*HEADER    MEMBRANE PROTEIN                        08-MAR-01   1H9E
*TITLE     LEM-LIKE DOMAIN OF HUMAN INNER NUCLEAR MEMBRANE PROTEIN
*TITLE    2 LAP2
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: THYMOPOIETIN;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: LEM-LIKE DOMAIN (2-57);
*COMPND   5 SYNONYM: LAMINA-ASSOCIATED POLYPEPTIDE 2
*SOURCE    MOL_ID: 1;
*SOURCE   2 SYNTHETIC: YES;
*SOURCE   3 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   4 ORGANISM_COMMON: HUMAN;
*SOURCE   5 CELLULAR_LOCATION: NUCLEUS
*KEYWDS    INNER NUCLEAR MEMBRANE PROTEIN, LAMINA-ASSOCIATED
*KEYWDS   2 POLYPEPTIDE, EMERIN, LEM DOMAIN, NMR
*EXPDTA    NMR, 10 STRUCTURES
*AUTHOR    C.LAGURI,B.GILQUIN,N.WOLFF,R.ROMI-LEBRUN,K.COURCHAY,
*AUTHOR   2 I.CALLEBAUT,H.J.WORMAN,S.ZINN-JUSTIN




1,HA-1,HB3 d 12 F1= 2.347 F2= 4.323 null null d= 3.1 1.54 ( 0.77 ) nbat 1 nbpic 4
1,HB3-1,HB2 h 88 F1= 1.954 F2= 2.339 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
1,HB3-1,HG2 d 658 F1= 1.983 F2= 2.349 null null d= 1.9 0.49 ( 0.05 ) nbat 1 nbpic 2
1,HD2-1,HG3 d 994 F1= 3.377 F2= 2.055 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
1,HD3-1,HB2 h 1508 F1= 1.963 F2= 3.401 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
1,HD3or1,HD2-1,HG2 d 11 F1= 1.998 F2= 3.384 null null d= 2.8 0.70 ( 0.00 ) nbat 2 nbpic 1
10,HA-10,HD1* d 58 F1= 0.771 F2= 4.462 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
10,HA-10,HD2* d 59 F1= 0.833 F2= 4.464 null null d= 2.4 0.78 ( 0.39 ) nbat 1 nbpic 4
10,HA-11,HG2* d 1022 F1= 1.420 F2= 4.449 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 2
10,HA-14,HB* h 355 F1= 2.024 F2= 4.444 null null d= 4.2 1.05 ( 0.00 ) nbat 1 nbpic 1
10,HA-9,HG1* d 1026 F1= 0.909 F2= 4.465 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
10,HB*-10,HD1* d 64 F1= 0.772 F2= 1.889 null null d= 2.5 1.86 ( 0.93 ) nbat 1 nbpic 4
10,HB*-10,HG d 958 F1= 1.872 F2= 1.464 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
10,HB*-14,HG3 h 1523 F1= 1.876 F2= 1.617 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
10,HG-10,HD1* d 62 F1= 0.771 F2= 1.454 null null d= 1.9 0.48 ( 0.08 ) nbat 1 nbpic 3
10,HG-10,HD2* d 63 F1= 0.834 F2= 1.456 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
10,HN-10,HA h 254 F1= 7.321 F2= 4.458 null null d= 2.4 0.36 ( 0.00 ) nbat 1 nbpic 1
10,HN-10,HB* h 1184 F1= 1.883 F2= 7.319 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
10,HN-10,HD1* h 654 F1= 7.324 F2= 0.769 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
10,HN-10,HG h 1178 F1= 1.446 F2= 7.320 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 2
10,HN-9,HAor7,HA h 503 F1= 7.322 F2= 4.091 null null d= 2.6 0.65 ( 0.00 ) nbat 2 nbpic 1
10,HN-9,HG1* h 1165 F1= 0.906 F2= 7.320 null null d= 2.5 0.61 ( 0.25 ) nbat 1 nbpic 2
10,HN-9,HN h 472 F1= 6.638 F2= 7.320 null null d= 2.2 0.32 ( 0.05 ) nbat 1 nbpic 2
11,HA-11,HB d 68 F1= 4.360 F2= 4.715 null null d= 2.3 0.80 ( 0.40 ) nbat 1 nbpic 2
11,HB-11,HG2* d 66 F1= 1.403 F2= 4.366 null null d= 2.4 0.59 ( 0.12 ) nbat 1 nbpic 3
11,HG2*-15,HD1* h 1052 F1= 1.418 F2= 0.770 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 2
11,HN-10,HA h 1077 F1= 4.455 F2= 7.617 null null d= 2.3 1.00 ( 0.50 ) nbat 1 nbpic 2
11,HN-10,HB* h 1231 F1= 1.881 F2= 7.609 null null d= 2.8 0.70 ( 0.10 ) nbat 1 nbpic 2
11,HN-11,HA h 325 F1= 7.620 F2= 4.728 null null d= 2.7 0.41 ( 0.00 ) nbat 1 nbpic 1
11,HN-11,HB h 324 F1= 7.612 F2= 4.367 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
11,HN-11,HG2* h 1237 F1= 1.411 F2= 7.612 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 2
11,HN-14,HB* h 1476 F1= 2.036 F2= 7.608 null null d= 2.5 0.64 ( 0.05 ) nbat 1 nbpic 2
11,HN-15,HD1*or10,HD1* h 1446 F1= 7.615 F2= 0.771 null null d= 3.5 0.88 ( 0.00 ) nbat 2 nbpic 1
12,HA-12,HB* d 563 F1= 1.884 F2= 3.865 null null d= 2.0 0.50 ( 0.10 ) nbat 1 nbpic 2
12,HA-12,HD3 d 817 F1= 3.853 F2= 1.953 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
12,HA-12,HG2 h 927 F1= 3.854 F2= 1.388 null null d= 3.6 0.90 ( 0.00 ) nbat 1 nbpic 1
12,HA-12,HG3 d 324 F1= 1.450 F2= 3.868 null null d= 2.4 0.60 ( 0.22 ) nbat 1 nbpic 3
12,HA-15,HD1* d 737 F1= 3.862 F2= 0.795 null null d= 2.1 0.52 ( 0.07 ) nbat 1 nbpic 4
12,HA-15,HD2* d 738 F1= 3.879 F2= 0.833 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 1
12,HA-15,HG d 818 F1= 3.877 F2= 1.671 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
12,HB*-12,HG2 d 26 F1= 1.385 F2= 1.879 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
12,HB*or10,HB*-12,HG3or10,HG d 89 F1= 1.455 F2= 1.880 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 3
12,HE*-12,HD2 d 329 F1= 1.816 F2= 3.083 null null d= 2.9 1.97 ( 0.98 ) nbat 1 nbpic 4
12,HE*-12,HD3 d 321 F1= 1.941 F2= 3.079 null null d= 2.3 0.57 ( 0.07 ) nbat 1 nbpic 4
12,HE*-12,HG2 d 1002 F1= 3.075 F2= 1.396 null null d= 2.7 0.67 ( 0.14 ) nbat 1 nbpic 3
12,HE*-31,HB* d 983 F1= 3.081 F2= 2.079 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
12,HG3-37,HG1* d 230 F1= 0.911 F2= 1.453 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
12,HN-11,HA h 474 F1= 9.167 F2= 4.724 null null d= 2.1 0.32 ( 0.00 ) nbat 1 nbpic 1
12,HN-11,HB h 1080 F1= 4.368 F2= 9.165 null null d= 2.4 0.59 ( 0.25 ) nbat 1 nbpic 2
12,HN-12,HA h 1 F1= 9.169 F2= 3.850 null null d= 2.6 0.40 ( 0.25 ) nbat 1 nbpic 2
12,HN-12,HB* h 1352 F1= 1.883 F2= 9.166 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
12,HN-12,HD3 h 1351 F1= 1.950 F2= 9.164 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 2
12,HN-13,HN h 396 F1= 9.168 F2= 8.444 null null d= 2.7 0.41 ( 0.10 ) nbat 1 nbpic 2
13,HA-13,HB2 d 70 F1= 2.528 F2= 4.276 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
13,HA-13,HB3 d 1020 F1= 4.273 F2= 2.639 null null d= 2.3 0.58 ( 0.22 ) nbat 1 nbpic 3
13,HA-16,HB2 d 567 F1= 1.662 F2= 4.276 null null d= 2.7 0.68 ( 0.30 ) nbat 1 nbpic 2
13,HA-16,HG2 d 586 F1= 0.733 F2= 4.284 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
13,HB3-13,HB2 d 652 F1= 2.634 F2= 2.533 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
13,HN-11,HG2* h 1286 F1= 1.391 F2= 8.435 null null d= 2.5 0.64 ( 0.05 ) nbat 1 nbpic 2
13,HN-13,HA h 1094 F1= 4.277 F2= 8.441 null null d= 2.4 0.36 ( 0.20 ) nbat 1 nbpic 2
13,HN-13,HB2 h 1324 F1= 2.538 F2= 8.442 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 2
13,HN-13,HB3 h 1325 F1= 2.641 F2= 8.443 null null d= 2.7 0.66 ( 0.05 ) nbat 1 nbpic 2
13,HN-14,HN h 413 F1= 8.444 F2= 7.720 null null d= 2.4 0.36 ( 0.00 ) nbat 1 nbpic 2
14,HA-14,HB* d 14 F1= 2.044 F2= 4.330 null null d= 2.8 0.93 ( 0.46 ) nbat 1 nbpic 3
14,HA-14,HD2 d 94 F1= 1.710 F2= 4.333 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
14,HA-14,HG2 d 93 F1= 1.476 F2= 4.326 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
14,HA-14,HG3 d 92 F1= 1.615 F2= 4.327 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
14,HA-17,HB2 d 543 F1= 4.323 F2= 4.016 null null d= 2.7 0.98 ( 0.49 ) nbat 1 nbpic 3
14,HA-17,HB3 d 544 F1= 4.323 F2= 4.072 null null d= 2.9 0.73 ( 0.20 ) nbat 1 nbpic 2
14,HB*-14,HG2 d 83 F1= 1.474 F2= 2.055 null null d= 2.0 0.49 ( 0.15 ) nbat 1 nbpic 2
14,HB*-14,HG3 d 84 F1= 1.619 F2= 2.049 null null d= 2.0 0.50 ( 0.16 ) nbat 1 nbpic 3
14,HD2-14,HG2 h 1041 F1= 1.696 F2= 1.471 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
14,HE2-14,HD2 d 1000 F1= 2.937 F2= 1.724 null null d= 2.6 0.65 ( 0.10 ) nbat 1 nbpic 2
14,HE2-14,HD3 h 1571 F1= 2.943 F2= 1.903 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 2
14,HE2-14,HD3or10,HB* d 74 F1= 1.903 F2= 2.939 null null d= 2.7 0.68 ( 0.00 ) nbat 2 nbpic 2
14,HE2-14,HG2 d 77 F1= 1.479 F2= 2.938 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
14,HE2-14,HG3 d 1033 F1= 1.616 F2= 2.943 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
14,HE3-10,HG d 78 F1= 1.467 F2= 3.007 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
14,HE3-14,HD2 h 1001 F1= 3.019 F2= 1.692 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
14,HE3-14,HD3 h 1572 F1= 3.019 F2= 1.905 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
14,HE3-14,HD3or10,HB* d 81 F1= 1.900 F2= 3.008 null null d= 2.5 0.64 ( 0.05 ) nbat 2 nbpic 2
14,HE3-14,HE2 d 647 F1= 3.002 F2= 2.937 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
14,HE3-14,HG3 d 79 F1= 1.615 F2= 3.009 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 1
14,HE3-15,HD1* d 626 F1= 0.794 F2= 3.027 null null d= 2.5 0.61 ( 0.05 ) nbat 1 nbpic 2
14,HE3-15,HG d 1018 F1= 3.007 F2= 1.688 null null d= 2.3 0.58 ( 0.22 ) nbat 1 nbpic 3
14,HE3-4,HD1* d 631 F1= 0.835 F2= 3.011 null null d= 3.1 0.78 ( 0.10 ) nbat 1 nbpic 2
14,HG3-10,HD1* d 681 F1= 0.769 F2= 1.621 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
14,HG3-14,HG2 d 952 F1= 1.616 F2= 1.484 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
14,HN-10,HB* h 1232 F1= 1.878 F2= 7.719 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
14,HN-13,HB2 h 1227 F1= 2.539 F2= 7.720 null null d= 2.7 0.80 ( 0.40 ) nbat 1 nbpic 2
14,HN-13,HB3 h 1222 F1= 2.640 F2= 7.718 null null d= 3.5 0.89 ( 0.15 ) nbat 1 nbpic 2
14,HN-14,HA h 228 F1= 7.721 F2= 4.321 null null d= 2.6 0.39 ( 0.00 ) nbat 1 nbpic 1
14,HN-14,HB* h 1235 F1= 2.035 F2= 7.719 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
15,HA-10,HD1* h 1503 F1= 0.786 F2= 3.885 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
15,HA-15,HB2 d 572 F1= 1.318 F2= 3.892 null null d= 2.2 0.56 ( 0.18 ) nbat 1 nbpic 4
15,HA-15,HG h 307 F1= 1.661 F2= 3.872 null null d= 3.7 0.93 ( 0.00 ) nbat 1 nbpic 1
15,HA-4,HD1* h 39 F1= 0.824 F2= 3.879 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 2
15,HAor12,HA-15,HG d 109 F1= 1.666 F2= 3.880 null null d= 2.1 0.53 ( 0.00 ) nbat 2 nbpic 1
15,HAor12,HA-4,HD1*or15,HD2* d 100 F1= 0.829 F2= 3.882 null null d= 2.1 0.53 ( 0.00 ) nbat 2 nbpic 1
15,HB2-15,HD1* d 102 F1= 0.795 F2= 1.325 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 2
15,HB2-15,HD2* d 101 F1= 0.830 F2= 1.325 null null d= 2.1 0.52 ( 0.19 ) nbat 1 nbpic 3
15,HB2-19,HD2* h 1548 F1= 1.302 F2= 1.134 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
15,HB3-10,HD1* h 1019 F1= 2.064 F2= 0.788 null null d= 2.2 0.56 ( 0.15 ) nbat 1 nbpic 2
15,HB3-15,HB2 h 1032 F1= 2.066 F2= 1.320 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
15,HB3-15,HG h 1515 F1= 1.683 F2= 2.060 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
15,HB3-4,HD1* d 673 F1= 0.832 F2= 2.041 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
15,HB3-7,HB2 d 1036 F1= 1.805 F2= 2.049 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
15,HG-15,HB2 d 105 F1= 1.322 F2= 1.675 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 2
15,HG-15,HD1* d 103 F1= 0.795 F2= 1.678 null null d= 2.0 0.49 ( 0.11 ) nbat 1 nbpic 4
15,HG-15,HD2* d 104 F1= 0.830 F2= 1.675 null null d= 1.9 0.49 ( 0.11 ) nbat 1 nbpic 4
15,HN-14,HB* h 1619 F1= 8.532 F2= 2.053 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 1
15,HN-14,HN h 412 F1= 8.532 F2= 7.720 null null d= 2.2 0.33 ( 0.00 ) nbat 1 nbpic 2
15,HN-15,HA h 1111 F1= 3.875 F2= 8.532 null null d= 2.4 0.36 ( 0.10 ) nbat 1 nbpic 2
15,HN-15,HB2 h 1285 F1= 1.324 F2= 8.531 null null d= 2.8 0.69 ( 0.05 ) nbat 1 nbpic 2
15,HN-15,HD2*or10,HD2* h 1262 F1= 0.827 F2= 8.530 null null d= 3.5 0.88 ( 0.00 ) nbat 2 nbpic 1
15,HN-15,HG h 1296 F1= 1.671 F2= 8.529 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
15,HN-16,HN h 417 F1= 8.530 F2= 8.060 null null d= 2.3 0.34 ( 0.00 ) nbat 1 nbpic 2
