116.924 -4.947 19515
848 1 6 . 1 1 676 676 THR HA H 676 3.903 3.903 4.078 -0.175 19515
849 1 6 . 1 1 676 676 THR C C 676 176.347 176.347 176.229 0.118 19515
850 1 6 . 1 1 676 676 THR CA C 676 65.643 65.643 67.084 -1.441 19515
851 1 6 . 1 1 676 676 THR CB C 676 68.453 68.453 68.982 -0.529 19515
852 1 6 . 1 1 676 676 THR H H 676 8.114 8.114 8.369 -0.255 19515
853 1 6 . 1 1 677 677 LYS N N 677 119.101 119.101 120.004 -0.903 19515
854 1 6 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.193 -0.178 19515
855 1 6 . 1 1 677 677 LYS C C 677 177.394 177.394 178.744 -1.350 19515
856 1 6 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.323 -1.180 19515
857 1 6 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.319 -0.194 19515
858 1 6 . 1 1 677 677 LYS H H 677 7.512 7.512 8.178 -0.666 19515
859 1 6 . 1 1 678 678 TRP N N 678 116.945 116.945 119.609 -2.664 19515
860 1 6 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.607 0.078 19515
861 1 6 . 1 1 678 678 TRP C C 678 176.964 176.964 178.972 -2.008 19515
862 1 6 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.401 -2.143 19515
863 1 6 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.141 -0.322 19515
864 1 6 . 1 1 678 678 TRP H H 678 7.525 7.525 8.409 -0.884 19515
865 1 6 . 1 1 679 679 LEU N N 679 116.664 116.664 119.928 -3.264 19515
866 1 6 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.191 -0.109 19515
867 1 6 . 1 1 679 679 LEU C C 679 177.458 177.458 178.967 -1.509 19515
868 1 6 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.809 -0.970 19515
869 1 6 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.309 0.603 19515
870 1 6 . 1 1 679 679 LEU H H 679 7.786 7.786 8.572 -0.786 19515
871 1 6 . 1 1 680 680 TRP N N 680 116.195 116.195 120.947 -4.752 19515
872 1 6 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.337 0.020 19515
873 1 6 . 1 1 680 680 TRP C C 680 176.394 176.394 177.706 -1.312 19515
874 1 6 . 1 1 680 680 TRP CA C 680 58.948 58.948 61.053 -2.105 19515
875 1 6 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.762 -0.627 19515
876 1 6 . 1 1 680 680 TRP H H 680 7.547 7.547 9.099 -1.552 19515
877 1 6 . 1 1 681 681 TYR N N 681 115.352 115.352 118.122 -2.770 19515
878 1 6 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.419 -0.269 19515
879 1 6 . 1 1 681 681 TYR C C 681 175.671 175.671 176.781 -1.110 19515
880 1 6 . 1 1 681 681 TYR CA C 681 59.780 59.780 60.899 -1.119 19515
881 1 6 . 1 1 681 681 TYR CB C 681 39.011 39.011 39.025 -0.014 19515
882 1 6 . 1 1 681 681 TYR H H 681 7.471 7.471 7.941 -0.470 19515
883 1 6 . 1 1 682 682 ILE N N 682 113.570 113.570 116.494 -2.924 19515
884 1 6 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.294 -0.083 19515
885 1 6 . 1 1 682 682 ILE C C 682 174.166 174.166 176.767 -2.601 19515
886 1 6 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.480 -0.316 19515
887 1 6 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.289 0.580 19515
888 1 6 . 1 1 682 682 ILE H H 682 7.471 7.471 7.605 -0.134 19515
889 1 7 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.583 -0.291 19515
890 1 7 . 1 1 658 658 LYS C C 658 175.668 175.668 174.286 1.382 19515
891 1 7 . 1 1 658 658 LYS CA C 658 56.747 56.747 55.804 0.943 19515
892 1 7 . 1 1 658 658 LYS CB C 658 32.868 32.868 33.996 -1.128 19515
893 1 7 . 1 1 659 659 ASP N N 659 120.320 120.320 123.352 -3.032 19515
894 1 7 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.871 -0.288 19515
895 1 7 . 1 1 659 659 ASP C C 659 176.214 176.214 177.098 -0.884 19515
896 1 7 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.540 0.802 19515
897 1 7 . 1 1 659 659 ASP CB C 659 41.140 41.140 42.408 -1.268 19515
898 1 7 . 1 1 659 659 ASP H H 659 8.360 8.360 8.600 -0.240 19515
899 1 7 . 1 1 660 660 LEU N N 660 121.445 121.445 122.250 -0.805 19515
900 1 7 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.325 -0.104 19515
901 1 7 . 1 1 660 660 LEU C C 660 177.071 177.071 177.151 -0.080 19515
902 1 7 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.889 -0.572 19515
903 1 7 . 1 1 660 660 LEU CB C 660 42.498 42.498 41.966 0.532 19515
904 1 7 . 1 1 660 660 LEU H H 660 8.388 8.388 8.774 -0.386 19515
905 1 7 . 1 1 661 661 LEU N N 661 118.164 118.164 118.647 -0.483 19515
906 1 7 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.725 -0.404 19515
907 1 7 . 1 1 661 661 LEU C C 661 176.473 176.473 176.460 0.013 19515
908 1 7 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.008 0.783 19515
909 1 7 . 1 1 661 661 LEU CB C 661 42.060 42.060 41.866 0.194 19515
910 1 7 . 1 1 661 661 LEU H H 661 8.114 8.114 8.037 0.077 19515
911 1 7 . 1 1 662 662 ALA N N 662 122.289 122.289 123.265 -0.976 19515
912 1 7 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.293 0.043 19515
913 1 7 . 1 1 662 662 ALA C C 662 177.849 177.849 178.806 -0.957 19515
914 1 7 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.710 -0.194 19515
915 1 7 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.808 1.405 19515
916 1 7 . 1 1 662 662 ALA H H 662 7.936 7.936 7.516 0.420 19515
917 1 7 . 1 1 663 663 LEU N N 663 119.570 119.570 126.692 -7.122 19515
918 1 7 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.135 0.065 19515
919 1 7 . 1 1 663 663 LEU C C 663 177.653 177.653 178.473 -0.820 19515
920 1 7 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.973 -1.457 19515
921 1 7 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.847 0.185 19515
922 1 7 . 1 1 663 663 LEU H H 663 8.210 8.210 8.435 -0.225 19515
923 1 7 . 1 1 664 664 ASP N N 664 117.320 117.320 118.031 -0.711 19515
924 1 7 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.490 0.015 19515
925 1 7 . 1 1 664 664 ASP C C 664 177.568 177.568 177.722 -0.154 19515
926 1 7 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.526 -0.847 19515
927 1 7 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.730 -0.262 19515
928 1 7 . 1 1 664 664 ASP H H 664 8.360 8.360 8.625 -0.265 19515
929 1 7 . 1 1 665 665 LYS N N 665 118.403 118.403 118.212 0.191 19515
930 1 7 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.430 -0.242 19515
931 1 7 . 1 1 665 665 LYS C C 665 177.428 177.428 178.396 -0.968 19515
932 1 7 . 1 1 665 665 LYS CA C 665 57.552 57.552 57.626 -0.074 19515
933 1 7 . 1 1 665 665 LYS CB C 665 32.253 32.253 32.955 -0.702 19515
934 1 7 . 1 1 665 665 LYS H H 665 7.957 7.957 8.227 -0.270 19515
935 1 7 . 1 1 666 666 TRP N N 666 119.008 119.008 120.751 -1.743 19515
936 1 7 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.383 0.135 19515
937 1 7 . 1 1 666 666 TRP C C 666 176.614 176.614 178.316 -1.702 19515
938 1 7 . 1 1 666 666 TRP CA C 666 58.613 58.613 60.545 -1.932 19515
939 1 7 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.261 0.127 19515
940 1 7 . 1 1 666 666 TRP H H 666 8.018 8.018 7.483 0.535 19515
941 1 7 . 1 1 667 667 ASN N N 667 115.789 115.789 118.282 -2.493 19515
942 1 7 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.553 -0.148 19515
943 1 7 . 1 1 667 667 ASN C C 667 177.139 177.139 177.569 -0.430 19515
944 1 7 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.673 -1.035 19515
945 1 7 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.402 0.157 19515
946 1 7 . 1 1 667 667 ASN H H 667 8.177 8.177 8.116 0.061 19515
947 1 7 . 1 1 668 668 SER N N 668 114.122 114.122 114.553 -0.431 19515
948 1 7 . 1 1 668 668 SER HA H 668 4.339 4.339 4.459 -0.120 19515
949 1 7 . 1 1 668 668 SER C C 668 175.509 175.509 176.060 -0.551 19515