16,HA-16,HB2 d 111 F1= 1.663 F2= 3.588 null null d= 2.5 0.62 ( 0.08 ) nbat 1 nbpic 4
16,HA-16,HB3 d 110 F1= 1.772 F2= 3.588 null null d= 2.3 0.59 ( 0.09 ) nbat 1 nbpic 4
16,HA-16,HD* d 112 F1= 1.483 F2= 3.588 null null d= 4.2 1.30 ( 0.65 ) nbat 1 nbpic 2
16,HA-16,HG2 d 135 F1= 0.716 F2= 3.590 null null d= 2.5 0.62 ( 0.08 ) nbat 1 nbpic 4
16,HA-16,HG3 d 134 F1= 1.084 F2= 3.586 null null d= 2.9 0.72 ( 0.22 ) nbat 1 nbpic 3
16,HA-19,HB3 d 607 F1= 2.203 F2= 3.590 null null d= 2.5 0.62 ( 0.07 ) nbat 1 nbpic 4
16,HA-19,HD2* d 613 F1= 1.135 F2= 3.589 null null d= 2.3 0.57 ( 0.08 ) nbat 1 nbpic 4
16,HA-19,HG d 810 F1= 3.584 F2= 2.085 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
16,HA-26,HD1* d 615 F1= 0.920 F2= 3.589 null null d= 2.9 0.71 ( 0.15 ) nbat 1 nbpic 2
16,HA-26,HD2* d 614 F1= 0.955 F2= 3.590 null null d= 3.0 0.74 ( 0.15 ) nbat 1 nbpic 2
16,HB2-16,HD* d 88 F1= 1.467 F2= 1.681 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
16,HB3-15,HD1* d 682 F1= 0.793 F2= 1.765 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 2
16,HB3-16,HD* d 1065 F1= 1.475 F2= 1.773 null null d= 1.9 0.49 ( 0.05 ) nbat 1 nbpic 2
16,HB3-16,HG2 d 138 F1= 0.716 F2= 1.779 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 2
16,HD*-16,HG2 d 136 F1= 0.716 F2= 1.483 null null d= 2.2 0.54 ( 0.08 ) nbat 1 nbpic 4
16,HD*-16,HG3 d 139 F1= 1.105 F2= 1.491 null null d= 1.8 0.46 ( 0.05 ) nbat 1 nbpic 4
16,HE2-16,HB3 d 1053 F1= 2.658 F2= 1.780 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
16,HE2-16,HD* d 1006 F1= 2.672 F2= 1.486 null null d= 2.2 0.56 ( 0.11 ) nbat 1 nbpic 4
16,HE3-15,HD1* d 850 F1= 2.787 F2= 0.796 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 1
16,HE3-16,HB2 d 1032 F1= 1.654 F2= 2.781 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
16,HE3-16,HD* d 1004 F1= 2.769 F2= 1.488 null null d= 2.4 0.61 ( 0.19 ) nbat 1 nbpic 4
16,HE3-16,HE2 d 121 F1= 2.671 F2= 2.767 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
16,HE3-16,HG2 d 132 F1= 0.731 F2= 2.776 null null d= 2.8 0.71 ( 0.05 ) nbat 1 nbpic 2
16,HG3-16,HG2 d 932 F1= 1.089 F2= 0.715 null null d= 1.9 0.47 ( 0.04 ) nbat 1 nbpic 4
16,HN-15,HB2 h 596 F1= 8.062 F2= 1.326 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
16,HN-16,HA h 1117 F1= 3.584 F2= 8.060 null null d= 2.3 0.35 ( 0.05 ) nbat 1 nbpic 2
16,HN-16,HB2 h 1292 F1= 1.686 F2= 8.061 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 2
16,HN-16,HB3 h 1293 F1= 1.766 F2= 8.065 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
16,HN-16,HD* h 594 F1= 8.061 F2= 1.483 null null d= 4.5 1.12 ( 0.00 ) nbat 1 nbpic 1
16,HN-16,HG3 h 1278 F1= 1.094 F2= 8.061 null null d= 2.4 0.59 ( 0.15 ) nbat 1 nbpic 2
16,HN-17,HN h 1611 F1= 8.061 F2= 7.959 null null d= 1.8 0.27 ( 0.00 ) nbat 1 nbpic 2
17,HA-17,HB2 d 123 F1= 4.011 F2= 4.160 null null d= 2.2 0.54 ( 0.23 ) nbat 1 nbpic 4
17,HA-17,HB3 d 122 F1= 4.066 F2= 4.159 null null d= 1.9 0.48 ( 0.11 ) nbat 1 nbpic 4
17,HA-20,HB d 558 F1= 2.107 F2= 4.161 null null d= 2.5 0.63 ( 0.18 ) nbat 1 nbpic 4
17,HA-20,HG2* d 581 F1= 0.981 F2= 4.161 null null d= 3.4 0.85 ( 0.20 ) nbat 1 nbpic 2
17,HB3-14,HB* d 565 F1= 2.045 F2= 4.059 null null d= 3.0 0.74 ( 0.05 ) nbat 1 nbpic 2
17,HB3-14,HG2 h 734 F1= 1.463 F2= 4.079 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
17,HN-14,HA h 510 F1= 7.963 F2= 4.321 null null d= 2.7 0.41 ( 0.00 ) nbat 1 nbpic 1
17,HN-16,HA h 1400 F1= 7.958 F2= 3.585 null null d= 2.8 0.42 ( 0.00 ) nbat 1 nbpic 1
17,HN-16,HB2 h 1472 F1= 1.677 F2= 7.960 null null d= 2.4 0.60 ( 0.20 ) nbat 1 nbpic 2
17,HN-16,HB3 h 1471 F1= 1.772 F2= 7.956 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 2
17,HN-17,HA h 1122 F1= 4.160 F2= 7.956 null null d= 2.5 0.37 ( 0.25 ) nbat 1 nbpic 2
17,HN-17,HB2 h 1458 F1= 4.022 F2= 7.961 null null d= 2.5 0.64 ( 0.15 ) nbat 1 nbpic 2
17,HN-17,HB3 h 1121 F1= 4.070 F2= 7.961 null null d= 2.5 0.61 ( 0.05 ) nbat 1 nbpic 2
18,HA-18,HB2 d 124 F1= 2.130 F2= 4.307 null null d= 2.4 0.61 ( 0.26 ) nbat 1 nbpic 3
18,HA-18,HB3 d 125 F1= 2.395 F2= 4.312 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
18,HA-18,HG3 d 556 F1= 2.553 F2= 4.319 null null d= 3.8 2.40 ( 1.20 ) nbat 1 nbpic 2
18,HA-21,HB* d 568 F1= 1.543 F2= 4.309 null null d= 2.6 0.75 ( 0.37 ) nbat 1 nbpic 4
18,HB2-44,HD1* d 697 F1= 0.074 F2= 2.128 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
18,HB3-18,HB2 d 655 F1= 2.125 F2= 2.402 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
18,HG2-10,HD1* d 1011 F1= 2.390 F2= 0.777 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
18,HG2-14,HD3 d 36 F1= 1.914 F2= 2.400 null null d= 1.8 0.46 ( 0.05 ) nbat 1 nbpic 4
18,HG3-10,HD1* d 1030 F1= 0.776 F2= 2.558 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
18,HG3-14,HD3 d 1054 F1= 2.536 F2= 1.894 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
18,HG3-18,HB2 d 327 F1= 2.127 F2= 2.555 null null d= 2.2 0.54 ( 0.12 ) nbat 1 nbpic 3
18,HG3-18,HG2 d 328 F1= 2.397 F2= 2.556 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
18,HN-17,HA h 500 F1= 8.583 F2= 4.161 null null d= 3.1 0.46 ( 0.00 ) nbat 1 nbpic 1
18,HN-17,HB2 h 498 F1= 8.582 F2= 4.020 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
18,HN-17,HB3 h 499 F1= 8.583 F2= 4.063 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
18,HN-17,HN h 415 F1= 8.581 F2= 7.959 null null d= 2.2 0.33 ( 0.00 ) nbat 1 nbpic 2
18,HN-18,HA h 1082 F1= 4.302 F2= 8.579 null null d= 2.7 0.90 ( 0.45 ) nbat 1 nbpic 2
18,HN-18,HB2 h 1317 F1= 2.127 F2= 8.580 null null d= 2.8 0.69 ( 0.05 ) nbat 1 nbpic 2
18,HN-18,HG3 h 1326 F1= 2.555 F2= 8.580 null null d= 2.4 0.60 ( 0.20 ) nbat 1 nbpic 2
18,HN-19,HN h 422 F1= 8.580 F2= 8.339 null null d= 1.9 0.29 ( 0.05 ) nbat 1 nbpic 2
19,HA-19,HB2 d 832 F1= 3.873 F2= 1.302 null null d= 2.2 0.56 ( 0.15 ) nbat 1 nbpic 2
19,HA-19,HB3 d 129 F1= 2.201 F2= 3.877 null null d= 2.7 0.68 ( 0.20 ) nbat 1 nbpic 2
19,HA-22,HB2 d 273 F1= 2.401 F2= 3.871 null null d= 3.0 1.84 ( 0.92 ) nbat 1 nbpic 4
19,HA-24,HB h 909 F1= 3.873 F2= 1.659 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 1
19,HA-24,HG2* d 588 F1= 0.523 F2= 3.875 null null d= 2.8 0.69 ( 0.25 ) nbat 1 nbpic 2
19,HB2-19,HD1* d 142 F1= 0.734 F2= 1.291 null null d= 2.0 0.50 ( 0.10 ) nbat 1 nbpic 4
19,HB2-19,HD2* d 145 F1= 1.139 F2= 1.297 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
19,HB2-24,HG1* d 1039 F1= 0.441 F2= 1.290 null null d= 2.8 0.71 ( 0.21 ) nbat 1 nbpic 3
19,HB2-24,HG2* d 1042 F1= 0.523 F2= 1.288 null null d= 3.1 0.78 ( 0.33 ) nbat 1 nbpic 3
19,HB2-26,HD1* d 1066 F1= 0.921 F2= 1.286 null null d= 2.0 0.49 ( 0.12 ) nbat 1 nbpic 3
19,HB3-19,HB2 d 666 F1= 1.284 F2= 2.209 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
19,HB3-19,HD1* h 273 F1= 0.730 F2= 2.183 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
19,HB3-19,HD2* d 669 F1= 1.135 F2= 2.204 null null d= 2.0 0.49 ( 0.05 ) nbat 1 nbpic 4
19,HB3-24,HB d 1052 F1= 2.203 F2= 1.642 null null d= 2.5 0.62 ( 0.20 ) nbat 1 nbpic 2
19,HB3-24,HG2* d 701 F1= 0.523 F2= 2.196 null null d= 3.8 0.95 ( 0.00 ) nbat 1 nbpic 1
19,HB3-26,HD2* h 807 F1= 0.967 F2= 2.191 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 1
19,HD1*-24,HG1* d 915 F1= 0.734 F2= 0.448 null null d= 2.1 0.53 ( 0.05 ) nbat 1 nbpic 3
19,HD1*-24,HG2* d 916 F1= 0.733 F2= 0.529 null null d= 2.0 0.51 ( 0.12 ) nbat 1 nbpic 3
19,HD1*-44,HD1* d 703 F1= 0.070 F2= 0.739 null null d= 2.4 0.60 ( 0.12 ) nbat 1 nbpic 4
19,HD1*-44,HD2* d 702 F1= 0.114 F2= 0.738 null null d= 3.2 0.84 ( 0.42 ) nbat 1 nbpic 3
19,HD2*-19,HD1* d 144 F1= 0.733 F2= 1.138 null null d= 1.8 0.46 ( 0.04 ) nbat 1 nbpic 4
19,HD2*-24,HG1* d 920 F1= 1.136 F2= 0.448 null null d= 2.8 0.70 ( 0.08 ) nbat 1 nbpic 3
19,HD2*-24,HG2* d 948 F1= 0.523 F2= 1.144 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
19,HG-19,HD1* d 143 F1= 0.732 F2= 2.090 null null d= 2.1 0.52 ( 0.12 ) nbat 1 nbpic 3
19,HG-44,HD1* d 698 F1= 0.068 F2= 2.086 null null d= 2.9 0.72 ( 0.31 ) nbat 1 nbpic 3
19,HG-44,HD2* d 865 F1= 2.104 F2= 0.123 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
19,HG-44,HG d 671 F1= 0.918 F2= 2.098 null null d= 2.2 0.55 ( 0.08 ) nbat 1 nbpic 3
19,HN-16,HA h 1456 F1= 3.588 F2= 8.344 null null d= 3.5 0.52 ( 0.25 ) nbat 1 nbpic 2
19,HN-18,HB3 h 1313 F1= 2.384 F2= 8.344 null null d= 2.5 0.64 ( 0.05 ) nbat 1 nbpic 2
19,HN-19,HB2 h 270 F1= 8.340 F2= 1.281 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 1
19,HN-19,HB3 h 108 F1= 8.344 F2= 2.194 null null d= 1.9 0.49 ( 0.05 ) nbat 1 nbpic 2
19,HN-19,HG h 1314 F1= 2.082 F2= 8.344 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
2,HA-47,HG3 d 564 F1= 1.805 F2= 4.055 null null d= 2.4 0.59 ( 0.09 ) nbat 1 nbpic 3
20,HA-20,HG1* d 574 F1= 1.145 F2= 3.857 null null d= 2.0 0.51 ( 0.04 ) nbat 1 nbpic 4
20,HA-20,HG2* d 151 F1= 0.982 F2= 3.860 null null d= 2.2 0.56 ( 0.15 ) nbat 1 nbpic 4
20,HB-20,HG2* d 149 F1= 0.981 F2= 2.113 null null d= 1.8 0.46 ( 0.05 ) nbat 1 nbpic 3
20,HBor19,HG-20,HG1*or19,HD2* d 146 F1= 1.147 F2= 2.106 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 4
20,HG1*-20,HG2* d 148 F1= 0.983 F2= 1.157 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
20,HG1*-26,HD1* d 930 F1= 1.137 F2= 0.926 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
20,HN-19,HB2 h 602 F1= 8.419 F2= 1.285 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
20,HN-19,HB3 h 1321 F1= 2.198 F2= 8.421 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 2
20,HN-20,HA h 1107 F1= 3.858 F2= 8.418 null null d= 2.1 0.32 ( 0.10 ) nbat 1 nbpic 2
20,HN-20,HB h 1315 F1= 2.106 F2= 8.425 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 2
20,HN-20,HG1* h 1275 F1= 1.149 F2= 8.422 null null d= 1.9 0.49 ( 0.05 ) nbat 1 nbpic 2
20,HN-20,HG2* h 1271 F1= 0.988 F2= 8.422 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 2
21,HA-20,HG2* d 582 F1= 0.981 F2= 4.200 null null d= 3.1 0.77 ( 0.20 ) nbat 1 nbpic 2
21,HA-21,HB* d 154 F1= 1.541 F2= 4.199 null null d= 2.1 0.53 ( 0.22 ) nbat 1 nbpic 3
21,HN-18,HA h 102 F1= 8.368 F2= 4.312 null null d= 2.4 0.36 ( 0.00 ) nbat 1 nbpic 1
21,HN-20,HB h 1436 F1= 8.367 F2= 2.102 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
21,HN-20,HG1* h 605 F1= 8.366 F2= 1.148 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
21,HN-20,HG2* h 103 F1= 8.364 F2= 0.984 null null d= 3.0 0.75 ( 0.20 ) nbat 1 nbpic 2
21,HN-21,HA h 1097 F1= 4.221 F2= 8.372 null null d= 2.2 0.33 ( 0.14 ) nbat 1 nbpic 3
21,HN-21,HB* h 1291 F1= 1.547 F2= 8.364 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 2
21,HN-22,HN h 405 F1= 8.368 F2= 7.250 null null d= 2.3 0.35 ( 0.05 ) nbat 1 nbpic 2
22,HA-22,HB2 d 156 F1= 2.401 F2= 4.787 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
22,HA-22,HB3 d 155 F1= 2.816 F2= 4.789 null null d= 3.0 0.90 ( 0.45 ) nbat 1 nbpic 2
22,HB2-24,HG2* d 1048 F1= 2.404 F2= 0.528 null null d= 3.0 0.75 ( 0.10 ) nbat 1 nbpic 2
22,HB2-44,HD1* d 687 F1= 0.072 F2= 2.402 null null d= 2.7 0.68 ( 0.14 ) nbat 1 nbpic 4
22,HB2-44,HD2* d 688 F1= 0.113 F2= 2.407 null null d= 2.5 0.61 ( 0.09 ) nbat 1 nbpic 4
22,HB3-22,HB2 d 157 F1= 2.401 F2= 2.823 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
22,HB3-44,HD1* d 690 F1= 0.074 F2= 2.831 null null d= 2.9 0.73 ( 0.15 ) nbat 1 nbpic 4
22,HB3-44,HD2* d 689 F1= 0.114 F2= 2.828 null null d= 2.4 0.59 ( 0.08 ) nbat 1 nbpic 4
22,HD21-21,HB* h 580 F1= 7.773 F2= 1.546 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
22,HD21-22,HB2 h 1230 F1= 2.402 F2= 7.772 null null d= 4.8 3.00 ( 1.50 ) nbat 1 nbpic 2