950 1 7 . 1 1 668 668 SER CA C 668 60.480 60.480 60.858 -0.378 19515
951 1 7 . 1 1 668 668 SER CB C 668 63.178 63.178 63.411 -0.233 19515
952 1 7 . 1 1 668 668 SER H H 668 8.113 8.113 7.605 0.508 19515
953 1 7 . 1 1 669 669 LEU N N 669 121.445 121.445 120.778 0.667 19515
954 1 7 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.842 0.137 19515
955 1 7 . 1 1 669 669 LEU C C 669 177.357 177.357 177.630 -0.273 19515
956 1 7 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.361 0.146 19515
957 1 7 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.031 -0.045 19515
958 1 7 . 1 1 669 669 LEU H H 669 7.813 7.813 7.989 -0.176 19515
959 1 7 . 1 1 670 670 TRP N N 670 115.164 115.164 118.482 -3.318 19515
960 1 7 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.440 0.201 19515
961 1 7 . 1 1 670 670 TRP C C 670 177.139 177.139 177.465 -0.326 19515
962 1 7 . 1 1 670 670 TRP CA C 670 58.242 58.242 58.997 -0.755 19515
963 1 7 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.789 -0.258 19515
964 1 7 . 1 1 670 670 TRP H H 670 7.554 7.554 7.837 -0.283 19515
965 1 7 . 1 1 671 671 SER N N 671 111.992 111.992 114.450 -2.458 19515
966 1 7 . 1 1 671 671 SER HA H 671 4.396 4.396 4.509 -0.113 19515
967 1 7 . 1 1 671 671 SER C C 671 175.159 175.159 175.539 -0.380 19515
968 1 7 . 1 1 671 671 SER CA C 671 60.034 60.034 61.255 -1.222 19515
969 1 7 . 1 1 671 671 SER CB C 671 63.623 63.623 63.822 -0.199 19515
970 1 7 . 1 1 671 671 SER H H 671 7.988 7.988 7.803 0.185 19515
971 1 7 . 1 1 672 672 TRP N N 672 120.173 120.173 118.104 2.069 19515
972 1 7 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.899 -0.374 19515
973 1 7 . 1 1 672 672 TRP C C 672 176.153 176.153 176.362 -0.209 19515
974 1 7 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.504 2.133 19515
975 1 7 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.606 0.057 19515
976 1 7 . 1 1 672 672 TRP H H 672 7.872 7.872 6.918 0.954 19515
977 1 7 . 1 1 673 673 PHE N N 673 117.414 117.414 121.087 -3.673 19515
978 1 7 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.505 -0.127 19515
979 1 7 . 1 1 673 673 PHE C C 673 174.357 174.357 174.475 -0.118 19515
980 1 7 . 1 1 673 673 PHE CA C 673 58.139 58.139 56.698 1.441 19515
981 1 7 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.925 0.459 19515
982 1 7 . 1 1 673 673 PHE H H 673 7.783 7.783 7.114 0.669 19515
983 1 7 . 1 1 674 674 ASP N N 674 120.414 120.414 119.588 0.826 19515
984 1 7 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.893 -0.261 19515
985 1 7 . 1 1 674 674 ASP C C 674 176.749 176.749 176.243 0.506 19515
986 1 7 . 1 1 674 674 ASP CA C 674 53.569 53.569 53.589 -0.020 19515
987 1 7 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.808 -0.153 19515
988 1 7 . 1 1 674 674 ASP H H 674 7.725 7.725 7.506 0.219 19515
989 1 7 . 1 1 675 675 ILE N N 675 120.320 120.320 124.009 -3.689 19515
990 1 7 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.903 -0.112 19515
991 1 7 . 1 1 675 675 ILE C C 675 176.683 176.683 177.557 -0.874 19515
992 1 7 . 1 1 675 675 ILE CA C 675 63.208 63.208 61.184 2.024 19515
993 1 7 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.178 1.158 19515
994 1 7 . 1 1 675 675 ILE H H 675 8.196 8.196 8.421 -0.225 19515
995 1 7 . 1 1 676 676 THR N N 676 111.977 111.977 114.236 -2.259 19515
996 1 7 . 1 1 676 676 THR HA H 676 3.903 3.903 4.044 -0.141 19515
997 1 7 . 1 1 676 676 THR C C 676 176.347 176.347 176.710 -0.363 19515
998 1 7 . 1 1 676 676 THR CA C 676 65.643 65.643 66.144 -0.501 19515
999 1 7 . 1 1 676 676 THR CB C 676 68.453 68.453 68.228 0.225 19515
1000 1 7 . 1 1 676 676 THR H H 676 8.114 8.114 8.410 -0.296 19515
1001 1 7 . 1 1 677 677 LYS N N 677 119.101 119.101 120.936 -1.835 19515
1002 1 7 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.154 -0.139 19515
1003 1 7 . 1 1 677 677 LYS C C 677 177.394 177.394 178.667 -1.273 19515
1004 1 7 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.287 -1.144 19515
1005 1 7 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.100 0.025 19515
1006 1 7 . 1 1 677 677 LYS H H 677 7.512 7.512 7.950 -0.438 19515
1007 1 7 . 1 1 678 678 TRP N N 678 116.945 116.945 119.959 -3.014 19515
1008 1 7 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.635 0.050 19515
1009 1 7 . 1 1 678 678 TRP C C 678 176.964 176.964 178.496 -1.532 19515
1010 1 7 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.638 -2.380 19515
1011 1 7 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.144 -0.325 19515
1012 1 7 . 1 1 678 678 TRP H H 678 7.525 7.525 8.400 -0.875 19515
1013 1 7 . 1 1 679 679 LEU N N 679 116.664 116.664 119.082 -2.418 19515
1014 1 7 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.183 -0.101 19515
1015 1 7 . 1 1 679 679 LEU C C 679 177.458 177.458 179.132 -1.674 19515
1016 1 7 . 1 1 679 679 LEU CA C 679 56.839 56.839 58.081 -1.242 19515
1017 1 7 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.407 0.505 19515
1018 1 7 . 1 1 679 679 LEU H H 679 7.786 7.786 8.518 -0.732 19515
1019 1 7 . 1 1 680 680 TRP N N 680 116.195 116.195 121.894 -5.699 19515
1020 1 7 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.322 0.035 19515
1021 1 7 . 1 1 680 680 TRP C C 680 176.394 176.394 177.415 -1.021 19515
1022 1 7 . 1 1 680 680 TRP CA C 680 58.948 58.948 61.397 -2.449 19515
1023 1 7 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.677 -0.542 19515
1024 1 7 . 1 1 680 680 TRP H H 680 7.547 7.547 8.725 -1.178 19515
1025 1 7 . 1 1 681 681 TYR N N 681 115.352 115.352 119.796 -4.444 19515
1026 1 7 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.506 -0.356 19515
1027 1 7 . 1 1 681 681 TYR C C 681 175.671 175.671 176.699 -1.028 19515
1028 1 7 . 1 1 681 681 TYR CA C 681 59.780 59.780 60.104 -0.324 19515
1029 1 7 . 1 1 681 681 TYR CB C 681 39.011 39.011 39.001 0.010 19515
1030 1 7 . 1 1 681 681 TYR H H 681 7.471 7.471 7.810 -0.339 19515
1031 1 7 . 1 1 682 682 ILE N N 682 113.570 113.570 115.334 -1.764 19515
1032 1 7 . 1 1 682 682 ILE HA H 682 4.211 4.211 3.822 0.389 19515
1033 1 7 . 1 1 682 682 ILE C C 682 174.166 174.166 176.604 -2.438 19515
1034 1 7 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.905 -0.741 19515
1035 1 7 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.701 0.168 19515
1036 1 7 . 1 1 682 682 ILE H H 682 7.471 7.471 7.480 -0.009 19515
1037 1 8 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.099 0.193 19515
1038 1 8 . 1 1 658 658 LYS C C 658 175.668 175.668 174.483 1.185 19515
1039 1 8 . 1 1 658 658 LYS CA C 658 56.747 56.747 56.561 0.186 19515
1040 1 8 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.198 0.670 19515
1041 1 8 . 1 1 659 659 ASP N N 659 120.320 120.320 120.117 0.203 19515
1042 1 8 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.814 -0.231 19515
1043 1 8 . 1 1 659 659 ASP C C 659 176.214 176.214 177.273 -1.059 19515
1044 1 8 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.590 0.752 19515
1045 1 8 . 1 1 659 659 ASP CB C 659 41.140 41.140 41.946 -0.806 19515
1046 1 8 . 1 1 659 659 ASP H H 659 8.360 8.360 8.348 0.012 19515
1047 1 8 . 1 1 660 660 LEU N N 660 121.445 121.445 124.067 -2.622 19515
1048 1 8 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.272 -0.051 19515
1049 1 8 . 1 1 660 660 LEU C C 660 177.071 177.071 178.081 -1.010 19515
1050 1 8 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.512 -0.195 19515
1051 1 8 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.340 0.158 19515
1052 1 8 . 1 1 660 660 LEU H H 660 8.388 8.388 9.013 -0.625 19515