22,HD21-3,HD* h 1385 F1= 7.774 F2= 7.175 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
22,HD21-3,HE* h 458 F1= 7.771 F2= 7.214 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
22,HD21-44,HD1* h 1253 F1= 0.068 F2= 7.770 null null d= 3.4 0.85 ( 0.00 ) nbat 1 nbpic 1
22,HD22-18,HB3 h 1312 F1= 2.404 F2= 8.239 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
22,HD22-21,HB* h 1290 F1= 1.547 F2= 8.238 null null d= 2.8 0.70 ( 0.20 ) nbat 1 nbpic 2
22,HD22-22,HB3 h 1328 F1= 2.826 F2= 8.240 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
22,HD22-22,HD21 h 418 F1= 8.242 F2= 7.769 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
22,HD22-22,HN h 1393 F1= 7.257 F2= 8.241 null null d= 2.7 0.66 ( 0.05 ) nbat 1 nbpic 2
22,HD22-3,HD* h 469 F1= 8.240 F2= 7.181 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
22,HD22-44,HD1* h 1252 F1= 0.072 F2= 8.239 null null d= 3.8 0.95 ( 0.00 ) nbat 1 nbpic 2
22,HD22-44,HD2* h 635 F1= 8.242 F2= 0.122 null null d= 4.3 1.07 ( 0.00 ) nbat 1 nbpic 1
22,HN-19,HA h 506 F1= 7.252 F2= 3.860 null null d= 3.1 0.46 ( 0.00 ) nbat 1 nbpic 1
22,HN-21,HA h 704 F1= 7.251 F2= 4.199 null null d= 2.7 0.41 ( 0.00 ) nbat 1 nbpic 1
22,HN-21,HB* h 1176 F1= 1.547 F2= 7.251 null null d= 3.0 0.90 ( 0.45 ) nbat 1 nbpic 2
22,HN-22,HA h 255 F1= 7.248 F2= 4.788 null null d= 2.2 0.33 ( 0.00 ) nbat 1 nbpic 1
22,HN-22,HB2 h 1192 F1= 2.402 F2= 7.250 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 2
22,HN-22,HB3 h 1197 F1= 2.827 F2= 7.249 null null d= 4.2 1.30 ( 0.65 ) nbat 1 nbpic 2
23,HA-23,HB2 d 159 F1= 2.787 F2= 4.353 null null d= 3.0 1.43 ( 0.72 ) nbat 1 nbpic 4
23,HA-23,HB3 d 160 F1= 3.059 F2= 4.351 null null d= 2.4 0.61 ( 0.23 ) nbat 1 nbpic 4
23,HB3-23,HB2 d 158 F1= 2.789 F2= 3.049 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
23,HD21-23,HB2 h 689 F1= 6.861 F2= 2.800 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
23,HD22-23,HB2 h 1221 F1= 2.794 F2= 7.588 null null d= 2.9 0.71 ( 0.25 ) nbat 1 nbpic 2
23,HN-22,HN h 411 F1= 8.029 F2= 7.250 null null d= 2.2 0.33 ( 0.00 ) nbat 1 nbpic 2
23,HN-23,HA h 1125 F1= 4.357 F2= 8.030 null null d= 2.1 0.32 ( 0.25 ) nbat 1 nbpic 2
23,HN-23,HB2 h 1225 F1= 2.805 F2= 8.028 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
23,HN-23,HB3 h 1466 F1= 3.070 F2= 8.023 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
24,HA-24,HB d 163 F1= 1.636 F2= 3.775 null null d= 2.7 0.67 ( 0.13 ) nbat 1 nbpic 4
24,HA-24,HG1* d 161 F1= 0.442 F2= 3.771 null null d= 2.2 0.56 ( 0.04 ) nbat 1 nbpic 4
24,HA-24,HG2* d 162 F1= 0.522 F2= 3.772 null null d= 2.2 0.55 ( 0.07 ) nbat 1 nbpic 4
24,HB-19,HB2 d 1061 F1= 1.286 F2= 1.642 null null d= 2.0 0.51 ( 0.23 ) nbat 1 nbpic 4
24,HB-19,HD1* d 137 F1= 0.732 F2= 1.644 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 4
24,HB-24,HG1* d 165 F1= 0.442 F2= 1.640 null null d= 2.1 0.51 ( 0.09 ) nbat 1 nbpic 4
24,HB-24,HG2* d 164 F1= 0.522 F2= 1.640 null null d= 2.0 0.49 ( 0.11 ) nbat 1 nbpic 4
24,HG1*-44,HD2* d 706 F1= 0.116 F2= 0.448 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
24,HG2*-24,HG1* d 166 F1= 0.443 F2= 0.528 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
24,HG2*-44,HD1* d 704 F1= 0.072 F2= 0.529 null null d= 2.8 0.70 ( 0.22 ) nbat 1 nbpic 3
24,HG2*-44,HD2* d 705 F1= 0.114 F2= 0.529 null null d= 2.5 0.78 ( 0.39 ) nbat 1 nbpic 4
24,HN-20,HA h 1402 F1= 8.034 F2= 3.860 null null d= 2.7 0.41 ( 0.00 ) nbat 1 nbpic 1
24,HN-24,HA h 1118 F1= 3.782 F2= 8.043 null null d= 3.0 0.44 ( 0.15 ) nbat 1 nbpic 2
24,HN-24,HB h 1429 F1= 8.039 F2= 1.638 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
24,HN-24,HG2* h 1255 F1= 0.524 F2= 8.040 null null d= 2.5 0.64 ( 0.05 ) nbat 1 nbpic 2
25,HA-25,HG2* d 575 F1= 1.163 F2= 3.887 null null d= 2.3 0.58 ( 0.22 ) nbat 1 nbpic 3
25,HA-26,HD1* h 121 F1= 0.930 F2= 3.878 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
25,HB-25,HG2* d 168 F1= 1.162 F2= 3.932 null null d= 2.2 0.54 ( 0.11 ) nbat 1 nbpic 4
25,HN-24,HA h 1105 F1= 3.779 F2= 8.226 null null d= 1.9 0.28 ( 0.05 ) nbat 1 nbpic 2
25,HN-24,HG1* h 1257 F1= 0.444 F2= 8.226 null null d= 2.6 0.66 ( 0.15 ) nbat 1 nbpic 2
25,HN-25,HA h 1104 F1= 3.892 F2= 8.227 null null d= 2.1 0.32 ( 0.15 ) nbat 1 nbpic 2
25,HN-25,HB h 1454 F1= 3.929 F2= 8.227 null null d= 2.3 0.57 ( 0.10 ) nbat 1 nbpic 2
26,HA-26,HD1* d 173 F1= 0.920 F2= 4.636 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
26,HA-26,HG d 171 F1= 1.870 F2= 4.632 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
26,HA-27,HD2 d 535 F1= 3.472 F2= 4.638 null null d= 2.1 0.53 ( 0.10 ) nbat 1 nbpic 2
26,HA-27,HD3 d 537 F1= 3.716 F2= 4.636 null null d= 2.0 0.50 ( 0.10 ) nbat 1 nbpic 2
26,HB2-26,HD1* d 686 F1= 0.918 F2= 1.616 null null d= 2.5 1.48 ( 0.74 ) nbat 1 nbpic 3
26,HB3-26,HB2 h 1563 F1= 1.768 F2= 1.609 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
26,HB3-26,HD1* d 684 F1= 0.925 F2= 1.773 null null d= 2.0 0.51 ( 0.15 ) nbat 1 nbpic 2
26,HB3or16,HB3-20,HG1*or19,HD2* d 1035 F1= 1.154 F2= 1.775 null null d= 2.3 0.59 ( 0.05 ) nbat 2 nbpic 2
26,HG-20,HG1* d 25 F1= 1.145 F2= 1.866 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
26,HG-26,HB2 d 90 F1= 1.611 F2= 1.881 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
26,HG-26,HD1* d 177 F1= 0.925 F2= 1.864 null null d= 1.8 0.46 ( 0.09 ) nbat 1 nbpic 4
26,HN-25,HA h 1455 F1= 3.897 F2= 8.569 null null d= 2.4 0.36 ( 0.00 ) nbat 1 nbpic 1
26,HN-25,HB h 1106 F1= 3.931 F2= 8.567 null null d= 1.9 0.46 ( 0.05 ) nbat 1 nbpic 2
26,HN-25,HG2* h 1277 F1= 1.169 F2= 8.565 null null d= 2.8 0.69 ( 0.15 ) nbat 1 nbpic 2
26,HN-26,HA h 25 F1= 8.568 F2= 4.629 null null d= 2.6 0.39 ( 0.00 ) nbat 1 nbpic 1
26,HN-26,HB2 h 1356 F1= 1.605 F2= 8.563 null null d= 3.9 0.97 ( 0.00 ) nbat 1 nbpic 1
26,HN-26,HB3 h 1297 F1= 1.767 F2= 8.564 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
26,HN-26,HG h 1298 F1= 1.864 F2= 8.567 null null d= 2.4 0.59 ( 0.25 ) nbat 1 nbpic 2
27,HA-27,HB3 d 178 F1= 2.301 F2= 4.466 null null d= 2.3 0.58 ( 0.27 ) nbat 1 nbpic 4
27,HAor10,HA-27,HB2or10,HB* d 61 F1= 1.885 F2= 4.466 null null d= 2.8 0.91 ( 0.46 ) nbat 2 nbpic 4
27,HB2-27,HG* h 34 F1= 1.755 F2= 1.880 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
27,HB3-27,HB2 h 1006 F1= 2.314 F2= 1.890 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
27,HB3-27,HG* d 1008 F1= 2.310 F2= 1.760 null null d= 2.3 0.58 ( 0.19 ) nbat 1 nbpic 4
27,HD2-27,HB2 d 184 F1= 1.880 F2= 3.477 null null d= 2.7 0.67 ( 0.28 ) nbat 1 nbpic 3
27,HD2-27,HG* d 183 F1= 1.759 F2= 3.477 null null d= 2.4 0.61 ( 0.11 ) nbat 1 nbpic 4
27,HD2-39,HD1* d 619 F1= 0.917 F2= 3.477 null null d= 2.5 0.63 ( 0.21 ) nbat 1 nbpic 3
27,HD3-26,HB2 d 612 F1= 1.608 F2= 3.721 null null d= 3.5 0.86 ( 0.15 ) nbat 1 nbpic 2
27,HD3-27,HB3 d 182 F1= 2.309 F2= 3.718 null null d= 3.0 0.75 ( 0.10 ) nbat 1 nbpic 2
27,HD3-27,HD2 d 188 F1= 3.472 F2= 3.722 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
27,HD3-39,HD1* d 618 F1= 0.916 F2= 3.721 null null d= 2.4 0.59 ( 0.11 ) nbat 1 nbpic 4
27,HD3-39,HD2*or35,HG1* d 617 F1= 1.032 F2= 3.721 null null d= 4.4 1.10 ( 0.00 ) nbat 2 nbpic 1
28,HN-28,HA h 1098 F1= 4.290 F2= 8.353 null null d= 3.2 1.20 ( 0.60 ) nbat 1 nbpic 2
29,HA2-29,HA1 d 190 F1= 3.844 F2= 4.045 null null d= 2.0 0.30 ( 0.19 ) nbat 1 nbpic 9
29,HN-28,HB* h 101 F1= 8.378 F2= 1.388 null null d= 2.5 0.64 ( 0.15 ) nbat 1 nbpic 2
29,HN-29,HA1 h 1112 F1= 3.856 F2= 8.374 null null d= 2.1 0.32 ( 0.10 ) nbat 1 nbpic 2
29,HN-29,HA2 h 1099 F1= 4.083 F2= 8.372 null null d= 3.0 0.45 ( 0.29 ) nbat 1 nbpic 3
3,HA-3,HB3 d 596 F1= 3.144 F2= 4.828 null null d= 2.8 0.69 ( 0.05 ) nbat 1 nbpic 2
3,HB3-3,HB2 d 17 F1= 2.594 F2= 3.150 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
3,HD*-18,HB2 d 385 F1= 7.176 F2= 2.141 null null d= 3.1 0.77 ( 0.30 ) nbat 1 nbpic 2
3,HD*-18,HB3 d 380 F1= 7.171 F2= 2.411 null null d= 3.8 0.95 ( 0.00 ) nbat 1 nbpic 1
3,HD*-19,HA d 355 F1= 7.174 F2= 3.878 null null d= 3.0 0.76 ( 0.15 ) nbat 1 nbpic 2
3,HD*-19,HG h 1188 F1= 2.103 F2= 7.175 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
3,HD*-2,HA d 364 F1= 7.171 F2= 4.055 null null d= 4.2 1.05 ( 0.00 ) nbat 1 nbpic 1
3,HD*-3,HA d 344 F1= 7.174 F2= 4.828 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 1
3,HD*-3,HB2 d 378 F1= 7.174 F2= 2.601 null null d= 2.2 0.54 ( 0.11 ) nbat 1 nbpic 4
3,HD*-44,HB* d 446 F1= 7.175 F2= -0.388 null null d= 2.7 0.68 ( 0.29 ) nbat 1 nbpic 4
3,HD*-44,HD1* d 441 F1= 7.175 F2= 0.075 null null d= 2.7 0.67 ( 0.15 ) nbat 1 nbpic 4
3,HD*-44,HD2* d 528 F1= 0.114 F2= 7.178 null null d= 3.0 0.76 ( 0.05 ) nbat 1 nbpic 2
3,HD*-44,HG d 417 F1= 7.174 F2= 0.921 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
3,HD*-46,HA d 356 F1= 7.173 F2= 3.660 null null d= 3.5 0.89 ( 0.15 ) nbat 1 nbpic 2
3,HD*-47,HB2or19,HG d 386 F1= 7.176 F2= 2.096 null null d= 2.7 0.66 ( 0.05 ) nbat 2 nbpic 2
3,HD*-47,HD2or3,HB3 d 367 F1= 7.175 F2= 3.153 null null d= 2.2 0.56 ( 0.05 ) nbat 2 nbpic 4
3,HD*-47,HD3 d 366 F1= 7.175 F2= 3.260 null null d= 3.9 0.97 ( 0.40 ) nbat 1 nbpic 2
3,HD*-47,HG3 d 395 F1= 7.175 F2= 1.810 null null d= 2.8 0.69 ( 0.11 ) nbat 1 nbpic 4
3,HE*-18,HB2 h 1477 F1= 2.135 F2= 7.214 null null d= 4.0 1.00 ( 0.00 ) nbat 1 nbpic 2
3,HE*-18,HB3 d 379 F1= 7.214 F2= 2.406 null null d= 4.1 1.02 ( 0.00 ) nbat 1 nbpic 1
3,HE*-19,HA d 354 F1= 7.210 F2= 3.880 null null d= 3.6 0.90 ( 0.00 ) nbat 1 nbpic 1
3,HE*-19,HG d 387 F1= 7.215 F2= 2.098 null null d= 3.0 0.76 ( 0.33 ) nbat 1 nbpic 3
3,HE*-3,HB2 d 377 F1= 7.209 F2= 2.593 null null d= 2.9 0.72 ( 0.10 ) nbat 1 nbpic 2
3,HE*-3,HZ d 338 F1= 7.215 F2= 7.043 null null d= 2.5 0.64 ( 0.05 ) nbat 1 nbpic 2
3,HE*-44,HB* d 447 F1= 7.212 F2= -0.389 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
3,HE*-44,HD1* d 444 F1= 7.214 F2= 0.075 null null d= 2.8 0.69 ( 0.11 ) nbat 1 nbpic 4
3,HE*-44,HD2* d 531 F1= 0.116 F2= 7.216 null null d= 3.5 0.90 ( 0.45 ) nbat 1 nbpic 2
3,HE*-44,HG d 418 F1= 7.211 F2= 0.923 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
3,HE*-47,HD2 d 368 F1= 7.211 F2= 3.156 null null d= 2.7 0.68 ( 0.08 ) nbat 1 nbpic 4
3,HE*-47,HD3 d 365 F1= 7.212 F2= 3.264 null null d= 3.4 0.84 ( 0.17 ) nbat 1 nbpic 3
3,HN-2,HA h 1085 F1= 4.060 F2= 8.637 null null d= 2.4 0.36 ( 0.10 ) nbat 1 nbpic 2
3,HN-3,HB2 h 10 F1= 8.640 F2= 2.595 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 2
3,HN-3,HB3 h 1334 F1= 3.146 F2= 8.642 null null d= 4.0 1.01 ( 0.05 ) nbat 1 nbpic 2
3,HN-3,HD* h 440 F1= 7.179 F2= 8.640 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
3,HN-47,HG3 h 1342 F1= 1.811 F2= 8.639 null null d= 2.5 0.62 ( 0.10 ) nbat 1 nbpic 2
3,HZ-19,HD1* d 430 F1= 7.039 F2= 0.742 null null d= 3.1 0.77 ( 0.24 ) nbat 1 nbpic 3
3,HZ-19,HG d 391 F1= 7.037 F2= 2.090 null null d= 2.8 0.71 ( 0.09 ) nbat 1 nbpic 3
3,HZ-4,HB2or19,HD2* d 419 F1= 7.040 F2= 1.126 null null d= 2.7 0.68 ( 0.00 ) nbat 2 nbpic 1
3,HZ-4,HD1* d 428 F1= 7.039 F2= 0.838 null null d= 2.3 0.59 ( 0.17 ) nbat 1 nbpic 4
3,HZ-40,HA d 353 F1= 7.040 F2= 3.871 null null d= 2.7 0.70 ( 0.35 ) nbat 1 nbpic 4
3,HZ-40,HB2 d 374 F1= 7.040 F2= 2.849 null null d= 2.1 0.52 ( 0.13 ) nbat 1 nbpic 4
3,HZ-40,HB3 d 358 F1= 7.038 F2= 3.523 null null d= 2.4 0.60 ( 0.12 ) nbat 1 nbpic 4
3,HZ-41,HA d 357 F1= 7.034 F2= 4.414 null null d= 3.5 1.10 ( 0.55 ) nbat 1 nbpic 2
3,HZ-44,HD1* d 1 F1= 0.072 F2= 7.041 null null d= 2.5 0.63 ( 0.08 ) nbat 1 nbpic 4
3,HZ-44,HD2* d 448 F1= 7.036 F2= 0.119 null null d= 3.8 0.95 ( 0.00 ) nbat 1 nbpic 1
3,HZ-44,HG d 427 F1= 7.037 F2= 0.925 null null d= 2.5 0.61 ( 0.15 ) nbat 1 nbpic 4
3,HZ-46,HA d 361 F1= 7.038 F2= 3.657 null null d= 3.6 0.90 ( 0.20 ) nbat 1 nbpic 2
3,HZ-7,HD2 d 359 F1= 7.041 F2= 3.415 null null d= 3.5 0.88 ( 0.42 ) nbat 1 nbpic 3
3,HZ-7,HG* d 492 F1= 1.849 F2= 7.042 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 1
3,HZ-7,HG*or4,HG d 398 F1= 7.038 F2= 1.854 null null d= 2.6 0.65 ( 0.00 ) nbat 2 nbpic 1
30,HA-30,HB3 d 191 F1= 2.251 F2= 4.315 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
30,HAor1,HA-30,HB2or1,HB2 d 776 F1= 4.316 F2= 1.946 null null d= 2.2 0.55 ( 0.21 ) nbat 2 nbpic 4
30,HB3-30,HB2 d 1059 F1= 2.246 F2= 1.944 null null d= 1.8 0.46 ( 0.05 ) nbat 1 nbpic 3
30,HN-29,HA2 h 1100 F1= 4.079 F2= 8.412 null null d= 2.5 0.70 ( 0.35 ) nbat 1 nbpic 2
30,HN-30,HA h 81 F1= 8.416 F2= 4.316 null null d= 2.2 0.33 ( 0.00 ) nbat 1 nbpic 1
30,HN-30,HB2 h 1300 F1= 1.943 F2= 8.411 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 2
31,HA-28,HB* d 1023 F1= 1.410 F2= 4.622 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
31,HA-31,HB* d 194 F1= 2.090 F2= 4.619 null null d= 2.5 0.62 ( 0.30 ) nbat 1 nbpic 2
31,HA-31,HG2 d 193 F1= 1.954 F2= 4.624 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
31,HA-31,HG3 d 195 F1= 2.442 F2= 4.622 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
31,HA-35,HG1* d 1025 F1= 1.033 F2= 4.626 null null d= 3.1 0.78 ( 0.00 ) nbat 1 nbpic 1
31,HB*-12,HB* h 1614 F1= 2.110 F2= 1.891 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
31,HG2-12,HG2 h 1560 F1= 1.965 F2= 1.399 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
31,HG3-12,HG2 h 1011 F1= 2.449 F2= 1.408 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 1
31,HG3-31,HG2 d 659 F1= 1.964 F2= 2.446 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
31,HG3-35,HG2* d 1050 F1= 2.443 F2= 0.614 null null d= 3.3 0.82 ( 0.10 ) nbat 1 nbpic 2
31,HN-28,HB* h 1280 F1= 1.399 F2= 8.060 null null d= 2.5 0.62 ( 0.10 ) nbat 1 nbpic 2
31,HN-30,HA h 1124 F1= 4.316 F2= 8.055 null null d= 2.1 0.31 ( 0.20 ) nbat 1 nbpic 2
31,HN-31,HA h 166 F1= 8.058 F2= 4.615 null null d= 2.6 0.39 ( 0.00 ) nbat 1 nbpic 1
31,HN-31,HB* h 1305 F1= 2.071 F2= 8.057 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
31,HN-31,HG2or30,HB2 h 1306 F1= 1.951 F2= 8.062 null null d= 4.0 1.80 ( 0.90 ) nbat 2 nbpic 2
31,HN-36,HE* h 409 F1= 8.057 F2= 6.826 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
32,HA-32,HB3 d 198 F1= 2.091 F2= 4.344 null null d= 2.6 0.77 ( 0.39 ) nbat 1 nbpic 3
32,HA-32,HD* d 306 F1= 3.290 F2= 4.344 null null d= 3.9 1.00 ( 0.50 ) nbat 1 nbpic 2
32,HA-32,HG* d 196 F1= 1.753 F2= 4.345 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
32,HB2-35,HG2* d 678 F1= 0.609 F2= 1.894 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
32,HB3-32,HB2 d 1013 F1= 2.108 F2= 1.881 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
32,HB3-35,HG1* d 670 F1= 1.031 F2= 2.092 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 4
32,HB3-35,HG2* d 675 F1= 0.610 F2= 2.095 null null d= 2.5 0.63 ( 0.09 ) nbat 1 nbpic 3
32,HB3or31,HB*-28,HB*or12,HG2 h 1033 F1= 2.088 F2= 1.405 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 2
32,HD*-32,HB2 h 49 F1= 1.842 F2= 3.291 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 2
32,HD*-32,HB3 d 199 F1= 2.094 F2= 3.288 null null d= 2.5 0.63 ( 0.19 ) nbat 1 nbpic 4
32,HD*-35,HB d 641 F1= 1.820 F2= 3.292 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 1
32,HD*-35,HG1* d 622 F1= 1.028 F2= 3.291 null null d= 4.0 1.00 ( 0.00 ) nbat 1 nbpic 1
32,HG*-35,HG1* d 685 F1= 1.032 F2= 1.763 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
32,HG*or27,HG*-35,HG2* d 677 F1= 0.611 F2= 1.761 null null d= 2.8 0.71 ( 0.05 ) nbat 2 nbpic 2
32,HN-28,HB* h 1486 F1= 1.398 F2= 8.520 null null d= 2.9 0.71 ( 0.25 ) nbat 1 nbpic 2
32,HN-31,HA h 483 F1= 8.519 F2= 4.617 null null d= 2.0 0.30 ( 0.00 ) nbat 1 nbpic 1
32,HN-32,HA h 43 F1= 8.517 F2= 4.341 null null d= 2.4 0.36 ( 0.00 ) nbat 1 nbpic 1
32,HN-32,HB2 h 1304 F1= 1.857 F2= 8.520 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
32,HN-32,HB3 h 1316 F1= 2.079 F2= 8.522 null null d= 1.9 0.47 ( 0.10 ) nbat 1 nbpic 2
32,HN-32,HD* h 1613 F1= 8.517 F2= 3.297 null null d= 3.8 0.95 ( 0.00 ) nbat 1 nbpic 1
32,HN-32,HG* h 1302 F1= 1.757 F2= 8.520 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 2
32,HN-35,HG1* h 1274 F1= 1.033 F2= 8.519 null null d= 2.8 0.70 ( 0.10 ) nbat 1 nbpic 2
33,HAor14,HA-33,HB*or14,HD3 h 50 F1= 1.886 F2= 4.324 null null d= 2.1 0.53 ( 0.00 ) nbat 2 nbpic 1
33,HAor32,HA-33,HB*or32,HB2 d 197 F1= 1.880 F2= 4.335 null null d= 2.2 0.55 ( 0.20 ) nbat 2 nbpic 2
33,HB*or27,HB2-33,HD*or27,HG* h 1522 F1= 1.887 F2= 1.760 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 1
33,HN-33,HB* h 1301 F1= 1.881 F2= 8.475 null null d= 2.7 0.66 ( 0.05 ) nbat 1 nbpic 2
34,HA-34,HB* d 202 F1= 2.613 F2= 4.243 null null d= 2.5 0.62 ( 0.24 ) nbat 1 nbpic 3
34,HA-37,HB d 33 F1= 2.303 F2= 4.242 null null d= 2.0 0.49 ( 0.17 ) nbat 1 nbpic 3
34,HA-37,HG1* d 583 F1= 0.932 F2= 4.244 null null d= 2.6 0.65 ( 0.33 ) nbat 1 nbpic 3
34,HAor13,HA-34,HB*or13,HB3 h 874 F1= 4.253 F2= 2.626 null null d= 3.0 0.75 ( 0.00 ) nbat 2 nbpic 1
34,HN-31,HB* h 1346 F1= 2.086 F2= 8.776 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
34,HN-33,HD* h 548 F1= 8.774 F2= 1.760 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
34,HN-34,HA h 1083 F1= 4.243 F2= 8.776 null null d= 2.5 0.37 ( 0.15 ) nbat 1 nbpic 2
34,HN-34,HB* h 1337 F1= 2.626 F2= 8.772 null null d= 2.2 0.56 ( 0.15 ) nbat 1 nbpic 2
34,HN-35,HN h 399 F1= 8.776 F2= 7.465 null null d= 3.1 0.46 ( 0.30 ) nbat 1 nbpic 2
35,HA-35,HB d 203 F1= 1.840 F2= 3.641 null null d= 2.7 0.68 ( 0.21 ) nbat 1 nbpic 3
35,HA-35,HG1* d 204 F1= 1.031 F2= 3.638 null null d= 2.1 0.53 ( 0.11 ) nbat 1 nbpic 4
35,HA-35,HG2* d 205 F1= 0.609 F2= 3.640 null null d= 2.3 0.58 ( 0.04 ) nbat 1 nbpic 4
35,HA-38,HB2 d 608 F1= 2.189 F2= 3.641 null null d= 2.8 0.71 ( 0.13 ) nbat 1 nbpic 4
35,HA-38,HB3 d 805 F1= 3.634 F2= 2.264 null null d= 3.0 0.75 ( 0.10 ) nbat 1 nbpic 2
35,HB-35,HG1* d 206 F1= 1.032 F2= 1.840 null null d= 1.9 0.47 ( 0.05 ) nbat 1 nbpic 3
35,HB-35,HG2* d 207 F1= 0.609 F2= 1.839 null null d= 2.0 0.51 ( 0.11 ) nbat 1 nbpic 4
35,HBor32,HB2-35,HG1* h 250 F1= 1.034 F2= 1.832 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 1
35,HG1*-35,HG2* d 208 F1= 0.608 F2= 1.035 null null d= 2.0 0.51 ( 0.15 ) nbat 1 nbpic 4
35,HN-31,HG2 h 576 F1= 7.460 F2= 1.957 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
35,HN-34,HB* h 1195 F1= 2.626 F2= 7.466 null null d= 3.1 0.78 ( 0.00 ) nbat 1 nbpic 2
35,HN-35,HA h 1214 F1= 3.637 F2= 7.463 null null d= 2.3 0.35 ( 0.05 ) nbat 1 nbpic 2
35,HN-35,HB h 1185 F1= 1.831 F2= 7.464 null null d= 1.9 0.49 ( 0.05 ) nbat 1 nbpic 2
35,HN-35,HG1* h 1168 F1= 1.034 F2= 7.466 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
35,HN-35,HG2* h 245 F1= 7.467 F2= 0.611 null null d= 3.6 0.90 ( 0.00 ) nbat 1 nbpic 1
35,HN-36,HN h 436 F1= 7.466 F2= 7.028 null null d= 2.2 0.32 ( 0.05 ) nbat 1 nbpic 2
36,HA-19,HD2* d 579 F1= 1.134 F2= 4.294 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
36,HA-35,HG2* d 587 F1= 0.608 F2= 4.293 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
36,HA-36,HB2 d 209 F1= 3.084 F2= 4.298 null null d= 2.5 0.63 ( 0.13 ) nbat 1 nbpic 4
36,HA-36,HB3 d 210 F1= 3.143 F2= 4.297 null null d= 2.6 0.65 ( 0.27 ) nbat 1 nbpic 4
36,HA-39,HB3 d 225 F1= 2.187 F2= 4.290 null null d= 2.3 0.57 ( 0.16 ) nbat 1 nbpic 3
36,HA-39,HD1* d 222 F1= 0.915 F2= 4.292 null null d= 2.6 0.66 ( 0.25 ) nbat 1 nbpic 3
36,HB2-12,HG3 d 1017 F1= 3.075 F2= 1.458 null null d= 2.7 0.68 ( 0.10 ) nbat 1 nbpic 2
36,HB2-15,HB2 h 1509 F1= 1.324 F2= 3.086 null null d= 2.8 1.10 ( 0.55 ) nbat 1 nbpic 2
36,HB2-15,HD1* d 627 F1= 0.794 F2= 3.087 null null d= 2.5 0.63 ( 0.04 ) nbat 1 nbpic 4
36,HB2-15,HD2* d 630 F1= 0.830 F2= 3.094 null null d= 3.0 0.74 ( 0.15 ) nbat 1 nbpic 2
36,HB2-19,HD2* d 633 F1= 1.134 F2= 3.092 null null d= 3.4 1.52 ( 0.76 ) nbat 1 nbpic 3
36,HB2-37,HG1* d 859 F1= 3.085 F2= 0.931 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
36,HB3-15,HB2 d 1003 F1= 3.134 F2= 1.328 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 4
36,HB3-15,HD1* d 628 F1= 0.795 F2= 3.138 null null d= 3.1 1.42 ( 0.71 ) nbat 1 nbpic 4
36,HB3-15,HD2* d 629 F1= 0.829 F2= 3.145 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 2
36,HB3-19,HD2* d 634 F1= 1.133 F2= 3.141 null null d= 2.4 0.61 ( 0.08 ) nbat 1 nbpic 4
36,HD*-12,HB* h 1181 F1= 1.885 F2= 6.974 null null d= 3.1 0.79 ( 0.25 ) nbat 1 nbpic 2
36,HD*-12,HG3 d 409 F1= 6.987 F2= 1.455 null null d= 2.7 0.68 ( 0.10 ) nbat 1 nbpic 2
36,HD*-15,HB2 d 411 F1= 6.987 F2= 1.332 null null d= 3.7 0.91 ( 0.05 ) nbat 1 nbpic 2
36,HD*-15,HD1* d 432 F1= 6.989 F2= 0.795 null null d= 3.0 0.76 ( 0.19 ) nbat 1 nbpic 3
36,HD*-15,HD2* d 433 F1= 6.993 F2= 0.834 null null d= 3.1 0.78 ( 0.08 ) nbat 1 nbpic 3
36,HD*-16,HA d 362 F1= 6.986 F2= 3.582 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
36,HD*-19,HD1* d 431 F1= 6.990 F2= 0.735 null null d= 3.2 0.79 ( 0.05 ) nbat 1 nbpic 2
36,HD*-19,HD2* d 420 F1= 6.988 F2= 1.138 null null d= 2.2 0.56 ( 0.04 ) nbat 1 nbpic 4
36,HD*-26,HD2* d 517 F1= 0.958 F2= 6.991 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
36,HD*-27,HD2 d 363 F1= 6.988 F2= 3.477 null null d= 4.1 1.02 ( 0.00 ) nbat 1 nbpic 1
36,HD*-31,HB* d 389 F1= 6.989 F2= 2.081 null null d= 3.0 0.75 ( 0.10 ) nbat 1 nbpic 2
36,HD*-31,HG2 d 399 F1= 6.988 F2= 1.955 null null d= 3.4 0.86 ( 0.23 ) nbat 1 nbpic 4
36,HD*-31,HG3 h 1190 F1= 2.450 F2= 6.970 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
36,HD*-35,HB d 400 F1= 6.990 F2= 1.843 null null d= 3.2 0.80 ( 0.40 ) nbat 1 nbpic 2
36,HD*-35,HBor26,HG d 493 F1= 1.853 F2= 6.995 null null d= 3.2 0.79 ( 0.05 ) nbat 2 nbpic 2
36,HD*-35,HG2* d 437 F1= 6.987 F2= 0.613 null null d= 3.7 0.92 ( 0.12 ) nbat 1 nbpic 3
36,HD*-36,HA d 348 F1= 6.988 F2= 4.296 null null d= 2.3 0.59 ( 0.29 ) nbat 1 nbpic 3
36,HD*-36,HB2 d 371 F1= 6.986 F2= 3.087 null null d= 2.2 0.54 ( 0.11 ) nbat 1 nbpic 4
36,HD*-36,HB3 d 370 F1= 6.987 F2= 3.139 null null d= 2.2 0.54 ( 0.13 ) nbat 1 nbpic 4
36,HD*-36,HE* d 3 F1= 6.831 F2= 6.991 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
36,HD*-39,HB2 d 410 F1= 6.987 F2= 1.401 null null d= 3.0 0.94 ( 0.47 ) nbat 1 nbpic 3
36,HD*-39,HB2or12,HG2 h 1172 F1= 1.402 F2= 6.976 null null d= 3.3 0.82 ( 0.00 ) nbat 2 nbpic 1
36,HD*-39,HB3or19,HB3 d 390 F1= 6.986 F2= 2.197 null null d= 3.8 0.95 ( 0.00 ) nbat 2 nbpic 1
36,HD*-39,HD1*or26,HD1* d 426 F1= 6.987 F2= 0.925 null null d= 2.2 0.56 ( 0.05 ) nbat 2 nbpic 4
36,HE*-16,HD* d 412 F1= 6.831 F2= 1.475 null null d= 2.8 0.70 ( 0.12 ) nbat 1 nbpic 4
36,HE*-16,HG2 d 525 F1= 0.708 F2= 6.838 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
36,HE*-19,HD1*or16,HG2 d 439 F1= 6.830 F2= 0.721 null null d= 4.0 2.10 ( 1.05 ) nbat 2 nbpic 2
36,HE*-19,HD2* d 423 F1= 6.832 F2= 1.141 null null d= 3.2 0.79 ( 0.05 ) nbat 1 nbpic 2
36,HE*-26,HA d 345 F1= 6.833 F2= 4.634 null null d= 3.0 0.76 ( 0.35 ) nbat 1 nbpic 2
36,HE*-26,HB2 d 405 F1= 6.831 F2= 1.611 null null d= 2.9 0.71 ( 0.05 ) nbat 1 nbpic 4
36,HE*-26,HB3 d 402 F1= 6.832 F2= 1.763 null null d= 3.2 1.07 ( 0.54 ) nbat 1 nbpic 4
36,HE*-26,HD1* d 424 F1= 6.831 F2= 0.925 null null d= 2.4 0.60 ( 0.12 ) nbat 1 nbpic 4
36,HE*-26,HD2* d 425 F1= 6.831 F2= 0.961 null null d= 2.5 0.64 ( 0.05 ) nbat 1 nbpic 2