1053 1 8 . 1 1 661 661 LEU N N 661 118.164 118.164 118.772 -0.608 19515
1054 1 8 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.624 -0.303 19515
1055 1 8 . 1 1 661 661 LEU C C 661 176.473 176.473 176.256 0.217 19515
1056 1 8 . 1 1 661 661 LEU CA C 661 54.791 54.791 53.993 0.798 19515
1057 1 8 . 1 1 661 661 LEU CB C 661 42.060 42.060 42.031 0.029 19515
1058 1 8 . 1 1 661 661 LEU H H 661 8.114 8.114 8.043 0.071 19515
1059 1 8 . 1 1 662 662 ALA N N 662 122.289 122.289 123.230 -0.941 19515
1060 1 8 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.295 0.041 19515
1061 1 8 . 1 1 662 662 ALA C C 662 177.849 177.849 178.814 -0.965 19515
1062 1 8 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.716 -0.200 19515
1063 1 8 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.877 1.336 19515
1064 1 8 . 1 1 662 662 ALA H H 662 7.936 7.936 7.504 0.432 19515
1065 1 8 . 1 1 663 663 LEU N N 663 119.570 119.570 126.586 -7.016 19515
1066 1 8 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.129 0.071 19515
1067 1 8 . 1 1 663 663 LEU C C 663 177.653 177.653 178.620 -0.967 19515
1068 1 8 . 1 1 663 663 LEU CA C 663 56.516 56.516 58.284 -1.768 19515
1069 1 8 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.952 0.080 19515
1070 1 8 . 1 1 663 663 LEU H H 663 8.210 8.210 8.386 -0.176 19515
1071 1 8 . 1 1 664 664 ASP N N 664 117.320 117.320 118.251 -0.931 19515
1072 1 8 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.516 -0.011 19515
1073 1 8 . 1 1 664 664 ASP C C 664 177.568 177.568 177.729 -0.161 19515
1074 1 8 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.743 -1.064 19515
1075 1 8 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.641 -0.173 19515
1076 1 8 . 1 1 664 664 ASP H H 664 8.360 8.360 8.561 -0.201 19515
1077 1 8 . 1 1 665 665 LYS N N 665 118.403 118.403 116.824 1.579 19515
1078 1 8 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.468 -0.280 19515
1079 1 8 . 1 1 665 665 LYS C C 665 177.428 177.428 178.675 -1.247 19515
1080 1 8 . 1 1 665 665 LYS CA C 665 57.552 57.552 56.453 1.099 19515
1081 1 8 . 1 1 665 665 LYS CB C 665 32.253 32.253 33.019 -0.766 19515
1082 1 8 . 1 1 665 665 LYS H H 665 7.957 7.957 8.388 -0.431 19515
1083 1 8 . 1 1 666 666 TRP N N 666 119.008 119.008 121.668 -2.660 19515
1084 1 8 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.429 0.089 19515
1085 1 8 . 1 1 666 666 TRP C C 666 176.614 176.614 177.797 -1.183 19515
1086 1 8 . 1 1 666 666 TRP CA C 666 58.613 58.613 60.380 -1.767 19515
1087 1 8 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.288 0.100 19515
1088 1 8 . 1 1 666 666 TRP H H 666 8.018 8.018 7.446 0.572 19515
1089 1 8 . 1 1 667 667 ASN N N 667 115.789 115.789 117.948 -2.159 19515
1090 1 8 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.552 -0.147 19515
1091 1 8 . 1 1 667 667 ASN C C 667 177.139 177.139 177.458 -0.319 19515
1092 1 8 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.430 -0.792 19515
1093 1 8 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.282 0.277 19515
1094 1 8 . 1 1 667 667 ASN H H 667 8.177 8.177 8.090 0.087 19515
1095 1 8 . 1 1 668 668 SER N N 668 114.122 114.122 114.887 -0.765 19515
1096 1 8 . 1 1 668 668 SER HA H 668 4.339 4.339 4.458 -0.119 19515
1097 1 8 . 1 1 668 668 SER C C 668 175.509 175.509 176.211 -0.702 19515
1098 1 8 . 1 1 668 668 SER CA C 668 60.480 60.480 60.848 -0.368 19515
1099 1 8 . 1 1 668 668 SER CB C 668 63.178 63.178 63.435 -0.257 19515
1100 1 8 . 1 1 668 668 SER H H 668 8.113 8.113 7.593 0.520 19515
1101 1 8 . 1 1 669 669 LEU N N 669 121.445 121.445 120.740 0.705 19515
1102 1 8 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.853 0.126 19515
1103 1 8 . 1 1 669 669 LEU C C 669 177.357 177.357 177.643 -0.286 19515
1104 1 8 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.426 0.081 19515
1105 1 8 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.006 -0.020 19515
1106 1 8 . 1 1 669 669 LEU H H 669 7.813 7.813 7.878 -0.065 19515
1107 1 8 . 1 1 670 670 TRP N N 670 115.164 115.164 118.254 -3.090 19515
1108 1 8 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.445 0.196 19515
1109 1 8 . 1 1 670 670 TRP C C 670 177.139 177.139 177.627 -0.488 19515
1110 1 8 . 1 1 670 670 TRP CA C 670 58.242 58.242 59.040 -0.798 19515
1111 1 8 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.744 -0.213 19515
1112 1 8 . 1 1 670 670 TRP H H 670 7.554 7.554 7.868 -0.314 19515
1113 1 8 . 1 1 671 671 SER N N 671 111.992 111.992 114.968 -2.976 19515
1114 1 8 . 1 1 671 671 SER HA H 671 4.396 4.396 4.506 -0.110 19515
1115 1 8 . 1 1 671 671 SER C C 671 175.159 175.159 175.567 -0.408 19515
1116 1 8 . 1 1 671 671 SER CA C 671 60.034 60.034 61.034 -1.000 19515
1117 1 8 . 1 1 671 671 SER CB C 671 63.623 63.623 63.727 -0.104 19515
1118 1 8 . 1 1 671 671 SER H H 671 7.988 7.988 7.787 0.201 19515
1119 1 8 . 1 1 672 672 TRP N N 672 120.173 120.173 117.947 2.226 19515
1120 1 8 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.898 -0.373 19515
1121 1 8 . 1 1 672 672 TRP C C 672 176.153 176.153 176.320 -0.167 19515
1122 1 8 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.582 2.055 19515
1123 1 8 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.574 0.089 19515
1124 1 8 . 1 1 672 672 TRP H H 672 7.872 7.872 6.889 0.983 19515
1125 1 8 . 1 1 673 673 PHE N N 673 117.414 117.414 121.099 -3.685 19515
1126 1 8 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.495 -0.117 19515
1127 1 8 . 1 1 673 673 PHE C C 673 174.357 174.357 174.477 -0.120 19515
1128 1 8 . 1 1 673 673 PHE CA C 673 58.139 58.139 56.691 1.448 19515
1129 1 8 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.918 0.466 19515
1130 1 8 . 1 1 673 673 PHE H H 673 7.783 7.783 7.099 0.684 19515
1131 1 8 . 1 1 674 674 ASP N N 674 120.414 120.414 119.597 0.817 19515
1132 1 8 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.839 -0.207 19515
1133 1 8 . 1 1 674 674 ASP C C 674 176.749 176.749 176.238 0.511 19515
1134 1 8 . 1 1 674 674 ASP CA C 674 53.569 53.569 53.622 -0.053 19515
1135 1 8 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.909 -0.254 19515
1136 1 8 . 1 1 674 674 ASP H H 674 7.725 7.725 7.478 0.247 19515
1137 1 8 . 1 1 675 675 ILE N N 675 120.320 120.320 123.655 -3.335 19515
1138 1 8 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.898 -0.107 19515
1139 1 8 . 1 1 675 675 ILE C C 675 176.683 176.683 177.549 -0.866 19515
1140 1 8 . 1 1 675 675 ILE CA C 675 63.208 63.208 60.929 2.279 19515
1141 1 8 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.211 1.125 19515
1142 1 8 . 1 1 675 675 ILE H H 675 8.196 8.196 8.311 -0.115 19515
1143 1 8 . 1 1 676 676 THR N N 676 111.977 111.977 113.926 -1.949 19515
1144 1 8 . 1 1 676 676 THR HA H 676 3.903 3.903 4.036 -0.133 19515
1145 1 8 . 1 1 676 676 THR C C 676 176.347 176.347 176.496 -0.149 19515
1146 1 8 . 1 1 676 676 THR CA C 676 65.643 65.643 66.493 -0.850 19515
1147 1 8 . 1 1 676 676 THR CB C 676 68.453 68.453 68.319 0.134 19515
1148 1 8 . 1 1 676 676 THR H H 676 8.114 8.114 8.349 -0.235 19515
1149 1 8 . 1 1 677 677 LYS N N 677 119.101 119.101 120.747 -1.646 19515
1150 1 8 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.139 -0.124 19515
1151 1 8 . 1 1 677 677 LYS C C 677 177.394 177.394 178.346 -0.952 19515
1152 1 8 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.190 -1.046 19515
1153 1 8 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.215 -0.090 19515
1154 1 8 . 1 1 677 677 LYS H H 677 7.512 7.512 7.970 -0.458 19515