36,HE*-26,HG d 404 F1= 6.833 F2= 1.883 null null d= 3.2 0.80 ( 0.30 ) nbat 1 nbpic 2
36,HE*-27,HD2 d 360 F1= 6.832 F2= 3.477 null null d= 2.4 0.61 ( 0.08 ) nbat 1 nbpic 4
36,HE*-27,HD3 d 351 F1= 6.832 F2= 3.721 null null d= 3.2 0.80 ( 0.10 ) nbat 1 nbpic 2
36,HE*-28,HB* d 413 F1= 6.830 F2= 1.406 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 2
36,HE*-31,HB* d 393 F1= 6.831 F2= 2.086 null null d= 3.2 0.81 ( 0.05 ) nbat 1 nbpic 2
36,HE*-31,HG2 d 401 F1= 6.831 F2= 1.949 null null d= 2.9 0.72 ( 0.17 ) nbat 1 nbpic 3
36,HE*-35,HG2* d 438 F1= 6.833 F2= 0.613 null null d= 3.5 0.90 ( 0.45 ) nbat 1 nbpic 3
36,HE*-36,HA d 349 F1= 6.831 F2= 4.301 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
36,HE*-36,HB2 d 372 F1= 6.831 F2= 3.082 null null d= 3.0 0.74 ( 0.22 ) nbat 1 nbpic 4
36,HE*-36,HB3 d 373 F1= 6.831 F2= 3.142 null null d= 3.5 0.86 ( 0.05 ) nbat 1 nbpic 2
36,HN-12,HG2 h 1173 F1= 1.402 F2= 7.027 null null d= 3.1 0.77 ( 0.20 ) nbat 1 nbpic 2
36,HN-35,HA h 693 F1= 7.029 F2= 3.643 null null d= 3.2 0.48 ( 0.00 ) nbat 1 nbpic 1
36,HN-36,HA h 379 F1= 7.030 F2= 4.289 null null d= 2.7 0.41 ( 0.00 ) nbat 1 nbpic 1
36,HN-36,HB2 h 1203 F1= 3.079 F2= 7.025 null null d= 2.3 0.59 ( 0.05 ) nbat 1 nbpic 2
36,HN-36,HB3 h 1201 F1= 3.145 F2= 7.024 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 2
37,HA-12,HG3 d 998 F1= 3.416 F2= 1.460 null null d= 3.0 0.74 ( 0.25 ) nbat 1 nbpic 3
37,HA-15,HD1* d 621 F1= 0.794 F2= 3.419 null null d= 2.9 0.75 ( 0.37 ) nbat 1 nbpic 3
37,HA-15,HD2* d 620 F1= 0.829 F2= 3.419 null null d= 2.4 0.60 ( 0.07 ) nbat 1 nbpic 4
37,HA-37,HB d 211 F1= 2.312 F2= 3.413 null null d= 2.4 0.60 ( 0.16 ) nbat 1 nbpic 4
37,HA-37,HG2*or37,HG1* d 212 F1= 0.932 F2= 3.416 null null d= 2.0 0.49 ( 0.08 ) nbat 2 nbpic 4
37,HA-40,HB2 d 801 F1= 3.414 F2= 2.848 null null d= 2.9 0.71 ( 0.15 ) nbat 1 nbpic 2
37,HB-37,HG2*or37,HG1* d 672 F1= 0.927 F2= 2.313 null null d= 1.9 0.47 ( 0.00 ) nbat 2 nbpic 1
37,HG1*-15,HD1* d 936 F1= 0.935 F2= 0.798 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
37,HN-34,HA h 496 F1= 8.244 F2= 4.243 null null d= 2.6 0.39 ( 0.00 ) nbat 1 nbpic 1
37,HN-36,HB2 h 1332 F1= 3.077 F2= 8.239 null null d= 2.7 0.66 ( 0.05 ) nbat 1 nbpic 2
37,HN-36,HD* h 471 F1= 8.242 F2= 6.981 null null d= 3.7 0.93 ( 0.00 ) nbat 1 nbpic 1
37,HN-36,HN h 406 F1= 8.245 F2= 7.028 null null d= 2.1 0.32 ( 0.00 ) nbat 1 nbpic 2
37,HN-37,HA h 1114 F1= 3.416 F2= 8.240 null null d= 2.6 0.39 ( 0.00 ) nbat 1 nbpic 2
37,HN-37,HB h 123 F1= 8.244 F2= 2.304 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 2
37,HN-37,HG1* h 1268 F1= 0.932 F2= 8.246 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
37,HN-38,HN h 420 F1= 8.242 F2= 8.038 null null d= 1.9 0.28 ( 0.05 ) nbat 1 nbpic 2
37,HNor22,HD22-36,HAor18,HA h 491 F1= 8.245 F2= 4.299 null null d= 2.4 0.60 ( 0.00 ) nbat 2 nbpic 1
38,HA-38,HB2 d 216 F1= 2.187 F2= 4.089 null null d= 2.6 0.64 ( 0.29 ) nbat 1 nbpic 3
38,HA-38,HB3 d 215 F1= 2.257 F2= 4.092 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 1
38,HA-38,HG2 d 214 F1= 2.504 F2= 4.090 null null d= 3.1 0.78 ( 0.29 ) nbat 1 nbpic 3
38,HA-38,HG3 d 213 F1= 2.552 F2= 4.090 null null d= 3.0 0.75 ( 0.14 ) nbat 1 nbpic 3
38,HA-41,HB3 d 557 F1= 2.139 F2= 4.091 null null d= 2.5 0.62 ( 0.14 ) nbat 1 nbpic 3
38,HAor17,HB3-41,HB2or14,HG2 d 762 F1= 4.086 F2= 1.472 null null d= 2.3 0.57 ( 0.00 ) nbat 2 nbpic 1
38,HE21-35,HA h 692 F1= 6.871 F2= 3.660 null null d= 3.7 0.93 ( 0.00 ) nbat 1 nbpic 1
38,HE22-38,HG3 h 1226 F1= 2.550 F2= 7.594 null null d= 2.9 0.73 ( 0.20 ) nbat 1 nbpic 2
38,HE22or23,HD22-38,HE21or23,HD21 h 388 F1= 7.593 F2= 6.864 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 2
38,HG2-38,HB2 d 217 F1= 2.188 F2= 2.509 null null d= 2.2 0.54 ( 0.08 ) nbat 1 nbpic 4
38,HG2-38,HB3 d 220 F1= 2.258 F2= 2.509 null null d= 2.1 0.52 ( 0.15 ) nbat 1 nbpic 4
38,HG3-38,HB2 d 218 F1= 2.187 F2= 2.554 null null d= 2.2 0.56 ( 0.09 ) nbat 1 nbpic 3
38,HG3-38,HB3 d 219 F1= 2.253 F2= 2.555 null null d= 2.1 0.52 ( 0.13 ) nbat 1 nbpic 4
38,HN-35,HA h 1399 F1= 8.039 F2= 3.636 null null d= 3.2 0.48 ( 0.00 ) nbat 1 nbpic 1
38,HN-37,HA h 495 F1= 8.037 F2= 3.411 null null d= 3.3 0.49 ( 0.00 ) nbat 1 nbpic 1
38,HN-37,HB h 587 F1= 8.038 F2= 2.301 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 1
38,HN-38,HB2 h 1308 F1= 2.190 F2= 8.040 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
38,HN-38,HB3 h 1416 F1= 8.039 F2= 2.256 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
38,HN-38,HG2 h 1229 F1= 2.529 F2= 8.038 null null d= 3.0 0.74 ( 0.15 ) nbat 1 nbpic 2
39,HA-39,HB2 h 1379 F1= 4.255 F2= 1.416 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 1
39,HA-39,HD2* d 223 F1= 1.032 F2= 4.282 null null d= 2.2 0.56 ( 0.21 ) nbat 1 nbpic 4
39,HA-39,HG d 561 F1= 1.979 F2= 4.282 null null d= 2.6 0.65 ( 0.30 ) nbat 1 nbpic 2
39,HA-42,HB2 d 566 F1= 1.778 F2= 4.280 null null d= 2.5 0.61 ( 0.25 ) nbat 1 nbpic 2
39,HA-42,HB3 d 560 F1= 2.073 F2= 4.288 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
39,HAor36,HA-24,HG1* d 590 F1= 0.445 F2= 4.285 null null d= 3.9 0.97 ( 0.00 ) nbat 2 nbpic 1
39,HB2-19,HD1* h 834 F1= 0.733 F2= 1.413 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
39,HB2-24,HG1* d 1040 F1= 0.443 F2= 1.423 null null d= 2.5 0.64 ( 0.15 ) nbat 1 nbpic 2
39,HB2-35,HG2* d 1041 F1= 0.610 F2= 1.419 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
39,HB2-39,HD1* h 1054 F1= 1.429 F2= 0.912 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
39,HB2-39,HD2* d 231 F1= 1.031 F2= 1.422 null null d= 1.9 0.47 ( 0.08 ) nbat 1 nbpic 4
39,HB2or28,HB*-35,HG2* d 924 F1= 1.407 F2= 0.616 null null d= 2.7 0.80 ( 0.40 ) nbat 2 nbpic 2
39,HB3-35,HG2* d 700 F1= 0.609 F2= 2.181 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
39,HB3-39,HB2 d 663 F1= 1.420 F2= 2.190 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
39,HB3-39,HD1* d 228 F1= 0.917 F2= 2.200 null null d= 2.1 0.51 ( 0.22 ) nbat 1 nbpic 4
39,HB3-39,HD2* d 229 F1= 1.034 F2= 2.190 null null d= 2.4 0.61 ( 0.04 ) nbat 1 nbpic 4
39,HB3or19,HB3-24,HG1* d 1049 F1= 2.200 F2= 0.447 null null d= 3.7 1.50 ( 0.75 ) nbat 2 nbpic 2
39,HD1*-35,HG2* d 926 F1= 0.913 F2= 0.615 null null d= 2.0 0.50 ( 0.16 ) nbat 1 nbpic 3
39,HD2*-19,HD1* d 1043 F1= 1.035 F2= 0.736 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 2
39,HD2*-24,HG1* d 919 F1= 1.033 F2= 0.448 null null d= 2.6 0.66 ( 0.12 ) nbat 1 nbpic 3
39,HD2*-39,HD1* d 927 F1= 1.032 F2= 0.921 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
39,HG-35,HG2* d 676 F1= 0.610 F2= 1.975 null null d= 2.3 0.57 ( 0.11 ) nbat 1 nbpic 4
39,HG-39,HD1* d 226 F1= 0.913 F2= 1.980 null null d= 2.2 1.02 ( 0.51 ) nbat 1 nbpic 4
39,HG-39,HD2* d 227 F1= 1.033 F2= 1.980 null null d= 1.9 0.48 ( 0.08 ) nbat 1 nbpic 4
39,HN-19,HD2* h 618 F1= 7.999 F2= 1.128 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
39,HN-38,HA h 1410 F1= 8.004 F2= 4.090 null null d= 2.8 0.42 ( 0.00 ) nbat 1 nbpic 1
39,HN-38,HB3 h 1415 F1= 7.999 F2= 2.261 null null d= 2.7 0.68 ( 0.10 ) nbat 1 nbpic 2
39,HN-39,HA h 1123 F1= 4.276 F2= 7.997 null null d= 2.7 0.90 ( 0.45 ) nbat 1 nbpic 2
39,HN-39,HB2 h 218 F1= 8.001 F2= 1.410 null null d= 4.5 1.12 ( 0.00 ) nbat 1 nbpic 1
39,HN-39,HB3or38,HB2 h 1307 F1= 2.183 F2= 7.998 null null d= 2.0 0.50 ( 0.00 ) nbat 2 nbpic 2
39,HN-39,HD1* h 376 F1= 7.999 F2= 0.912 null null d= 3.9 0.97 ( 0.00 ) nbat 1 nbpic 1
39,HN-39,HG h 1294 F1= 1.969 F2= 8.000 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
4,HA-4,HB2 d 20 F1= 1.112 F2= 4.178 null null d= 2.4 0.59 ( 0.07 ) nbat 1 nbpic 5
4,HA-4,HB3 d 827 F1= 4.173 F2= 1.393 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
4,HA-4,HD1* d 18 F1= 0.850 F2= 4.179 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
4,HA-4,HG d 22 F1= 1.864 F2= 4.181 null null d= 3.2 1.16 ( 0.58 ) nbat 1 nbpic 3
4,HB2-10,HD1* h 838 F1= 0.784 F2= 1.128 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 1
4,HB2-4,HD1* d 31 F1= 0.851 F2= 1.135 null null d= 1.9 0.48 ( 0.13 ) nbat 1 nbpic 4
4,HB2-4,HD2* d 30 F1= 0.880 F2= 1.131 null null d= 2.0 0.49 ( 0.17 ) nbat 1 nbpic 3
4,HB3-10,HD1* d 1038 F1= 0.773 F2= 1.381 null null d= 2.0 0.49 ( 0.05 ) nbat 1 nbpic 3
4,HB3-4,HB2 d 913 F1= 1.384 F2= 1.130 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
4,HB3-4,HD1* d 27 F1= 0.838 F2= 1.390 null null d= 1.9 0.48 ( 0.08 ) nbat 1 nbpic 3
4,HB3-4,HD2* d 28 F1= 0.877 F2= 1.399 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 1
4,HG-4,HD1* d 679 F1= 0.840 F2= 1.876 null null d= 2.0 0.49 ( 0.08 ) nbat 1 nbpic 4
4,HN-3,HA h 492 F1= 8.697 F2= 4.820 null null d= 2.2 0.33 ( 0.00 ) nbat 1 nbpic 1
4,HN-3,HB3 h 1335 F1= 3.146 F2= 8.695 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 2
4,HN-4,HA h 6 F1= 8.703 F2= 4.178 null null d= 2.6 0.39 ( 0.00 ) nbat 1 nbpic 1
4,HN-4,HB2 h 1359 F1= 1.117 F2= 8.703 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
4,HN-4,HB3 h 1355 F1= 1.387 F2= 8.698 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 2
4,HN-4,HG h 1343 F1= 1.858 F2= 8.697 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
40,HA-19,HD1* d 127 F1= 0.733 F2= 3.869 null null d= 1.9 0.47 ( 0.07 ) nbat 1 nbpic 4
40,HA-40,HB2 d 234 F1= 2.846 F2= 3.856 null null d= 2.4 0.60 ( 0.24 ) nbat 1 nbpic 4
40,HA-40,HB3 d 233 F1= 3.518 F2= 3.857 null null d= 2.1 0.53 ( 0.15 ) nbat 1 nbpic 4
40,HA-44,HB* d 591 F1= -0.391 F2= 3.879 null null d= 2.3 0.57 ( 0.10 ) nbat 1 nbpic 2
40,HAor25,HA-44,HGor26,HD1* d 247 F1= 0.934 F2= 3.880 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 2
40,HAor25,HAor19,HA-24,HG1* d 589 F1= 0.443 F2= 3.873 null null d= 3.0 0.75 ( 0.00 ) nbat 3 nbpic 1
40,HB2-19,HD1* d 635 F1= 0.732 F2= 2.850 null null d= 2.8 0.69 ( 0.26 ) nbat 1 nbpic 4
40,HB2-19,HD2* d 844 F1= 2.850 F2= 1.136 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
40,HB2-4,HD1* d 636 F1= 0.828 F2= 2.850 null null d= 2.7 0.67 ( 0.21 ) nbat 1 nbpic 3
40,HB2-44,HG d 847 F1= 2.852 F2= 0.924 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
40,HB3-15,HD2* d 840 F1= 3.518 F2= 0.833 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
40,HB3-37,HA d 643 F1= 3.411 F2= 3.524 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 2
40,HB3-40,HB2 d 235 F1= 2.844 F2= 3.524 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
40,HD*-40,HE* d 2 F1= 7.110 F2= 6.811 null null d= 2.5 0.61 ( 0.05 ) nbat 1 nbpic 2
40,HE*or36,HE*-41,HD1*or26,HD2* h 1144 F1= 0.959 F2= 6.830 null null d= 2.9 0.71 ( 0.35 ) nbat 2 nbpic 2
40,HE*or36,HE*-46,HB*or28,HB* h 1138 F1= 1.403 F2= 6.828 null null d= 2.5 0.64 ( 0.05 ) nbat 2 nbpic 2
40,HN-19,HD1* h 629 F1= 8.572 F2= 0.734 null null d= 3.7 0.93 ( 0.00 ) nbat 1 nbpic 1
40,HN-37,HA h 1333 F1= 3.413 F2= 8.573 null null d= 3.4 0.51 ( 0.20 ) nbat 1 nbpic 2
40,HN-39,HB3 h 1435 F1= 8.576 F2= 2.186 null null d= 2.6 0.65 ( 0.20 ) nbat 1 nbpic 2
40,HN-39,HN h 416 F1= 8.572 F2= 7.999 null null d= 2.3 0.34 ( 0.00 ) nbat 1 nbpic 2
40,HN-40,HA h 1110 F1= 3.849 F2= 8.570 null null d= 2.5 0.38 ( 0.05 ) nbat 1 nbpic 2
40,HN-40,HB2 h 1329 F1= 2.845 F2= 8.573 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
40,HN-40,HB3 h 1115 F1= 3.515 F2= 8.572 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 2
40,HNor26,HN-20,HG1*or19,HD2* h 1439 F1= 8.575 F2= 1.131 null null d= 3.0 0.75 ( 0.00 ) nbat 2 nbpic 1
40,HNor26,HNor18,HN-37,HNor25,HNor22,HD22 h 463 F1= 8.570 F2= 8.229 null null d= 2.8 0.70 ( 0.00 ) nbat 3 nbpic 1