1155 1 8 . 1 1 678 678 TRP N N 678 116.945 116.945 119.578 -2.633 19515
1156 1 8 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.529 0.156 19515
1157 1 8 . 1 1 678 678 TRP C C 678 176.964 176.964 178.927 -1.963 19515
1158 1 8 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.344 -2.086 19515
1159 1 8 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.126 -0.307 19515
1160 1 8 . 1 1 678 678 TRP H H 678 7.525 7.525 8.400 -0.875 19515
1161 1 8 . 1 1 679 679 LEU N N 679 116.664 116.664 119.862 -3.198 19515
1162 1 8 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.187 -0.105 19515
1163 1 8 . 1 1 679 679 LEU C C 679 177.458 177.458 178.957 -1.499 19515
1164 1 8 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.787 -0.948 19515
1165 1 8 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.300 0.612 19515
1166 1 8 . 1 1 679 679 LEU H H 679 7.786 7.786 8.489 -0.703 19515
1167 1 8 . 1 1 680 680 TRP N N 680 116.195 116.195 120.849 -4.654 19515
1168 1 8 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.550 -0.193 19515
1169 1 8 . 1 1 680 680 TRP C C 680 176.394 176.394 178.250 -1.856 19515
1170 1 8 . 1 1 680 680 TRP CA C 680 58.948 58.948 60.746 -1.798 19515
1171 1 8 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.655 -0.520 19515
1172 1 8 . 1 1 680 680 TRP H H 680 7.547 7.547 8.822 -1.275 19515
1173 1 8 . 1 1 681 681 TYR N N 681 115.352 115.352 118.155 -2.803 19515
1174 1 8 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.452 -0.302 19515
1175 1 8 . 1 1 681 681 TYR C C 681 175.671 175.671 176.765 -1.094 19515
1176 1 8 . 1 1 681 681 TYR CA C 681 59.780 59.780 61.017 -1.238 19515
1177 1 8 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.843 0.168 19515
1178 1 8 . 1 1 681 681 TYR H H 681 7.471 7.471 7.970 -0.498 19515
1179 1 8 . 1 1 682 682 ILE N N 682 113.570 113.570 116.364 -2.794 19515
1180 1 8 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.274 -0.063 19515
1181 1 8 . 1 1 682 682 ILE C C 682 174.166 174.166 176.838 -2.672 19515
1182 1 8 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.419 -0.255 19515
1183 1 8 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.284 0.585 19515
1184 1 8 . 1 1 682 682 ILE H H 682 7.471 7.471 7.555 -0.084 19515
1185 1 9 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.457 -0.165 19515
1186 1 9 . 1 1 658 658 LYS C C 658 175.668 175.668 175.163 0.505 19515
1187 1 9 . 1 1 658 658 LYS CA C 658 56.747 56.747 55.810 0.937 19515
1188 1 9 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.457 0.411 19515
1189 1 9 . 1 1 659 659 ASP N N 659 120.320 120.320 119.857 0.463 19515
1190 1 9 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.669 -0.086 19515
1191 1 9 . 1 1 659 659 ASP C C 659 176.214 176.214 177.982 -1.768 19515
1192 1 9 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.463 0.879 19515
1193 1 9 . 1 1 659 659 ASP CB C 659 41.140 41.140 42.161 -1.021 19515
1194 1 9 . 1 1 659 659 ASP H H 659 8.360 8.360 7.722 0.638 19515
1195 1 9 . 1 1 660 660 LEU N N 660 121.445 121.445 123.952 -2.507 19515
1196 1 9 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.176 0.045 19515
1197 1 9 . 1 1 660 660 LEU C C 660 177.071 177.071 177.718 -0.647 19515
1198 1 9 . 1 1 660 660 LEU CA C 660 56.317 56.317 57.263 -0.946 19515
1199 1 9 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.325 0.173 19515
1200 1 9 . 1 1 660 660 LEU H H 660 8.388 8.388 8.667 -0.279 19515
1201 1 9 . 1 1 661 661 LEU N N 661 118.164 118.164 118.022 0.142 19515
1202 1 9 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.588 -0.267 19515
1203 1 9 . 1 1 661 661 LEU C C 661 176.473 176.473 176.238 0.235 19515
1204 1 9 . 1 1 661 661 LEU CA C 661 54.791 54.791 53.949 0.842 19515
1205 1 9 . 1 1 661 661 LEU CB C 661 42.060 42.060 42.033 0.027 19515
1206 1 9 . 1 1 661 661 LEU H H 661 8.114 8.114 8.119 -0.005 19515
1207 1 9 . 1 1 662 662 ALA N N 662 122.289 122.289 123.473 -1.184 19515
1208 1 9 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.243 0.093 19515
1209 1 9 . 1 1 662 662 ALA C C 662 177.849 177.849 178.300 -0.451 19515
1210 1 9 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.516 -0.000 19515
1211 1 9 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.638 1.575 19515
1212 1 9 . 1 1 662 662 ALA H H 662 7.936 7.936 8.003 -0.067 19515
1213 1 9 . 1 1 663 663 LEU N N 663 119.570 119.570 126.570 -7.000 19515
1214 1 9 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.062 0.138 19515
1215 1 9 . 1 1 663 663 LEU C C 663 177.653 177.653 178.282 -0.629 19515
1216 1 9 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.676 -1.160 19515
1217 1 9 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.814 0.218 19515
1218 1 9 . 1 1 663 663 LEU H H 663 8.210 8.210 8.389 -0.179 19515
1219 1 9 . 1 1 664 664 ASP N N 664 117.320 117.320 118.620 -1.300 19515
1220 1 9 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.475 0.030 19515
1221 1 9 . 1 1 664 664 ASP C C 664 177.568 177.568 177.846 -0.278 19515
1222 1 9 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.772 -1.093 19515
1223 1 9 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.500 -0.032 19515
1224 1 9 . 1 1 664 664 ASP H H 664 8.360 8.360 8.525 -0.165 19515
1225 1 9 . 1 1 665 665 LYS N N 665 118.403 118.403 117.477 0.926 19515
1226 1 9 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.450 -0.262 19515
1227 1 9 . 1 1 665 665 LYS C C 665 177.428 177.428 178.679 -1.251 19515
1228 1 9 . 1 1 665 665 LYS CA C 665 57.552 57.552 56.711 0.841 19515
1229 1 9 . 1 1 665 665 LYS CB C 665 32.253 32.253 33.085 -0.832 19515
1230 1 9 . 1 1 665 665 LYS H H 665 7.957 7.957 8.332 -0.375 19515
1231 1 9 . 1 1 666 666 TRP N N 666 119.008 119.008 121.459 -2.451 19515
1232 1 9 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.515 0.003 19515
1233 1 9 . 1 1 666 666 TRP C C 666 176.614 176.614 177.819 -1.205 19515
1234 1 9 . 1 1 666 666 TRP CA C 666 58.613 58.613 60.499 -1.886 19515
1235 1 9 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.349 0.038 19515
1236 1 9 . 1 1 666 666 TRP H H 666 8.018 8.018 7.410 0.608 19515
1237 1 9 . 1 1 667 667 ASN N N 667 115.789 115.789 117.976 -2.187 19515
1238 1 9 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.550 -0.145 19515
1239 1 9 . 1 1 667 667 ASN C C 667 177.139 177.139 177.663 -0.524 19515
1240 1 9 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.840 -1.202 19515
1241 1 9 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.524 0.035 19515
1242 1 9 . 1 1 667 667 ASN H H 667 8.177 8.177 8.167 0.010 19515
1243 1 9 . 1 1 668 668 SER N N 668 114.122 114.122 115.001 -0.879 19515
1244 1 9 . 1 1 668 668 SER HA H 668 4.339 4.339 4.386 -0.047 19515
1245 1 9 . 1 1 668 668 SER C C 668 175.509 175.509 176.000 -0.491 19515
1246 1 9 . 1 1 668 668 SER CA C 668 60.480 60.480 61.185 -0.705 19515
1247 1 9 . 1 1 668 668 SER CB C 668 63.178 63.178 63.355 -0.177 19515
1248 1 9 . 1 1 668 668 SER H H 668 8.113 8.113 7.737 0.376 19515
1249 1 9 . 1 1 669 669 LEU N N 669 121.445 121.445 120.771 0.674 19515
1250 1 9 . 1 1 669 669 LEU HA H 669 3.979 3.979 4.021 -0.042 19515
1251 1 9 . 1 1 669 669 LEU C C 669 177.357 177.357 177.759 -0.402 19515
1252 1 9 . 1 1 669 669 LEU CA C 669 57.507 57.507 56.879 0.628 19515
1253 1 9 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.401 -0.416 19515
1254 1 9 . 1 1 669 669 LEU H H 669 7.813 7.813 7.775 0.038 19515
1255 1 9 . 1 1 670 670 TRP N N 670 115.164 115.164 119.931 -4.767 19515
1256 1 9 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.399 0.242 19515