41,HA-41,HB2 d 1021 F1= 1.493 F2= 4.417 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 2
41,HA-41,HB3 d 238 F1= 2.141 F2= 4.414 null null d= 2.6 0.66 ( 0.15 ) nbat 1 nbpic 2
41,HA-41,HD1* d 236 F1= 0.970 F2= 4.410 null null d= 3.6 0.90 ( 0.00 ) nbat 1 nbpic 1
41,HA-41,HD2* d 237 F1= 1.106 F2= 4.413 null null d= 2.3 0.57 ( 0.24 ) nbat 1 nbpic 4
41,HA-41,HG d 1024 F1= 1.853 F2= 4.417 null null d= 2.7 0.66 ( 0.05 ) nbat 1 nbpic 2
41,HB2or16,HD*-41,HD1*or26,HD2* d 239 F1= 0.966 F2= 1.492 null null d= 1.9 0.48 ( 0.09 ) nbat 2 nbpic 3
41,HB3-41,HB2 d 662 F1= 1.493 F2= 2.144 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
41,HB3-41,HD2* d 674 F1= 1.107 F2= 2.139 null null d= 2.4 0.60 ( 0.10 ) nbat 1 nbpic 2
41,HB3or20,HB-41,HD1*or20,HG2* h 1021 F1= 2.111 F2= 0.983 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 1
41,HD2*or16,HG3-41,HD1*or26,HD2* d 326 F1= 0.968 F2= 1.110 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 3
41,HG-41,HD2* d 240 F1= 1.107 F2= 1.858 null null d= 1.9 0.48 ( 0.05 ) nbat 1 nbpic 3
41,HGor26,HG-41,HD1*or26,HD2* d 174 F1= 0.962 F2= 1.866 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 4
41,HGor4,HG-41,HD2*or4,HB2 d 870 F1= 1.852 F2= 1.114 null null d= 1.9 0.47 ( 0.00 ) nbat 2 nbpic 1
41,HN-38,HA h 477 F1= 9.021 F2= 4.085 null null d= 2.8 0.42 ( 0.00 ) nbat 1 nbpic 1
41,HN-40,HB2 h 1336 F1= 2.844 F2= 9.020 null null d= 4.6 1.15 ( 0.00 ) nbat 1 nbpic 1
41,HN-40,HB3 h 1116 F1= 3.515 F2= 9.016 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 2
41,HN-40,HN h 397 F1= 9.020 F2= 8.573 null null d= 2.2 0.34 ( 0.05 ) nbat 1 nbpic 2
41,HN-41,HA h 2 F1= 9.021 F2= 4.406 null null d= 2.3 0.34 ( 0.00 ) nbat 1 nbpic 1
41,HN-41,HB2 h 1353 F1= 1.501 F2= 9.016 null null d= 3.2 0.79 ( 0.05 ) nbat 1 nbpic 2
41,HN-41,HB3 h 1349 F1= 2.138 F2= 9.015 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
41,HN-41,HD2* h 613 F1= 9.019 F2= 1.107 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
41,HN-42,HN h 398 F1= 9.023 F2= 8.346 null null d= 2.3 0.35 ( 0.05 ) nbat 1 nbpic 2
42,HA-42,HB2 h 370 F1= 1.791 F2= 3.914 null null d= 3.0 0.75 ( 0.30 ) nbat 1 nbpic 2
42,HA-42,HB3 h 1595 F1= 3.903 F2= 2.064 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
42,HA-42,HG* d 242 F1= 2.240 F2= 3.904 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 2
42,HA-45,HG2* h 306 F1= 1.322 F2= 3.911 null null d= 2.6 0.66 ( 0.25 ) nbat 1 nbpic 2
42,HE22-42,HE21 h 16 F1= 7.289 F2= 6.676 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
42,HE22-42,HG* h 1421 F1= 7.289 F2= 2.243 null null d= 3.8 0.95 ( 0.00 ) nbat 1 nbpic 1
42,HG*-42,HB2 d 244 F1= 1.776 F2= 2.230 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
42,HN-41,HB2 h 1289 F1= 1.500 F2= 8.346 null null d= 3.4 0.85 ( 0.30 ) nbat 1 nbpic 2
42,HN-42,HA h 109 F1= 8.347 F2= 3.915 null null d= 2.3 0.34 ( 0.10 ) nbat 1 nbpic 2
42,HN-42,HB2 h 1295 F1= 1.779 F2= 8.346 null null d= 2.5 0.62 ( 0.10 ) nbat 1 nbpic 2
42,HN-42,HB3 h 107 F1= 8.345 F2= 2.078 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
43,HA-43,HB2 d 308 F1= 2.769 F2= 4.497 null null d= 2.8 0.69 ( 0.15 ) nbat 1 nbpic 2
43,HA-43,HB3 d 309 F1= 2.853 F2= 4.497 null null d= 2.3 0.59 ( 0.05 ) nbat 1 nbpic 2
43,HB2-24,HG1* d 692 F1= 0.442 F2= 2.778 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 2
43,HB2-24,HG2* d 693 F1= 0.523 F2= 2.778 null null d= 2.8 0.82 ( 0.41 ) nbat 1 nbpic 4
43,HB2-44,HG h 799 F1= 0.937 F2= 2.789 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
43,HB2or16,HE3-44,HGor26,HD2* d 846 F1= 2.784 F2= 0.944 null null d= 2.2 0.55 ( 0.00 ) nbat 2 nbpic 1
43,HB3-24,HG1* d 691 F1= 0.442 F2= 2.852 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 2
43,HB3-24,HG2* d 694 F1= 0.523 F2= 2.848 null null d= 2.5 0.62 ( 0.17 ) nbat 1 nbpic 4
43,HB3-43,HB2 h 1567 F1= 2.776 F2= 2.859 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
43,HD2-19,HD1* d 434 F1= 7.141 F2= 0.741 null null d= 3.6 0.90 ( 0.10 ) nbat 1 nbpic 2
43,HD2-19,HD2* d 414 F1= 7.141 F2= 1.137 null null d= 4.0 1.00 ( 0.00 ) nbat 1 nbpic 1
43,HD2-24,HG1* d 436 F1= 7.141 F2= 0.447 null null d= 2.5 0.62 ( 0.07 ) nbat 1 nbpic 4
43,HD2-24,HG2* d 435 F1= 7.141 F2= 0.528 null null d= 3.4 0.85 ( 0.08 ) nbat 1 nbpic 3
43,HD2-39,HA d 347 F1= 7.141 F2= 4.282 null null d= 2.5 0.64 ( 0.30 ) nbat 1 nbpic 4
43,HD2-39,HB2 d 406 F1= 7.141 F2= 1.427 null null d= 2.7 0.67 ( 0.22 ) nbat 1 nbpic 3
43,HD2-39,HB3 d 382 F1= 7.142 F2= 2.194 null null d= 3.6 0.89 ( 0.21 ) nbat 1 nbpic 3
43,HD2-39,HD2* d 415 F1= 7.141 F2= 1.037 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 4
43,HD2-39,HG d 384 F1= 7.141 F2= 1.981 null null d= 3.9 0.97 ( 0.00 ) nbat 1 nbpic 2
43,HD2-42,HB2 d 396 F1= 7.141 F2= 1.788 null null d= 2.7 0.68 ( 0.19 ) nbat 1 nbpic 3
43,HD2-42,HB3 d 383 F1= 7.141 F2= 2.076 null null d= 2.9 0.73 ( 0.08 ) nbat 1 nbpic 4
43,HD2-43,HA d 346 F1= 7.141 F2= 4.497 null null d= 4.0 1.00 ( 0.00 ) nbat 1 nbpic 1
43,HD2-43,HB2 d 375 F1= 7.141 F2= 2.774 null null d= 2.6 0.65 ( 0.12 ) nbat 1 nbpic 4
43,HD2-43,HB3 d 376 F1= 7.141 F2= 2.853 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 3
43,HD2-44,HG d 416 F1= 7.141 F2= 0.920 null null d= 2.8 0.71 ( 0.05 ) nbat 1 nbpic 2
43,HE1-24,HG1* d 449 F1= 7.799 F2= 0.445 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
43,HE1-24,HG2* d 450 F1= 7.799 F2= 0.530 null null d= 4.2 1.05 ( 0.00 ) nbat 1 nbpic 1
43,HE1-39,HD2* d 451 F1= 7.799 F2= 1.038 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
43,HE1-42,HB2 d 452 F1= 7.799 F2= 1.794 null null d= 3.6 0.90 ( 0.00 ) nbat 1 nbpic 1
43,HE1-43,HD2 d 7 F1= 7.800 F2= 7.146 null null d= 4.0 1.00 ( 0.40 ) nbat 1 nbpic 2
43,HN-42,HA h 1405 F1= 8.120 F2= 3.914 null null d= 2.7 0.41 ( 0.00 ) nbat 1 nbpic 1
43,HN-42,HB2 h 1474 F1= 1.777 F2= 8.112 null null d= 2.5 0.61 ( 0.05 ) nbat 1 nbpic 2
43,HN-42,HB3 h 1430 F1= 8.122 F2= 2.067 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
43,HN-43,HA h 151 F1= 8.119 F2= 4.501 null null d= 2.5 0.38 ( 0.00 ) nbat 1 nbpic 1
43,HN-43,HB2 h 1327 F1= 2.778 F2= 8.119 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 2
43,HN-43,HB3 h 1330 F1= 2.872 F2= 8.123 null null d= 2.7 0.66 ( 0.05 ) nbat 1 nbpic 2
43,HN-43,HD2 h 410 F1= 8.118 F2= 7.153 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 2
44,HA-44,HB* h 131 F1= -0.385 F2= 3.882 null null d= 2.4 0.59 ( 0.25 ) nbat 1 nbpic 2
44,HA-44,HD2* d 246 F1= 0.113 F2= 3.879 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 4
44,HA-47,HD2 d 553 F1= 3.148 F2= 3.879 null null d= 2.8 0.69 ( 0.26 ) nbat 1 nbpic 3
44,HAor19,HA-44,HD1* d 245 F1= 0.070 F2= 3.872 null null d= 2.3 0.57 ( 0.07 ) nbat 2 nbpic 4
44,HD1*-44,HB* d 253 F1= -0.393 F2= 0.074 null null d= 2.2 0.56 ( 0.22 ) nbat 1 nbpic 4
44,HD2*-44,HB* d 252 F1= -0.392 F2= 0.122 null null d= 2.6 0.91 ( 0.46 ) nbat 1 nbpic 4
44,HD2*-44,HD1* d 251 F1= 0.074 F2= 0.115 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 3
44,HG-19,HD1* d 935 F1= 0.918 F2= 0.739 null null d= 1.9 0.47 ( 0.09 ) nbat 1 nbpic 3
44,HG-24,HG2* d 918 F1= 0.921 F2= 0.527 null null d= 2.3 0.66 ( 0.33 ) nbat 1 nbpic 3
44,HG-44,HB* d 250 F1= -0.393 F2= 0.918 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
44,HG-44,HD1* d 249 F1= 0.072 F2= 0.925 null null d= 2.0 0.49 ( 0.05 ) nbat 1 nbpic 3
44,HG-44,HD2* d 248 F1= 0.116 F2= 0.925 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 3
44,HGor39,HD1*or26,HD1*-24,HG1* d 917 F1= 0.917 F2= 0.449 null null d= 2.4 0.62 ( 0.31 ) nbat 3 nbpic 3
44,HN-43,HD2 h 468 F1= 8.341 F2= 7.154 null null d= 3.7 0.93 ( 0.00 ) nbat 1 nbpic 1
44,HN-43,HN h 421 F1= 8.331 F2= 8.118 null null d= 1.8 0.27 ( 0.00 ) nbat 1 nbpic 2
44,HN-44,HD2* h 134 F1= 8.332 F2= 0.119 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
44,HN-45,HN h 403 F1= 8.331 F2= 6.867 null null d= 2.5 0.37 ( 0.05 ) nbat 1 nbpic 2
44,HNor19,HN-19,HD1* h 627 F1= 8.336 F2= 0.735 null null d= 3.8 0.95 ( 0.00 ) nbat 2 nbpic 1
44,HNor19,HN-44,HD1* h 125 F1= 8.328 F2= 0.073 null null d= 4.4 1.10 ( 0.00 ) nbat 2 nbpic 1
45,HBor45,HA-45,HG2* d 254 F1= 1.317 F2= 4.109 null null d= 2.2 0.55 ( 0.19 ) nbat 2 nbpic 4
45,HN-45,HA h 261 F1= 6.870 F2= 4.117 null null d= 2.4 0.36 ( 0.00 ) nbat 1 nbpic 1
45,HN-45,HG2* h 1139 F1= 1.321 F2= 6.870 null null d= 2.1 0.53 ( 0.10 ) nbat 1 nbpic 2
45,HNor38,HE21-41,HD1* h 673 F1= 6.870 F2= 0.971 null null d= 4.4 1.10 ( 0.00 ) nbat 2 nbpic 1
46,HA-3,HB2 h 780 F1= 2.592 F2= 3.661 null null d= 3.8 0.95 ( 0.00 ) nbat 1 nbpic 1
46,HA-46,HB* d 255 F1= 1.419 F2= 3.659 null null d= 2.3 0.58 ( 0.19 ) nbat 1 nbpic 4
46,HA-47,HD2 d 605 F1= 3.145 F2= 3.660 null null d= 2.7 0.68 ( 0.08 ) nbat 1 nbpic 3
46,HA-5,HG2 d 609 F1= 2.262 F2= 3.642 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
46,HB*-41,HD2* d 914 F1= 1.419 F2= 1.111 null null d= 1.8 0.46 ( 0.05 ) nbat 1 nbpic 3
46,HN-46,HA h 1113 F1= 3.662 F2= 8.329 null null d= 2.5 0.38 ( 0.15 ) nbat 1 nbpic 2
46,HN-46,HB* h 105 F1= 8.332 F2= 1.416 null null d= 3.2 0.80 ( 0.40 ) nbat 1 nbpic 2
46,HN-47,HG2 h 104 F1= 8.350 F2= 1.721 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
46,HNor19,HN-45,HG2*or15,HB2 h 1440 F1= 8.332 F2= 1.316 null null d= 2.9 0.72 ( 0.00 ) nbat 2 nbpic 1
47,HA-47,HB3 h 230 F1= 2.117 F2= 4.226 null null d= 2.5 1.00 ( 0.50 ) nbat 1 nbpic 2
47,HA-47,HG2 d 256 F1= 1.702 F2= 4.219 null null d= 2.5 0.64 ( 0.15 ) nbat 1 nbpic 2
47,HA-47,HG3 d 773 F1= 4.215 F2= 1.809 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
47,HD2-44,HD2* d 624 F1= 0.116 F2= 3.159 null null d= 3.0 0.76 ( 0.15 ) nbat 1 nbpic 2
47,HD2-47,HB2 d 262 F1= 2.075 F2= 3.153 null null d= 2.6 0.78 ( 0.39 ) nbat 1 nbpic 4
47,HD2-47,HG2 d 260 F1= 1.698 F2= 3.161 null null d= 2.9 0.99 ( 0.50 ) nbat 1 nbpic 4
47,HD2-47,HG3 d 639 F1= 1.810 F2= 3.161 null null d= 2.8 0.70 ( 0.31 ) nbat 1 nbpic 4
47,HD2or36,HB3-44,HGor37,HG1* d 858 F1= 3.146 F2= 0.925 null null d= 3.1 0.78 ( 0.00 ) nbat 2 nbpic 1
47,HD3-44,HD2* d 625 F1= 0.117 F2= 3.265 null null d= 3.4 0.85 ( 0.20 ) nbat 1 nbpic 2
47,HD3-47,HB2 h 1582 F1= 3.259 F2= 2.066 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
47,HD3-47,HB3 d 1015 F1= 3.264 F2= 2.149 null null d= 2.7 0.67 ( 0.08 ) nbat 1 nbpic 3
47,HD3-47,HD2 d 307 F1= 3.156 F2= 3.262 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
47,HD3-47,HG2 h 165 F1= 1.722 F2= 3.248 null null d= 2.7 0.68 ( 0.20 ) nbat 1 nbpic 2
47,HE-47,HD2 h 1420 F1= 7.076 F2= 3.155 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
47,HE-47,HG3 h 314 F1= 7.080 F2= 1.808 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
47,HN-45,HB h 511 F1= 7.826 F2= 4.109 null null d= 2.9 0.72 ( 0.00 ) nbat 1 nbpic 1
47,HN-45,HG2* h 1240 F1= 1.321 F2= 7.825 null null d= 5.2 1.30 ( 0.00 ) nbat 1 nbpic 1
47,HN-46,HA h 1401 F1= 7.815 F2= 3.663 null null d= 3.0 0.45 ( 0.00 ) nbat 1 nbpic 1
47,HN-47,HA h 219 F1= 7.824 F2= 4.219 null null d= 2.5 0.38 ( 0.00 ) nbat 1 nbpic 1
47,HN-47,HG2 h 1473 F1= 1.706 F2= 7.824 null null d= 4.0 1.50 ( 0.75 ) nbat 1 nbpic 2
47,HN-47,HG3 h 1234 F1= 1.806 F2= 7.824 null null d= 2.6 0.65 ( 0.10 ) nbat 1 nbpic 2
48,HA-48,HB2 d 266 F1= 2.959 F2= 4.737 null null d= 2.5 0.61 ( 0.05 ) nbat 1 nbpic 2
48,HA-48,HB3 d 265 F1= 3.100 F2= 4.740 null null d= 3.0 0.75 ( 0.30 ) nbat 1 nbpic 2
48,HB3-48,HB2 d 267 F1= 2.960 F2= 3.100 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
48,HD21-47,HB2 h 577 F1= 7.463 F2= 2.089 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
48,HD21-48,HB2 h 1206 F1= 2.963 F2= 7.456 null null d= 3.1 0.78 ( 0.00 ) nbat 1 nbpic 1
48,HD21-48,HB3 h 1205 F1= 3.100 F2= 7.456 null null d= 4.2 1.05 ( 0.00 ) nbat 1 nbpic 1
48,HD22-47,HB2 h 223 F1= 7.823 F2= 2.082 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 1
48,HD22-47,HB3 h 1428 F1= 7.824 F2= 2.138 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
48,HD22-48,HB2 h 1219 F1= 2.964 F2= 7.806 null null d= 2.4 0.61 ( 0.05 ) nbat 1 nbpic 3
48,HD22-48,HD21 h 13 F1= 7.809 F2= 7.459 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
48,HN-48,HA h 190 F1= 8.017 F2= 4.735 null null d= 3.2 0.48 ( 0.00 ) nbat 1 nbpic 1
48,HN-48,HB2 h 187 F1= 8.018 F2= 2.976 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
48,HN-48,HB3 h 1224 F1= 3.111 F2= 8.011 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
48,HN-48,HD22 h 419 F1= 8.016 F2= 7.822 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
48,HN-5,HG2 h 1309 F1= 2.278 F2= 8.039 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 1
48,HNor23,HN-47,HAor21,HA h 1409 F1= 8.020 F2= 4.213 null null d= 2.8 0.70 ( 0.00 ) nbat 2 nbpic 1
48,HNor23,HN-48,HB3or23,HB3 h 188 F1= 8.019 F2= 3.083 null null d= 2.2 0.55 ( 0.00 ) nbat 2 nbpic 1
49,HA-46,HB* d 67 F1= 1.403 F2= 4.717 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 2
49,HA-49,HB* d 268 F1= 1.912 F2= 4.721 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
49,HA-49,HD2 d 597 F1= 3.243 F2= 4.724 null null d= 4.0 1.00 ( 0.00 ) nbat 1 nbpic 1
49,HA-49,HD3 d 598 F1= 3.289 F2= 4.724 null null d= 3.4 0.85 ( 0.00 ) nbat 1 nbpic 1
49,HA-49,HG2 d 270 F1= 1.739 F2= 4.724 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 1
49,HA-49,HG3 d 269 F1= 1.792 F2= 4.725 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
49,HA-50,HD2 d 540 F1= 3.664 F2= 4.723 null null d= 2.3 0.57 ( 0.10 ) nbat 1 nbpic 2
49,HA-50,HD3 d 539 F1= 3.864 F2= 4.723 null null d= 2.3 0.57 ( 0.10 ) nbat 1 nbpic 2
49,HD2-49,HG2 d 271 F1= 1.730 F2= 3.253 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
49,HD3or32,HD*-49,HB*or33,HB* h 164 F1= 1.900 F2= 3.291 null null d= 2.6 0.65 ( 0.00 ) nbat 2 nbpic 1
49,HD3or32,HD*-49,HG2or32,HG* d 201 F1= 1.744 F2= 3.290 null null d= 2.3 0.58 ( 0.22 ) nbat 2 nbpic 3
49,HE-50,HD3 h 1411 F1= 7.322 F2= 3.881 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
49,HN-48,HB2 h 1331 F1= 2.965 F2= 8.081 null null d= 3.4 0.84 ( 0.35 ) nbat 1 nbpic 2
49,HN-49,HAor48,HA h 154 F1= 8.083 F2= 4.730 null null d= 2.0 0.50 ( 0.00 ) nbat 2 nbpic 1
49,HN-49,HB* h 1310 F1= 1.910 F2= 8.083 null null d= 3.3 1.00 ( 0.50 ) nbat 1 nbpic 2
49,HN-49,HG2 h 158 F1= 8.073 F2= 1.764 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 1
5,HA-41,HD2* d 578 F1= 1.105 F2= 4.245 null null d= 3.0 0.75 ( 0.00 ) nbat 1 nbpic 1
5,HA-46,HB* d 571 F1= 1.419 F2= 4.245 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
5,HA-47,HG2 h 235 F1= 1.708 F2= 4.214 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
5,HA-5,HB* d 32 F1= 1.889 F2= 4.241 null null d= 2.6 0.65 ( 0.28 ) nbat 1 nbpic 3
5,HA-5,HG2 h 880 F1= 4.241 F2= 2.299 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 1
5,HA-5,HG3 d 34 F1= 2.413 F2= 4.243 null null d= 3.0 0.75 ( 0.29 ) nbat 1 nbpic 3
5,HA-7,HD2 d 552 F1= 3.412 F2= 4.243 null null d= 3.2 0.80 ( 0.10 ) nbat 1 nbpic 2
5,HG2-46,HB* d 1051 F1= 2.281 F2= 1.421 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
5,HG2-47,HG3 h 1009 F1= 2.266 F2= 1.825 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 1
5,HG3-5,HG2 d 35 F1= 2.281 F2= 2.410 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
5,HN-4,HA h 1096 F1= 4.176 F2= 8.429 null null d= 2.0 0.29 ( 0.15 ) nbat 1 nbpic 2
5,HN-5,HA h 1450 F1= 4.236 F2= 8.431 null null d= 2.5 0.38 ( 0.20 ) nbat 1 nbpic 2
5,HN-5,HB* h 1299 F1= 1.889 F2= 8.433 null null d= 2.1 0.53 ( 0.00 ) nbat 1 nbpic 2
5,HN-5,HG2 h 1320 F1= 2.280 F2= 8.423 null null d= 2.5 0.62 ( 0.10 ) nbat 1 nbpic 2
5,HN-5,HG3 h 1323 F1= 2.417 F2= 8.432 null null d= 2.8 0.69 ( 0.05 ) nbat 1 nbpic 2
5,HN-6,HN h 414 F1= 8.431 F2= 7.816 null null d= 2.0 0.31 ( 0.05 ) nbat 1 nbpic 2
50,HA-49,HB* d 594 F1= 1.930 F2= 4.765 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 1
50,HA-50,HB* d 274 F1= 2.398 F2= 4.757 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 1
50,HA-51,HD2 d 296 F1= 3.666 F2= 4.757 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 2
50,HA-51,HD3 d 295 F1= 3.841 F2= 4.759 null null d= 2.3 0.57 ( 0.10 ) nbat 1 nbpic 2
50,HA-51,HG*or50,HG* d 275 F1= 2.061 F2= 4.758 null null d= 2.9 0.72 ( 0.00 ) nbat 2 nbpic 1
50,HD2-49,HB* d 279 F1= 1.916 F2= 3.668 null null d= 2.3 0.59 ( 0.09 ) nbat 1 nbpic 4
50,HD3-49,HB* h 323 F1= 1.919 F2= 3.857 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
50,HD3-49,HG3 d 330 F1= 1.809 F2= 3.872 null null d= 2.4 0.60 ( 0.20 ) nbat 1 nbpic 2
50,HD3or40,HA-46,HB*or39,HB2 h 930 F1= 3.850 F2= 1.421 null null d= 2.9 0.72 ( 0.00 ) nbat 2 nbpic 1
50,HD3or44,HA-49,HD2or47,HD3 d 554 F1= 3.257 F2= 3.876 null null d= 2.7 0.68 ( 0.00 ) nbat 2 nbpic 1
50,HG*-52,HD1* h 809 F1= 0.943 F2= 2.081 null null d= 1.9 0.47 ( 0.00 ) nbat 1 nbpic 1
51,HA-51,HD2 h 347 F1= 3.664 F2= 4.437 null null d= 2.8 0.70 ( 0.00 ) nbat 1 nbpic 1
51,HAor10,HA-51,HG*or14,HB* d 278 F1= 2.040 F2= 4.460 null null d= 3.1 0.78 ( 0.00 ) nbat 2 nbpic 1
51,HAor27,HA-52,HGor27,HG* d 179 F1= 1.753 F2= 4.468 null null d= 3.6 0.90 ( 0.00 ) nbat 2 nbpic 1
51,HD2or50,HD2-51,HG*or50,HG* d 281 F1= 2.060 F2= 3.668 null null d= 2.1 0.53 ( 0.00 ) nbat 2 nbpic 2
51,HD2or50,HD2or46,HA-50,HB*or5,HG3 d 276 F1= 2.403 F2= 3.670 null null d= 3.2 0.79 ( 0.09 ) nbat 3 nbpic 3
51,HD3or50,HD3-51,HD2or50,HD2 d 335 F1= 3.662 F2= 3.860 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 4
52,HA-53,HD2 d 536 F1= 3.632 F2= 4.611 null null d= 2.2 0.56 ( 0.05 ) nbat 1 nbpic 2
52,HA-53,HD3 d 538 F1= 3.875 F2= 4.613 null null d= 2.2 0.56 ( 0.15 ) nbat 1 nbpic 2
52,HAor26,HA-52,HB*or26,HB2 d 169 F1= 1.610 F2= 4.629 null null d= 2.3 0.57 ( 0.00 ) nbat 2 nbpic 1
52,HAor26,HA-52,HGor26,HB3 d 593 F1= 1.763 F2= 4.635 null null d= 2.4 0.60 ( 0.00 ) nbat 2 nbpic 1
52,HB*-52,HD2*or52,HD1* d 899 F1= 1.606 F2= 0.932 null null d= 2.0 0.50 ( 0.00 ) nbat 2 nbpic 1
52,HB*or26,HB2-52,HD2*or26,HD2* d 176 F1= 0.955 F2= 1.609 null null d= 2.1 0.62 ( 0.31 ) nbat 2 nbpic 4
52,HG-52,HD2*or52,HD1* d 893 F1= 1.768 F2= 0.933 null null d= 2.2 0.55 ( 0.00 ) nbat 2 nbpic 1
52,HGor16,HB3-52,HD2*or52,HD1*or26,HD2* d 683 F1= 0.955 F2= 1.771 null null d= 2.0 0.50 ( 0.08 ) nbat 3 nbpic 3
52,HN-51,HB* h 1432 F1= 8.346 F2= 1.908 null null d= 4.4 1.10 ( 0.00 ) nbat 1 nbpic 1
52,HN-52,HA h 110 F1= 8.350 F2= 4.610 null null d= 2.7 0.41 ( 0.00 ) nbat 1 nbpic 1
52,HN-52,HB* h 1357 F1= 1.601 F2= 8.348 null null d= 2.5 0.61 ( 0.05 ) nbat 1 nbpic 2
52,HNor28,HN-51,HAor27,HA h 1078 F1= 4.455 F2= 8.346 null null d= 2.6 1.00 ( 0.50 ) nbat 2 nbpic 2
52,HNor42,HN-52,HGor42,HB2 h 106 F1= 8.348 F2= 1.761 null null d= 2.7 0.68 ( 0.00 ) nbat 2 nbpic 1
52,HNor44,HNor19,HN-53,HD3or44,HAor19,HA h 1108 F1= 3.868 F2= 8.340 null null d= 2.4 0.59 ( 0.15 ) nbat 3 nbpic 2
53,HA-53,HB2 d 288 F1= 1.913 F2= 4.404 null null d= 2.7 0.68 ( 0.00 ) nbat 1 nbpic 2
53,HA-53,HB3 d 286 F1= 2.317 F2= 4.407 null null d= 2.5 0.64 ( 0.05 ) nbat 1 nbpic 2
53,HA-53,HG* d 287 F1= 2.049 F2= 4.409 null null d= 3.2 0.80 ( 0.00 ) nbat 1 nbpic 1
53,HA-54,HB* d 761 F1= 4.423 F2= 1.427 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
53,HB3or27,HB3-53,HB2or27,HB2 d 657 F1= 1.892 F2= 2.307 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 2
53,HD2or35,HA-52,HD2*or52,HD1*or39,HD1* d 835 F1= 3.636 F2= 0.937 null null d= 3.1 0.78 ( 0.00 ) nbat 3 nbpic 1
53,HD3-53,HB3 d 290 F1= 2.317 F2= 3.880 null null d= 2.5 0.62 ( 0.00 ) nbat 1 nbpic 1
53,HD3-53,HD2 d 301 F1= 3.632 F2= 3.879 null null d= 1.8 0.46 ( 0.09 ) nbat 1 nbpic 4
53,HD3or50,HD3or15,HA-53,HG*or50,HG*or15,HB3 h 38 F1= 2.069 F2= 3.868 null null d= 1.8 0.45 ( 0.00 ) nbat 3 nbpic 1
53,HD3or51,HD3or50,HD3-53,HG*or51,HG*or50,HG* h 896 F1= 3.853 F2= 2.058 null null d= 1.8 0.45 ( 0.00 ) nbat 3 nbpic 1
53,HG*or51,HG*-53,HB2or51,HB* d 1012 F1= 2.048 F2= 1.918 null null d= 1.8 0.45 ( 0.00 ) nbat 2 nbpic 4
54,HN-53,HA h 1081 F1= 4.399 F2= 8.494 null null d= 2.8 1.10 ( 0.55 ) nbat 1 nbpic 2
54,HN-53,HB3 h 1322 F1= 2.311 F2= 8.476 null null d= 3.4 0.84 ( 0.15 ) nbat 1 nbpic 2
55,HN-54,HA h 1093 F1= 4.347 F2= 8.506 null null d= 2.9 0.43 ( 0.10 ) nbat 1 nbpic 2
55,HN-54,HB* h 1287 F1= 1.435 F2= 8.506 null null d= 2.6 0.65 ( 0.00 ) nbat 1 nbpic 2
55,HNor33,HN-54,HAor33,HA h 338 F1= 8.482 F2= 4.323 null null d= 2.2 0.55 ( 0.00 ) nbat 2 nbpic 1
56,HBor34,HA-56,HG2*or12,HG2 d 292 F1= 1.384 F2= 4.225 null null d= 2.3 0.58 ( 0.29 ) nbat 2 nbpic 3
56,HN-56,HB h 1095 F1= 4.223 F2= 8.474 null null d= 2.8 0.70 ( 0.30 ) nbat 1 nbpic 2
56,HN-56,HG2* h 1284 F1= 1.390 F2= 8.473 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 2
56,HNor55,HN-55,HA* h 1451 F1= 4.009 F2= 8.482 null null d= 2.8 0.80 ( 0.40 ) nbat 2 nbpic 2
6,HA-41,HD2* d 592 F1= 1.107 F2= 5.176 null null d= 3.5 0.86 ( 0.35 ) nbat 1 nbpic 2
6,HA-6,HB2 d 38 F1= 2.533 F2= 5.175 null null d= 2.1 0.52 ( 0.20 ) nbat 1 nbpic 2
6,HA-6,HB3 d 37 F1= 2.874 F2= 5.176 null null d= 3.3 0.82 ( 0.00 ) nbat 1 nbpic 1
6,HA-7,HD2 d 1009 F1= 5.168 F2= 3.417 null null d= 2.5 1.05 ( 0.52 ) nbat 1 nbpic 3
6,HA-7,HD3 d 1010 F1= 5.171 F2= 3.876 null null d= 2.3 0.59 ( 0.29 ) nbat 1 nbpic 3
6,HB3-6,HB2 d 39 F1= 2.535 F2= 2.876 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 4
6,HN-4,HB2 h 1241 F1= 1.131 F2= 7.819 null null d= 2.5 0.61 ( 0.15 ) nbat 1 nbpic 2
6,HN-4,HB3 h 620 F1= 7.810 F2= 1.376 null null d= 4.2 1.05 ( 0.00 ) nbat 1 nbpic 1
6,HN-5,HB* h 1233 F1= 1.897 F2= 7.816 null null d= 2.5 0.62 ( 0.10 ) nbat 1 nbpic 2
6,HN-6,HA h 220 F1= 7.817 F2= 5.172 null null d= 2.4 0.36 ( 0.00 ) nbat 1 nbpic 1
6,HN-6,HB2 h 1465 F1= 2.542 F2= 7.816 null null d= 3.5 0.88 ( 0.00 ) nbat 1 nbpic 1
6,HN-6,HB3 h 1220 F1= 2.881 F2= 7.814 null null d= 2.5 0.62 ( 0.10 ) nbat 1 nbpic 2
6,HNor47,HN-7,HD3or44,HA h 1404 F1= 7.820 F2= 3.878 null null d= 3.2 0.80 ( 0.00 ) nbat 2 nbpic 1
7,HA-10,HD1* d 585 F1= 0.773 F2= 4.092 null null d= 3.0 0.75 ( 0.20 ) nbat 1 nbpic 2
7,HA-10,HD2* d 584 F1= 0.847 F2= 4.092 null null d= 2.2 0.55 ( 0.10 ) nbat 1 nbpic 2
7,HA-10,HG d 569 F1= 1.468 F2= 4.092 null null d= 2.3 0.57 ( 0.20 ) nbat 1 nbpic 2
7,HA-4,HB2 d 577 F1= 1.110 F2= 4.091 null null d= 3.5 1.89 ( 0.94 ) nbat 1 nbpic 3
7,HA-4,HB3 d 570 F1= 1.388 F2= 4.091 null null d= 2.6 0.64 ( 0.09 ) nbat 1 nbpic 3
7,HA-4,HD1* d 740 F1= 4.088 F2= 0.852 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 2
7,HA-7,HB2 h 906 F1= 4.060 F2= 1.812 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 1
7,HA-7,HD2 d 47 F1= 3.412 F2= 4.092 null null d= 2.9 0.71 ( 0.15 ) nbat 1 nbpic 2
7,HAor38,HA-7,HG*or41,HG d 50 F1= 1.858 F2= 4.088 null null d= 2.8 0.70 ( 0.00 ) nbat 2 nbpic 1
7,HB3-15,HD2* d 107 F1= 0.831 F2= 2.081 null null d= 2.4 0.60 ( 0.00 ) nbat 1 nbpic 1
7,HB3-7,HB2 h 1036 F1= 2.066 F2= 1.821 null null d= 1.8 0.45 ( 0.00 ) nbat 1 nbpic 2
7,HB3or15,HB3-4,HD1*or15,HD2* d 887 F1= 2.050 F2= 0.837 null null d= 2.1 0.53 ( 0.10 ) nbat 2 nbpic 2
7,HD2-4,HB2 d 838 F1= 3.408 F2= 1.112 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 1
7,HD2-41,HD2* d 623 F1= 1.106 F2= 3.416 null null d= 2.4 0.61 ( 0.12 ) nbat 1 nbpic 3
7,HD2-7,HB2 d 44 F1= 1.811 F2= 3.417 null null d= 2.5 0.61 ( 0.15 ) nbat 1 nbpic 4
7,HD2-7,HG* d 51 F1= 1.854 F2= 3.418 null null d= 2.5 0.62 ( 0.08 ) nbat 1 nbpic 4