1257 1 9 . 1 1 670 670 TRP C C 670 177.139 177.139 176.463 0.676 19515
1258 1 9 . 1 1 670 670 TRP CA C 670 58.242 58.242 59.057 -0.815 19515
1259 1 9 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.732 -0.201 19515
1260 1 9 . 1 1 670 670 TRP H H 670 7.554 7.554 8.739 -1.185 19515
1261 1 9 . 1 1 671 671 SER N N 671 111.992 111.992 115.621 -3.629 19515
1262 1 9 . 1 1 671 671 SER HA H 671 4.396 4.396 3.973 0.423 19515
1263 1 9 . 1 1 671 671 SER C C 671 175.159 175.159 175.473 -0.314 19515
1264 1 9 . 1 1 671 671 SER CA C 671 60.034 60.034 60.139 -0.104 19515
1265 1 9 . 1 1 671 671 SER CB C 671 63.623 63.623 63.525 0.098 19515
1266 1 9 . 1 1 671 671 SER H H 671 7.988 7.988 7.542 0.446 19515
1267 1 9 . 1 1 672 672 TRP N N 672 120.173 120.173 118.633 1.540 19515
1268 1 9 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.808 -0.283 19515
1269 1 9 . 1 1 672 672 TRP C C 672 176.153 176.153 176.346 -0.193 19515
1270 1 9 . 1 1 672 672 TRP CA C 672 58.637 58.637 55.967 2.671 19515
1271 1 9 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.840 -0.177 19515
1272 1 9 . 1 1 672 672 TRP H H 672 7.872 7.872 6.835 1.037 19515
1273 1 9 . 1 1 673 673 PHE N N 673 117.414 117.414 121.227 -3.813 19515
1274 1 9 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.515 -0.137 19515
1275 1 9 . 1 1 673 673 PHE C C 673 174.357 174.357 174.524 -0.167 19515
1276 1 9 . 1 1 673 673 PHE CA C 673 58.139 58.139 57.220 0.919 19515
1277 1 9 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.905 0.479 19515
1278 1 9 . 1 1 673 673 PHE H H 673 7.783 7.783 7.093 0.690 19515
1279 1 9 . 1 1 674 674 ASP N N 674 120.414 120.414 121.152 -0.738 19515
1280 1 9 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.626 0.006 19515
1281 1 9 . 1 1 674 674 ASP C C 674 176.749 176.749 176.632 0.117 19515
1282 1 9 . 1 1 674 674 ASP CA C 674 53.569 53.569 53.394 0.175 19515
1283 1 9 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.100 0.555 19515
1284 1 9 . 1 1 674 674 ASP H H 674 7.725 7.725 7.388 0.337 19515
1285 1 9 . 1 1 675 675 ILE N N 675 120.320 120.320 126.574 -6.254 19515
1286 1 9 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.892 -0.101 19515
1287 1 9 . 1 1 675 675 ILE C C 675 176.683 176.683 177.246 -0.563 19515
1288 1 9 . 1 1 675 675 ILE CA C 675 63.208 63.208 61.219 1.989 19515
1289 1 9 . 1 1 675 675 ILE CB C 675 38.336 38.336 38.041 0.295 19515
1290 1 9 . 1 1 675 675 ILE H H 675 8.196 8.196 8.026 0.170 19515
1291 1 9 . 1 1 676 676 THR N N 676 111.977 111.977 115.917 -3.940 19515
1292 1 9 . 1 1 676 676 THR HA H 676 3.903 3.903 4.042 -0.139 19515
1293 1 9 . 1 1 676 676 THR C C 676 176.347 176.347 176.447 -0.100 19515
1294 1 9 . 1 1 676 676 THR CA C 676 65.643 65.643 66.975 -1.331 19515
1295 1 9 . 1 1 676 676 THR CB C 676 68.453 68.453 68.870 -0.417 19515
1296 1 9 . 1 1 676 676 THR H H 676 8.114 8.114 8.407 -0.293 19515
1297 1 9 . 1 1 677 677 LYS N N 677 119.101 119.101 120.225 -1.124 19515
1298 1 9 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.144 -0.129 19515
1299 1 9 . 1 1 677 677 LYS C C 677 177.394 177.394 179.000 -1.606 19515
1300 1 9 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.386 -1.243 19515
1301 1 9 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.320 -0.195 19515
1302 1 9 . 1 1 677 677 LYS H H 677 7.512 7.512 8.014 -0.502 19515
1303 1 9 . 1 1 678 678 TRP N N 678 116.945 116.945 119.928 -2.983 19515
1304 1 9 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.652 0.033 19515
1305 1 9 . 1 1 678 678 TRP C C 678 176.964 176.964 178.440 -1.476 19515
1306 1 9 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.739 -2.481 19515
1307 1 9 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.297 -0.478 19515
1308 1 9 . 1 1 678 678 TRP H H 678 7.525 7.525 8.289 -0.764 19515
1309 1 9 . 1 1 679 679 LEU N N 679 116.664 116.664 118.828 -2.164 19515
1310 1 9 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.278 -0.196 19515
1311 1 9 . 1 1 679 679 LEU C C 679 177.458 177.458 179.053 -1.595 19515
1312 1 9 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.549 -0.710 19515
1313 1 9 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.849 0.063 19515
1314 1 9 . 1 1 679 679 LEU H H 679 7.786 7.786 8.375 -0.589 19515
1315 1 9 . 1 1 680 680 TRP N N 680 116.195 116.195 121.687 -5.492 19515
1316 1 9 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.284 0.073 19515
1317 1 9 . 1 1 680 680 TRP C C 680 176.394 176.394 177.713 -1.319 19515
1318 1 9 . 1 1 680 680 TRP CA C 680 58.948 58.948 61.393 -2.445 19515
1319 1 9 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.775 -0.640 19515
1320 1 9 . 1 1 680 680 TRP H H 680 7.547 7.547 9.102 -1.555 19515
1321 1 9 . 1 1 681 681 TYR N N 681 115.352 115.352 117.504 -2.152 19515
1322 1 9 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.412 -0.262 19515
1323 1 9 . 1 1 681 681 TYR C C 681 175.671 175.671 176.814 -1.143 19515
1324 1 9 . 1 1 681 681 TYR CA C 681 59.780 59.780 61.071 -1.291 19515
1325 1 9 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.748 0.263 19515
1326 1 9 . 1 1 681 681 TYR H H 681 7.471 7.471 7.954 -0.483 19515
1327 1 9 . 1 1 682 682 ILE N N 682 113.570 113.570 116.907 -3.337 19515
1328 1 9 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.222 -0.011 19515
1329 1 9 . 1 1 682 682 ILE C C 682 174.166 174.166 176.782 -2.616 19515
1330 1 9 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.823 -0.659 19515
1331 1 9 . 1 1 682 682 ILE CB C 682 38.869 38.869 37.829 1.040 19515
1332 1 9 . 1 1 682 682 ILE H H 682 7.471 7.471 7.621 -0.150 19515
1333 1 10 . 1 1 658 658 LYS HA H 658 4.292 4.292 4.006 0.286 19515
1334 1 10 . 1 1 658 658 LYS C C 658 175.668 175.668 174.837 0.831 19515
1335 1 10 . 1 1 658 658 LYS CA C 658 56.747 56.747 56.686 0.061 19515
1336 1 10 . 1 1 658 658 LYS CB C 658 32.868 32.868 31.744 1.124 19515
1337 1 10 . 1 1 659 659 ASP N N 659 120.320 120.320 118.070 2.250 19515
1338 1 10 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.680 -0.097 19515
1339 1 10 . 1 1 659 659 ASP C C 659 176.214 176.214 177.957 -1.743 19515
1340 1 10 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.208 1.134 19515
1341 1 10 . 1 1 659 659 ASP CB C 659 41.140 41.140 42.094 -0.954 19515
1342 1 10 . 1 1 659 659 ASP H H 659 8.360 8.360 8.025 0.334 19515
1343 1 10 . 1 1 660 660 LEU N N 660 121.445 121.445 123.944 -2.499 19515
1344 1 10 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.077 0.144 19515
1345 1 10 . 1 1 660 660 LEU C C 660 177.071 177.071 177.974 -0.903 19515
1346 1 10 . 1 1 660 660 LEU CA C 660 56.317 56.317 57.000 -0.683 19515
1347 1 10 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.294 0.204 19515
1348 1 10 . 1 1 660 660 LEU H H 660 8.388 8.388 8.855 -0.467 19515
1349 1 10 . 1 1 661 661 LEU N N 661 118.164 118.164 117.615 0.549 19515
1350 1 10 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.697 -0.376 19515
1351 1 10 . 1 1 661 661 LEU C C 661 176.473 176.473 176.184 0.289 19515
1352 1 10 . 1 1 661 661 LEU CA C 661 54.791 54.791 53.911 0.880 19515
1353 1 10 . 1 1 661 661 LEU CB C 661 42.060 42.060 42.489 -0.428 19515
1354 1 10 . 1 1 661 661 LEU H H 661 8.114 8.114 8.088 0.026 19515
1355 1 10 . 1 1 662 662 ALA N N 662 122.289 122.289 123.355 -1.066 19515
1356 1 10 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.272 0.064 19515
1357 1 10 . 1 1 662 662 ALA C C 662 177.849 177.849 178.422 -0.573 19515
1358 1 10 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.455 0.061 19515
1359 1 10 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.651 1.562 19515
1360 1 10 . 1 1 662 662 ALA H H 662 7.936 7.936 7.833 0.103 19515
1361 1 10 . 1 1 663 663 LEU N N 663 119.570 119.570 126.071 -6.501 19515
1362 1 10 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.127 0.073 19515
1363 1 10 . 1 1 663 663 LEU C C 663 177.653 177.653 178.203 -0.550 19515
1364 1 10 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.665 -1.149 19515
1365 1 10 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.862 0.170 19515
1366 1 10 . 1 1 663 663 LEU H H 663 8.210 8.210 8.199 0.011 19515
1367 1 10 . 1 1 664 664 ASP N N 664 117.320 117.320 117.860 -0.540 19515
1368 1 10 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.503 0.002 19515
1369 1 10 . 1 1 664 664 ASP C C 664 177.568 177.568 177.267 0.301 19515
1370 1 10 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.700 -1.022 19515
1371 1 10 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.581 -0.113 19515
1372 1 10 . 1 1 664 664 ASP H H 664 8.360 8.360 8.377 -0.017 19515
1373 1 10 . 1 1 665 665 LYS N N 665 118.403 118.403 119.272 -0.869 19515
1374 1 10 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.412 -0.224 19515
1375 1 10 . 1 1 665 665 LYS C C 665 177.428 177.428 178.323 -0.895 19515
1376 1 10 . 1 1 665 665 LYS CA C 665 57.552 57.552 56.890 0.662 19515
1377 1 10 . 1 1 665 665 LYS CB C 665 32.253 32.253 32.733 -0.480 19515
1378 1 10 . 1 1 665 665 LYS H H 665 7.957 7.957 8.330 -0.373 19515
1379 1 10 . 1 1 666 666 TRP N N 666 119.008 119.008 121.859 -2.851 19515
1380 1 10 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.354 0.164 19515
1381 1 10 . 1 1 666 666 TRP C C 666 176.614 176.614 177.555 -0.941 19515
1382 1 10 . 1 1 666 666 TRP CA C 666 58.613 58.613 61.005 -2.393 19515
1383 1 10 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.309 0.079 19515
1384 1 10 . 1 1 666 666 TRP H H 666 8.018 8.018 7.885 0.133 19515
1385 1 10 . 1 1 667 667 ASN N N 667 115.789 115.789 118.177 -2.388 19515
1386 1 10 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.587 -0.182 19515
1387 1 10 . 1 1 667 667 ASN C C 667 177.139 177.139 177.301 -0.162 19515
1388 1 10 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.672 -1.034 19515
1389 1 10 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.446 0.113 19515
1390 1 10 . 1 1 667 667 ASN H H 667 8.177 8.177 8.168 0.009 19515
1391 1 10 . 1 1 668 668 SER N N 668 114.122 114.122 115.064 -0.942 19515
1392 1 10 . 1 1 668 668 SER HA H 668 4.339 4.339 4.432 -0.093 19515
1393 1 10 . 1 1 668 668 SER C C 668 175.509 175.509 175.893 -0.384 19515
1394 1 10 . 1 1 668 668 SER CA C 668 60.480 60.480 61.251 -0.771 19515
1395 1 10 . 1 1 668 668 SER CB C 668 63.178 63.178 63.487 -0.309 19515
1396 1 10 . 1 1 668 668 SER H H 668 8.113 8.113 7.647 0.466 19515
1397 1 10 . 1 1 669 669 LEU N N 669 121.445 121.445 120.760 0.685 19515
1398 1 10 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.785 0.194 19515
1399 1 10 . 1 1 669 669 LEU C C 669 177.357 177.357 177.470 -0.113 19515
1400 1 10 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.100 0.407 19515
1401 1 10 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.053 -0.067 19515
1402 1 10 . 1 1 669 669 LEU H H 669 7.813 7.813 7.916 -0.103 19515
1403 1 10 . 1 1 670 670 TRP N N 670 115.164 115.164 118.181 -3.017 19515
1404 1 10 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.444 0.197 19515
1405 1 10 . 1 1 670 670 TRP C C 670 177.139 177.139 177.403 -0.264 19515
1406 1 10 . 1 1 670 670 TRP CA C 670 58.242 58.242 59.011 -0.769 19515
1407 1 10 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.698 -0.167 19515
1408 1 10 . 1 1 670 670 TRP H H 670 7.554 7.554 7.878 -0.324 19515
1409 1 10 . 1 1 671 671 SER N N 671 111.992 111.992 114.376 -2.384 19515
1410 1 10 . 1 1 671 671 SER HA H 671 4.396 4.396 4.507 -0.111 19515
1411 1 10 . 1 1 671 671 SER C C 671 175.159 175.159 175.477 -0.318 19515
1412 1 10 . 1 1 671 671 SER CA C 671 60.034 60.034 61.111 -1.077 19515
1413 1 10 . 1 1 671 671 SER CB C 671 63.623 63.623 63.847 -0.224 19515
1414 1 10 . 1 1 671 671 SER H H 671 7.988 7.988 7.791 0.197 19515
1415 1 10 . 1 1 672 672 TRP N N 672 120.173 120.173 117.635 2.538 19515
1416 1 10 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.924 -0.399 19515
1417 1 10 . 1 1 672 672 TRP C C 672 176.153 176.153 176.467 -0.314 19515
1418 1 10 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.478 2.159 19515
1419 1 10 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.616 0.047 19515
1420 1 10 . 1 1 672 672 TRP H H 672 7.872 7.872 6.979 0.893 19515
1421 1 10 . 1 1 673 673 PHE N N 673 117.414 117.414 122.695 -5.281 19515
1422 1 10 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.521 -0.143 19515
1423 1 10 . 1 1 673 673 PHE C C 673 174.357 174.357 174.101 0.256 19515
1424 1 10 . 1 1 673 673 PHE CA C 673 58.139 58.139 56.092 2.047 19515
1425 1 10 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.157 1.227 19515
1426 1 10 . 1 1 673 673 PHE H H 673 7.783 7.783 7.173 0.610 19515
1427 1 10 . 1 1 674 674 ASP N N 674 120.414 120.414 119.597 0.817 19515
1428 1 10 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.808 -0.176 19515
1429 1 10 . 1 1 674 674 ASP C C 674 176.749 176.749 176.227 0.522 19515
1430 1 10 . 1 1 674 674 ASP CA C 674 53.569 53.569 53.550 0.020 19515
1431 1 10 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.827 -0.172 19515
1432 1 10 . 1 1 674 674 ASP H H 674 7.725 7.725 7.484 0.241 19515
1433 1 10 . 1 1 675 675 ILE N N 675 120.320 120.320 123.478 -3.158 19515
1434 1 10 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.911 -0.120 19515
1435 1 10 . 1 1 675 675 ILE C C 675 176.683 176.683 177.722 -1.039 19515
1436 1 10 . 1 1 675 675 ILE CA C 675 63.208 63.208 60.431 2.777 19515
1437 1 10 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.285 1.051 19515
1438 1 10 . 1 1 675 675 ILE H H 675 8.196 8.196 8.338 -0.142 19515
1439 1 10 . 1 1 676 676 THR N N 676 111.977 111.977 115.971 -3.994 19515
1440 1 10 . 1 1 676 676 THR HA H 676 3.903 3.903 4.054 -0.151 19515
1441 1 10 . 1 1 676 676 THR C C 676 176.347 176.347 176.271 0.076 19515
1442 1 10 . 1 1 676 676 THR CA C 676 65.643 65.643 66.435 -0.792 19515
1443 1 10 . 1 1 676 676 THR CB C 676 68.453 68.453 68.826 -0.373 19515
1444 1 10 . 1 1 676 676 THR H H 676 8.114 8.114 8.370 -0.256 19515
1445 1 10 . 1 1 677 677 LYS N N 677 119.101 119.101 119.987 -0.886 19515
1446 1 10 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.178 -0.163 19515
1447 1 10 . 1 1 677 677 LYS C C 677 177.394 177.394 178.747 -1.353 19515
1448 1 10 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.312 -1.169 19515
1449 1 10 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.295 -0.170 19515
1450 1 10 . 1 1 677 677 LYS H H 677 7.512 7.512 8.152 -0.640 19515
1451 1 10 . 1 1 678 678 TRP N N 678 116.945 116.945 119.591 -2.646 19515
1452 1 10 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.568 0.117 19515
1453 1 10 . 1 1 678 678 TRP C C 678 176.964 176.964 178.958 -1.994 19515
1454 1 10 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.380 -2.122 19515
1455 1 10 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.132 -0.313 19515
1456 1 10 . 1 1 678 678 TRP H H 678 7.525 7.525 8.393 -0.868 19515
1457 1 10 . 1 1 679 679 LEU N N 679 116.664 116.664 119.914 -3.250 19515
1458 1 10 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.188 -0.106 19515
1459 1 10 . 1 1 679 679 LEU C C 679 177.458 177.458 178.934 -1.476 19515
1460 1 10 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.796 -0.957 19515
1461 1 10 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.295 0.617 19515
1462 1 10 . 1 1 679 679 LEU H H 679 7.786 7.786 8.562 -0.776 19515
1463 1 10 . 1 1 680 680 TRP N N 680 116.195 116.195 120.970 -4.775 19515
1464 1 10 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.522 -0.165 19515
1465 1 10 . 1 1 680 680 TRP C C 680 176.394 176.394 178.232 -1.838 19515
1466 1 10 . 1 1 680 680 TRP CA C 680 58.948 58.948 60.808 -1.860 19515
1467 1 10 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.631 -0.496 19515
1468 1 10 . 1 1 680 680 TRP H H 680 7.547 7.547 8.895 -1.348 19515
1469 1 10 . 1 1 681 681 TYR N N 681 115.352 115.352 118.266 -2.914 19515
1470 1 10 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.429 -0.279 19515
1471 1 10 . 1 1 681 681 TYR C C 681 175.671 175.671 176.776 -1.105 19515
1472 1 10 . 1 1 681 681 TYR CA C 681 59.780 59.780 61.065 -1.285 19515
1473 1 10 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.920 0.091 19515
1474 1 10 . 1 1 681 681 TYR H H 681 7.471 7.471 7.963 -0.492 19515
1475 1 10 . 1 1 682 682 ILE N N 682 113.570 113.570 116.636 -3.066 19515
1476 1 10 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.266 -0.055 19515
1477 1 10 . 1 1 682 682 ILE C C 682 174.166 174.166 176.684 -2.518 19515
1478 1 10 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.483 -0.319 19515
1479 1 10 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.276 0.593 19515
1480 1 10 . 1 1 682 682 ILE H H 682 7.471 7.471 7.635 -0.164 19515
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 3.172 2.434 2.078 19515
2 1 1 "Average Difference" HA 25 0.180 0.109 0.147 19515
3 1 1 "Average Difference" C 25 1.082 0.817 0.723 19515
4 1 1 "Average Difference" CA 25 1.254 0.403 1.212 19515
5 1 1 "Average Difference" CB 25 0.563 -0.026 0.574 19515
6 1 1 "Average Difference" HN 24 0.559 0.157 0.548 19515
7 1 2 "Average Difference" N 24 2.829 2.067 1.972 19515
8 1 2 "Average Difference" HA 25 0.179 0.105 0.148 19515
9 1 2 "Average Difference" C 25 1.099 0.783 0.787 19515
10 1 2 "Average Difference" CA 25 1.212 0.309 1.196 19515
11 1 2 "Average Difference" CB 25 0.615 -0.076 0.623 19515
12 1 2 "Average Difference" HN 24 0.495 0.094 0.497 19515
13 1 3 "Average Difference" N 24 2.885 2.003 2.121 19515
14 1 3 "Average Difference" HA 25 0.195 0.117 0.159 19515
15 1 3 "Average Difference" C 25 1.034 0.742 0.736 19515
16 1 3 "Average Difference" CA 25 1.143 0.238 1.141 19515
17 1 3 "Average Difference" CB 25 0.600 -0.093 0.605 19515
18 1 3 "Average Difference" HN 24 0.530 0.080 0.535 19515
19 1 4 "Average Difference" N 24 2.952 2.288 1.906 19515
20 1 4 "Average Difference" HA 25 0.171 0.044 0.168 19515
21 1 4 "Average Difference" C 25 1.031 0.764 0.707 19515
22 1 4 "Average Difference" CA 25 1.108 0.292 1.091 19515
23 1 4 "Average Difference" CB 25 0.581 -0.100 0.585 19515
24 1 4 "Average Difference" HN 24 0.528 0.104 0.529 19515
25 1 5 "Average Difference" N 24 2.575 1.898 1.777 19515
26 1 5 "Average Difference" HA 25 0.175 0.087 0.156 19515
27 1 5 "Average Difference" C 25 1.028 0.716 0.753 19515
28 1 5 "Average Difference" CA 25 1.263 0.383 1.228 19515
29 1 5 "Average Difference" CB 25 0.523 -0.154 0.511 19515
30 1 5 "Average Difference" HN 24 0.492 0.125 0.486 19515
31 1 6 "Average Difference" N 24 2.821 2.010 2.022 19515
32 1 6 "Average Difference" HA 25 0.168 0.089 0.145 19515
33 1 6 "Average Difference" C 25 1.028 0.645 0.817 19515
34 1 6 "Average Difference" CA 25 1.290 0.364 1.263 19515
35 1 6 "Average Difference" CB 25 0.569 -0.078 0.576 19515
36 1 6 "Average Difference" HN 24 0.551 0.078 0.557 19515
37 1 7 "Average Difference" N 24 2.887 2.026 2.101 19515
38 1 7 "Average Difference" HA 25 0.210 0.090 0.193 19515
39 1 7 "Average Difference" C 25 1.000 0.646 0.778 19515
40 1 7 "Average Difference" CA 25 1.241 0.360 1.213 19515
41 1 7 "Average Difference" CB 25 0.576 -0.004 0.587 19515
42 1 7 "Average Difference" HN 24 0.492 0.096 0.493 19515
43 1 8 "Average Difference" N 24 2.764 1.872 2.076 19515
44 1 8 "Average Difference" HA 25 0.177 0.084 0.160 19515
45 1 8 "Average Difference" C 25 1.084 0.729 0.819 19515
46 1 8 "Average Difference" CA 25 1.195 0.301 1.181 19515
47 1 8 "Average Difference" CB 25 0.507 -0.093 0.509 19515
48 1 8 "Average Difference" HN 24 0.521 0.094 0.523 19515
49 1 9 "Average Difference" N 24 3.164 2.257 2.265 19515
50 1 9 "Average Difference" HA 25 0.170 0.047 0.167 19515
51 1 9 "Average Difference" C 25 1.027 0.688 0.778 19515
52 1 9 "Average Difference" CA 25 1.313 0.328 1.298 19515
53 1 9 "Average Difference" CB 25 0.543 -0.027 0.554 19515
54 1 9 "Average Difference" HN 24 0.593 0.093 0.598 19515
55 1 10 "Average Difference" N 24 2.930 1.925 2.256 19515
56 1 10 "Average Difference" HA 25 0.187 0.064 0.180 19515
57 1 10 "Average Difference" C 25 1.055 0.648 0.850 19515
58 1 10 "Average Difference" CA 25 1.324 0.288 1.319 19515
59 1 10 "Average Difference" CB 25 0.607 -0.104 0.610 19515
60 1 10 "Average Difference" HN 24 0.501 0.123 0.497 19515
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 19515
_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 4.292 4.292 4.372 -0.080 19515
2 1 . 1 1 658 658 LYS C C 658 175.668 175.668 175.009 0.659 19515
3 1 . 1 1 658 658 LYS CA C 658 56.747 56.747 56.158 0.589 19515
4 1 . 1 1 658 658 LYS CB C 658 32.868 32.868 32.680 0.188 19515
5 1 . 1 1 659 659 ASP N N 659 120.320 120.320 121.445 -1.125 19515
6 1 . 1 1 659 659 ASP HA H 659 4.583 4.583 4.771 -0.189 19515
7 1 . 1 1 659 659 ASP C C 659 176.214 176.214 177.183 -0.969 19515
8 1 . 1 1 659 659 ASP CA C 659 54.342 54.342 53.711 0.631 19515
9 1 . 1 1 659 659 ASP CB C 659 41.140 41.140 42.144 -1.004 19515
10 1 . 1 1 659 659 ASP H H 659 8.360 8.360 8.295 0.065 19515
11 1 . 1 1 660 660 LEU N N 660 121.445 121.445 123.722 -2.277 19515
12 1 . 1 1 660 660 LEU HA H 660 4.221 4.221 4.264 -0.043 19515
13 1 . 1 1 660 660 LEU C C 660 177.071 177.071 177.895 -0.824 19515
14 1 . 1 1 660 660 LEU CA C 660 56.317 56.317 56.660 -0.343 19515
15 1 . 1 1 660 660 LEU CB C 660 42.498 42.498 42.380 0.118 19515
16 1 . 1 1 660 660 LEU H H 660 8.388 8.388 8.802 -0.414 19515
17 1 . 1 1 661 661 LEU N N 661 118.164 118.164 118.640 -0.475 19515
18 1 . 1 1 661 661 LEU HA H 661 4.321 4.321 4.630 -0.309 19515
19 1 . 1 1 661 661 LEU C C 661 176.473 176.473 176.312 0.161 19515
20 1 . 1 1 661 661 LEU CA C 661 54.791 54.791 54.105 0.686 19515
21 1 . 1 1 661 661 LEU CB C 661 42.060 42.060 42.061 -0.000 19515
22 1 . 1 1 661 661 LEU H H 661 8.114 8.114 8.012 0.102 19515
23 1 . 1 1 662 662 ALA N N 662 122.289 122.289 123.161 -0.872 19515
24 1 . 1 1 662 662 ALA HA H 662 4.336 4.336 4.278 0.058 19515
25 1 . 1 1 662 662 ALA C C 662 177.849 177.849 178.675 -0.826 19515
26 1 . 1 1 662 662 ALA CA C 662 52.516 52.516 52.591 -0.076 19515
27 1 . 1 1 662 662 ALA CB C 662 19.213 19.213 17.664 1.549 19515
28 1 . 1 1 662 662 ALA H H 662 7.936 7.936 7.671 0.265 19515
29 1 . 1 1 663 663 LEU N N 663 119.570 119.570 126.253 -6.683 19515
30 1 . 1 1 663 663 LEU HA H 663 4.200 4.200 4.129 0.071 19515
31 1 . 1 1 663 663 LEU C C 663 177.653 177.653 178.299 -0.646 19515
32 1 . 1 1 663 663 LEU CA C 663 56.516 56.516 57.863 -1.347 19515
33 1 . 1 1 663 663 LEU CB C 663 42.032 42.032 41.823 0.209 19515
34 1 . 1 1 663 663 LEU H H 663 8.210 8.210 8.337 -0.127 19515
35 1 . 1 1 664 664 ASP N N 664 117.320 117.320 117.685 -0.365 19515
36 1 . 1 1 664 664 ASP HA H 664 4.505 4.505 4.475 0.031 19515
37 1 . 1 1 664 664 ASP C C 664 177.568 177.568 177.701 -0.133 19515
38 1 . 1 1 664 664 ASP CA C 664 55.679 55.679 56.687 -1.008 19515
39 1 . 1 1 664 664 ASP CB C 664 40.468 40.468 40.463 0.005 19515
40 1 . 1 1 664 664 ASP H H 664 8.360 8.360 8.574 -0.214 19515
41 1 . 1 1 665 665 LYS N N 665 118.403 118.403 117.699 0.704 19515
42 1 . 1 1 665 665 LYS HA H 665 4.188 4.188 4.452 -0.264 19515
43 1 . 1 1 665 665 LYS C C 665 177.428 177.428 178.521 -1.093 19515
44 1 . 1 1 665 665 LYS CA C 665 57.552 57.552 56.835 0.717 19515
45 1 . 1 1 665 665 LYS CB C 665 32.253 32.253 33.037 -0.784 19515
46 1 . 1 1 665 665 LYS H H 665 7.957 7.957 8.262 -0.305 19515
47 1 . 1 1 666 666 TRP N N 666 119.008 119.008 121.521 -2.513 19515
48 1 . 1 1 666 666 TRP HA H 666 4.518 4.518 4.390 0.128 19515
49 1 . 1 1 666 666 TRP C C 666 176.614 176.614 177.773 -1.159 19515
50 1 . 1 1 666 666 TRP CA C 666 58.613 58.613 60.631 -2.018 19515
51 1 . 1 1 666 666 TRP CB C 666 29.388 29.388 29.325 0.063 19515
52 1 . 1 1 666 666 TRP H H 666 8.018 8.018 7.559 0.459 19515
53 1 . 1 1 667 667 ASN N N 667 115.789 115.789 118.001 -2.212 19515
54 1 . 1 1 667 667 ASN HA H 667 4.405 4.405 4.544 -0.139 19515
55 1 . 1 1 667 667 ASN C C 667 177.139 177.139 177.459 -0.320 19515
56 1 . 1 1 667 667 ASN CA C 667 55.638 55.638 56.673 -1.035 19515
57 1 . 1 1 667 667 ASN CB C 667 38.559 38.559 38.426 0.133 19515
58 1 . 1 1 667 667 ASN H H 667 8.177 8.177 8.106 0.071 19515
59 1 . 1 1 668 668 SER N N 668 114.122 114.122 115.028 -0.906 19515
60 1 . 1 1 668 668 SER HA H 668 4.339 4.339 4.433 -0.093 19515
61 1 . 1 1 668 668 SER C C 668 175.509 175.509 176.148 -0.639 19515
62 1 . 1 1 668 668 SER CA C 668 60.480 60.480 61.093 -0.613 19515
63 1 . 1 1 668 668 SER CB C 668 63.178 63.178 63.425 -0.247 19515
64 1 . 1 1 668 668 SER H H 668 8.113 8.113 7.641 0.472 19515
65 1 . 1 1 669 669 LEU N N 669 121.445 121.445 121.094 0.351 19515
66 1 . 1 1 669 669 LEU HA H 669 3.979 3.979 3.872 0.107 19515
67 1 . 1 1 669 669 LEU C C 669 177.357 177.357 177.596 -0.239 19515
68 1 . 1 1 669 669 LEU CA C 669 57.507 57.507 57.289 0.218 19515
69 1 . 1 1 669 669 LEU CB C 669 41.986 41.986 42.044 -0.058 19515
70 1 . 1 1 669 669 LEU H H 669 7.813 7.813 7.898 -0.085 19515
71 1 . 1 1 670 670 TRP N N 670 115.164 115.164 117.927 -2.763 19515
72 1 . 1 1 670 670 TRP HA H 670 4.641 4.641 4.446 0.195 19515
73 1 . 1 1 670 670 TRP C C 670 177.139 177.139 177.316 -0.177 19515
74 1 . 1 1 670 670 TRP CA C 670 58.242 58.242 58.899 -0.657 19515
75 1 . 1 1 670 670 TRP CB C 670 29.531 29.531 29.666 -0.135 19515
76 1 . 1 1 670 670 TRP H H 670 7.554 7.554 7.898 -0.344 19515
77 1 . 1 1 671 671 SER N N 671 111.992 111.992 114.552 -2.560 19515
78 1 . 1 1 671 671 SER HA H 671 4.396 4.396 4.463 -0.067 19515
79 1 . 1 1 671 671 SER C C 671 175.159 175.159 175.539 -0.380 19515
80 1 . 1 1 671 671 SER CA C 671 60.034 60.034 60.734 -0.700 19515
81 1 . 1 1 671 671 SER CB C 671 63.623 63.623 63.733 -0.110 19515
82 1 . 1 1 671 671 SER H H 671 7.988 7.988 7.755 0.233 19515
83 1 . 1 1 672 672 TRP N N 672 120.173 120.173 118.322 1.850 19515
84 1 . 1 1 672 672 TRP HA H 672 4.525 4.525 4.870 -0.345 19515
85 1 . 1 1 672 672 TRP C C 672 176.153 176.153 176.440 -0.286 19515
86 1 . 1 1 672 672 TRP CA C 672 58.637 58.637 56.486 2.151 19515
87 1 . 1 1 672 672 TRP CB C 672 29.663 29.663 29.569 0.094 19515
88 1 . 1 1 672 672 TRP H H 672 7.872 7.872 6.964 0.908 19515
89 1 . 1 1 673 673 PHE N N 673 117.414 117.414 121.173 -3.759 19515
90 1 . 1 1 673 673 PHE HA H 673 4.378 4.378 4.509 -0.131 19515
91 1 . 1 1 673 673 PHE C C 673 174.357 174.357 174.525 -0.168 19515
92 1 . 1 1 673 673 PHE CA C 673 58.139 58.139 56.811 1.328 19515
93 1 . 1 1 673 673 PHE CB C 673 39.384 39.384 38.658 0.726 19515
94 1 . 1 1 673 673 PHE H H 673 7.783 7.783 7.076 0.707 19515
95 1 . 1 1 674 674 ASP N N 674 120.414 120.414 121.123 -0.709 19515
96 1 . 1 1 674 674 ASP HA H 674 4.632 4.632 4.814 -0.182 19515
97 1 . 1 1 674 674 ASP C C 674 176.749 176.749 176.443 0.306 19515
98 1 . 1 1 674 674 ASP CA C 674 53.569 53.569 53.812 -0.243 19515
99 1 . 1 1 674 674 ASP CB C 674 40.655 40.655 40.641 0.014 19515
100 1 . 1 1 674 674 ASP H H 674 7.725 7.725 7.627 0.098 19515
101 1 . 1 1 675 675 ILE N N 675 120.320 120.320 124.968 -4.647 19515
102 1 . 1 1 675 675 ILE HA H 675 3.791 3.791 3.934 -0.143 19515
103 1 . 1 1 675 675 ILE C C 675 176.683 176.683 177.767 -1.084 19515
104 1 . 1 1 675 675 ILE CA C 675 63.208 63.208 61.017 2.191 19515
105 1 . 1 1 675 675 ILE CB C 675 38.336 38.336 37.353 0.983 19515
106 1 . 1 1 675 675 ILE H H 675 8.196 8.196 8.251 -0.055 19515
107 1 . 1 1 676 676 THR N N 676 111.977 111.977 114.961 -2.984 19515
108 1 . 1 1 676 676 THR HA H 676 3.903 3.903 4.025 -0.122 19515
109 1 . 1 1 676 676 THR C C 676 176.347 176.347 176.538 -0.191 19515
110 1 . 1 1 676 676 THR CA C 676 65.643 65.643 66.411 -0.768 19515
111 1 . 1 1 676 676 THR CB C 676 68.453 68.453 68.541 -0.088 19515
112 1 . 1 1 676 676 THR H H 676 8.114 8.114 8.358 -0.244 19515
113 1 . 1 1 677 677 LYS N N 677 119.101 119.101 120.550 -1.449 19515
114 1 . 1 1 677 677 LYS HA H 677 4.015 4.015 4.161 -0.146 19515
115 1 . 1 1 677 677 LYS C C 677 177.394 177.394 178.693 -1.299 19515
116 1 . 1 1 677 677 LYS CA C 677 58.143 58.143 59.283 -1.140 19515
117 1 . 1 1 677 677 LYS CB C 677 32.125 32.125 32.237 -0.112 19515
118 1 . 1 1 677 677 LYS H H 677 7.512 7.512 8.072 -0.560 19515
119 1 . 1 1 678 678 TRP N N 678 116.945 116.945 119.686 -2.741 19515
120 1 . 1 1 678 678 TRP HA H 678 4.685 4.685 4.619 0.066 19515
121 1 . 1 1 678 678 TRP C C 678 176.964 176.964 178.869 -1.905 19515
122 1 . 1 1 678 678 TRP CA C 678 58.258 58.258 60.460 -2.202 19515
123 1 . 1 1 678 678 TRP CB C 678 29.819 29.819 30.174 -0.355 19515
124 1 . 1 1 678 678 TRP H H 678 7.525 7.525 8.412 -0.887 19515
125 1 . 1 1 679 679 LEU N N 679 116.664 116.664 119.712 -3.048 19515
126 1 . 1 1 679 679 LEU HA H 679 4.082 4.082 4.201 -0.119 19515
127 1 . 1 1 679 679 LEU C C 679 177.458 177.458 178.980 -1.522 19515
128 1 . 1 1 679 679 LEU CA C 679 56.839 56.839 57.802 -0.963 19515
129 1 . 1 1 679 679 LEU CB C 679 41.912 41.912 41.365 0.547 19515
130 1 . 1 1 679 679 LEU H H 679 7.786 7.786 8.515 -0.729 19515
131 1 . 1 1 680 680 TRP N N 680 116.195 116.195 121.129 -4.933 19515
132 1 . 1 1 680 680 TRP HA H 680 4.357 4.357 4.420 -0.063 19515
133 1 . 1 1 680 680 TRP C C 680 176.394 176.394 177.931 -1.537 19515
134 1 . 1 1 680 680 TRP CA C 680 58.948 58.948 60.986 -2.038 19515
135 1 . 1 1 680 680 TRP CB C 680 29.135 29.135 29.641 -0.506 19515
136 1 . 1 1 680 680 TRP H H 680 7.547 7.547 8.900 -1.353 19515
137 1 . 1 1 681 681 TYR N N 681 115.352 115.352 118.256 -2.904 19515
138 1 . 1 1 681 681 TYR HA H 681 4.150 4.150 4.438 -0.288 19515
139 1 . 1 1 681 681 TYR C C 681 175.671 175.671 176.768 -1.097 19515
140 1 . 1 1 681 681 TYR CA C 681 59.780 59.780 60.929 -1.149 19515
141 1 . 1 1 681 681 TYR CB C 681 39.011 39.011 38.930 0.081 19515
142 1 . 1 1 681 681 TYR H H 681 7.471 7.471 7.928 -0.457 19515
143 1 . 1 1 682 682 ILE N N 682 113.570 113.570 116.422 -2.852 19515
144 1 . 1 1 682 682 ILE HA H 682 4.211 4.211 4.234 -0.023 19515
145 1 . 1 1 682 682 ILE C C 682 174.166 174.166 176.743 -2.577 19515
146 1 . 1 1 682 682 ILE CA C 682 61.164 61.164 61.538 -0.374 19515
147 1 . 1 1 682 682 ILE CB C 682 38.869 38.869 38.297 0.572 19515
148 1 . 1 1 682 682 ILE H H 682 7.471 7.471 7.577 -0.106 19515
stop_
save_