7,HD2or37,HA-6,HB3or40,HB2 d 642 F1= 2.851 F2= 3.416 null null d= 2.7 0.68 ( 0.00 ) nbat 2 nbpic 1
7,HD3-41,HD2* d 573 F1= 1.108 F2= 3.873 null null d= 2.3 0.57 ( 0.00 ) nbat 1 nbpic 1
7,HD3-7,HD2 d 48 F1= 3.408 F2= 3.874 null null d= 1.8 0.46 ( 0.04 ) nbat 1 nbpic 4
7,HD3-7,HG* h 1594 F1= 3.858 F2= 1.861 null null d= 2.2 0.55 ( 0.00 ) nbat 1 nbpic 2
7,HD3or40,HA-41,HD2*or19,HD2* h 756 F1= 1.111 F2= 3.862 null null d= 2.8 0.70 ( 0.20 ) nbat 2 nbpic 2
7,HG*or4,HG-4,HD2* d 24 F1= 0.880 F2= 1.864 null null d= 2.0 0.50 ( 0.12 ) nbat 2 nbpic 4
8,HA-37,HG2*or37,HG1* d 580 F1= 0.934 F2= 4.030 null null d= 3.2 0.79 ( 0.19 ) nbat 2 nbpic 3
8,HA-8,HB* d 52 F1= 3.875 F2= 4.030 null null d= 1.8 0.46 ( 0.05 ) nbat 1 nbpic 4
8,HB*or7,HD3-6,HB2 d 555 F1= 2.550 F2= 3.878 null null d= 2.6 0.65 ( 0.00 ) nbat 2 nbpic 1
8,HN-6,HA h 502 F1= 8.067 F2= 5.172 null null d= 3.1 0.46 ( 0.00 ) nbat 1 nbpic 1
8,HN-8,HA h 155 F1= 8.063 F2= 4.037 null null d= 3.3 0.49 ( 0.00 ) nbat 1 nbpic 1
8,HN-8,HB* h 1119 F1= 3.868 F2= 8.049 null null d= 2.0 0.51 ( 0.05 ) nbat 1 nbpic 2
8,HN-9,HN h 408 F1= 8.063 F2= 6.636 null null d= 2.3 0.34 ( 0.00 ) nbat 1 nbpic 2
8,HNor38,HN-7,HAor38,HA h 1120 F1= 4.088 F2= 8.042 null null d= 2.3 0.57 ( 0.00 ) nbat 2 nbpic 2
8,HNor38,HN-9,HG2*or37,HG2* h 1267 F1= 0.940 F2= 8.051 null null d= 2.7 0.68 ( 0.00 ) nbat 2 nbpic 1
9,HA-9,HB d 53 F1= 2.295 F2= 4.099 null null d= 2.0 0.51 ( 0.13 ) nbat 1 nbpic 4
9,HA-9,HG1* d 55 F1= 0.902 F2= 4.096 null null d= 2.2 0.55 ( 0.07 ) nbat 1 nbpic 4
9,HA-9,HG2* d 54 F1= 0.957 F2= 4.096 null null d= 2.0 0.50 ( 0.12 ) nbat 1 nbpic 4
9,HB-9,HG1* d 56 F1= 0.904 F2= 2.301 null null d= 2.0 0.50 ( 0.00 ) nbat 1 nbpic 1
9,HB-9,HG2* d 876 F1= 2.303 F2= 0.951 null null d= 1.9 0.47 ( 0.10 ) nbat 1 nbpic 2
9,HBor37,HB-9,HG1*or37,HG2*or37,HG1* d 880 F1= 2.299 F2= 0.912 null null d= 2.0 0.49 ( 0.12 ) nbat 3 nbpic 3
9,HBor37,HB-9,HG2*or37,HG2*or37,HG1* d 57 F1= 0.950 F2= 2.301 null null d= 1.9 0.47 ( 0.00 ) nbat 3 nbpic 1
9,HN-9,HA h 1091 F1= 4.091 F2= 6.638 null null d= 2.5 0.38 ( 0.15 ) nbat 1 nbpic 2
9,HN-9,HB h 1129 F1= 2.299 F2= 6.636 null null d= 2.8 0.71 ( 0.05 ) nbat 1 nbpic 2
9,HN-9,HG1* h 1142 F1= 0.906 F2= 6.635 null null d= 2.2 0.54 ( 0.05 ) nbat 1 nbpic 2
9,HN-9,HG2* h 1141 F1= 0.957 F2= 6.633 null null d= 2.2 0.55 ( 0.10 ) nbat 1 nbpic 2
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H2   PRO   1           H2       PRO   1  -1.779  10.645  -9.339
    2    H3   PRO   1           H3       PRO   1  -3.213  10.869 -10.222
    3    HA   PRO   1           HA       PRO   1  -4.222   9.355  -8.967
    4   1HB   PRO   1          1HB       PRO   1  -2.500   7.076  -9.206
    5   2HB   PRO   1          2HB       PRO   1  -4.016   7.382 -10.052
    6   1HG   PRO   1          1HG       PRO   1  -1.412   7.390 -11.137
    7   2HG   PRO   1          2HG       PRO   1  -2.923   7.810 -11.955
    8   1HD   PRO   1          1HD       PRO   1  -0.791   9.630 -11.020
    9   2HD   PRO   1          2HD       PRO   1  -2.207  10.037 -12.001
   10    H    GLU   2           H        GLU   2  -3.699  10.408  -6.954
   11    HA   GLU   2           HA       GLU   2  -1.263   9.724  -5.509
   12   1HB   GLU   2          1HB       GLU   2  -3.593  11.468  -5.114
   13   2HB   GLU   2          2HB       GLU   2  -3.031  10.710  -3.623
   14   1HG   GLU   2          1HG       GLU   2  -0.980  11.871  -5.463
   15   2HG   GLU   2          2HG       GLU   2  -1.957  12.986  -4.507
   16    H    PHE   3           H        PHE   3  -1.040   8.240  -3.840
   17    HA   PHE   3           HA       PHE   3  -3.401   6.657  -2.996
   18   1HB   PHE   3          1HB       PHE   3  -2.786   5.088  -4.595
   19   2HB   PHE   3          2HB       PHE   3  -1.146   5.730  -4.704
   20    HD1  PHE   3           HD1      PHE   3  -3.104   3.026  -3.469
   21    HD2  PHE   3           HD2      PHE   3   0.412   5.344  -2.781
   22    HE1  PHE   3           HE1      PHE   3  -2.147   1.176  -2.172
   23    HE2  PHE   3           HE2      PHE   3   1.384   3.497  -1.530
   24    HZ   PHE   3           HZ       PHE   3   0.103   1.358  -1.240
   25    H    LEU   4           H        LEU   4  -2.852   5.332  -1.101
   26    HA   LEU   4           HA       LEU   4  -1.598   6.739   0.976
   27   1HB   LEU   4          1HB       LEU   4  -1.278   4.257   1.920
   28   2HB   LEU   4          2HB       LEU   4  -2.884   4.946   1.735
   29    HG   LEU   4           HG       LEU   4  -1.836   3.703  -0.704
   30   1HD1  LEU   4          1HD1      LEU   4  -2.438   2.059   1.754
   31   2HD1  LEU   4          2HD1      LEU   4  -2.209   1.407   0.128
   32   3HD1  LEU   4          3HD1      LEU   4  -0.864   2.190   0.966
   33   1HD2  LEU   4          1HD2      LEU   4  -4.309   4.259   0.658
   34   2HD2  LEU   4          2HD2      LEU   4  -4.061   3.809  -1.027
   35   3HD2  LEU   4          3HD2      LEU   4  -4.253   2.559   0.201
   36    H    GLU   5           H        GLU   5   0.407   7.578   0.094
   37    HA   GLU   5           HA       GLU   5   2.502   5.863  -0.885
   38   1HB   GLU   5          1HB       GLU   5   2.647   8.657   0.293
   39   2HB   GLU   5          2HB       GLU   5   3.952   7.857  -0.580
   40   1HG   GLU   5          1HG       GLU   5   2.712   7.869  -2.636
   41   2HG   GLU   5          2HG       GLU   5   1.218   8.275  -1.824
   42    H    ASP   6           H        ASP   6   1.220   6.342   2.173
   43    HA   ASP   6           HA       ASP   6   3.397   4.789   3.403
   44   1HB   ASP   6          1HB       ASP   6   2.450   7.396   4.636
   45   2HB   ASP   6          2HB       ASP   6   3.711   6.328   5.252
   46    HA   PRO   7           HA       PRO   7  -0.871   3.660   4.586
   47   1HB   PRO   7          1HB       PRO   7  -0.496   0.964   4.207
   48   2HB   PRO   7          2HB       PRO   7  -1.014   2.074   2.932
   49   1HG   PRO   7          1HG       PRO   7   1.636   0.799   3.354
   50   2HG   PRO   7          2HG       PRO   7   0.891   1.382   1.858
   51   1HD   PRO   7          1HD       PRO   7   2.912   2.712   3.356
   52   2HD   PRO   7          2HD       PRO   7   1.957   3.417   2.035
   53    H    SER   8           H        SER   8   0.612   4.360   6.678
   54    HA   SER   8           HA       SER   8   1.034   1.898   8.315
   55   1HB   SER   8          1HB       SER   8   3.063   3.141   8.282
   56   2HB   SER   8          2HB       SER   8   2.217   4.675   8.476
   57    HG   SER   8           HG       SER   8   2.740   2.667  10.361
   58    H    VAL   9           H        VAL   9  -1.395   3.859   7.691
   59    HA   VAL   9           HA       VAL   9  -2.273   3.967  10.542
   60    HB   VAL   9           HB       VAL   9  -3.579   6.046   9.858
   61   1HG1  VAL   9          1HG1      VAL   9  -1.680   5.812   7.507
   62   2HG1  VAL   9          2HG1      VAL   9  -3.441   5.767   7.441
   63   3HG1  VAL   9          3HG1      VAL   9  -2.614   7.258   7.893
   64   1HG2  VAL   9          1HG2      VAL   9  -0.546   6.071   9.823
   65   2HG2  VAL   9          2HG2      VAL   9  -1.547   7.506  10.035
   66   3HG2  VAL   9          3HG2      VAL   9  -1.583   6.220  11.241
   67    H    LEU  10           H        LEU  10  -2.850   2.623   7.557
   68    HA   LEU  10           HA       LEU  10  -5.806   2.635   7.863
   69   1HB   LEU  10          1HB       LEU  10  -5.301   0.973   5.700
   70   2HB   LEU  10          2HB       LEU  10  -5.665   2.697   5.578
   71    HG   LEU  10           HG       LEU  10  -2.846   1.664   5.951
   72   1HD1  LEU  10          1HD1      LEU  10  -4.207   1.028   3.749
   73   2HD1  LEU  10          2HD1      LEU  10  -3.767   2.677   3.300
   74   3HD1  LEU  10          3HD1      LEU  10  -2.523   1.496   3.686
   75   1HD2  LEU  10          1HD2      LEU  10  -4.066   4.227   6.040
   76   2HD2  LEU  10          2HD2      LEU  10  -2.345   3.855   6.100
   77   3HD2  LEU  10          3HD2      LEU  10  -3.127   4.156   4.549
   78    H    THR  11           H        THR  11  -3.698  -0.018   6.867
   79    HA   THR  11           HA       THR  11  -3.744  -1.804   8.928
   80    HB   THR  11           HB       THR  11  -6.082  -1.527   9.291
   81    HG1  THR  11           HG1      THR  11  -6.098  -3.622   9.309
   82   1HG2  THR  11          1HG2      THR  11  -6.078  -1.250   6.345
   83   2HG2  THR  11          2HG2      THR  11  -7.545  -1.932   7.058
   84   3HG2  THR  11          3HG2      THR  11  -6.989  -0.318   7.542
   85    H    LYS  12           H        LYS  12  -4.369  -4.185   7.813
   86    HA   LYS  12           HA       LYS  12  -2.835  -4.110   5.304
   87   1HB   LYS  12          1HB       LYS  12  -3.181  -6.011   7.420
   88   2HB   LYS  12          2HB       LYS  12  -3.718  -6.772   5.927
   89   1HG   LYS  12          1HG       LYS  12  -1.471  -7.205   5.675
   90   2HG   LYS  12          2HG       LYS  12  -1.394  -5.539   5.081
   91   1HD   LYS  12          1HD       LYS  12   0.277  -5.708   6.788
   92   2HD   LYS  12          2HD       LYS  12  -1.077  -4.845   7.524
   93   1HE   LYS  12          1HE       LYS  12  -0.723  -6.418   9.170
   94   2HE   LYS  12          2HE       LYS  12  -1.817  -7.345   8.144
   95   1HZ   LYS  12          1HZ       LYS  12   0.871  -7.561   7.248
   96   2HZ   LYS  12          2HZ       LYS  12   0.741  -8.036   8.871
   97   3HZ   LYS  12          3HZ       LYS  12  -0.219  -8.788   7.688
   98    H    ASP  13           H        ASP  13  -6.005  -3.671   6.037
   99    HA   ASP  13           HA       ASP  13  -6.967  -5.224   3.665
  100   1HB   ASP  13          1HB       ASP  13  -7.995  -5.334   6.126
  101   2HB   ASP  13          2HB       ASP  13  -8.879  -3.916   5.560
  102    H    LYS  14           H        LYS  14  -6.657  -1.921   4.919
  103    HA   LYS  14           HA       LYS  14  -8.471  -0.823   2.927
  104   1HB   LYS  14          1HB       LYS  14  -7.869   0.184   5.176
  105   2HB   LYS  14          2HB       LYS  14  -6.366   0.677   4.421
  106   1HG   LYS  14          1HG       LYS  14  -9.162   1.428   3.533
  107   2HG   LYS  14          2HG       LYS  14  -7.982   2.495   4.288
  108   1HD   LYS  14          1HD       LYS  14  -7.773   1.199   1.565
  109   2HD   LYS  14          2HD       LYS  14  -7.947   2.913   1.901
  110   1HE   LYS  14          1HE       LYS  14  -5.615   1.381   3.036
  111   2HE   LYS  14          2HE       LYS  14  -5.566   2.006   1.391
  112   1HZ   LYS  14          1HZ       LYS  14  -6.511   4.121   2.729
  113   2HZ   LYS  14          2HZ       LYS  14  -5.489   3.440   3.898
  114   3HZ   LYS  14          3HZ       LYS  14  -4.868   3.873   2.380
  115    H    LEU  15           H        LEU  15  -4.949  -0.684   3.423
  116    HA   LEU  15           HA       LEU  15  -4.085   0.539   1.095
  117   1HB   LEU  15          1HB       LEU  15  -2.416  -1.729   1.222
  118   2HB   LEU  15          2HB       LEU  15  -2.100  -0.160   1.965
  119    HG   LEU  15           HG       LEU  15  -3.244  -0.875   4.015
  120   1HD1  LEU  15          1HD1      LEU  15  -4.220  -2.939   2.270
  121   2HD1  LEU  15          2HD1      LEU  15  -3.360  -3.668   3.611
  122   3HD1  LEU  15          3HD1      LEU  15  -4.720  -2.561   3.925
  123   1HD2  LEU  15          1HD2      LEU  15  -0.779  -1.412   3.481
  124   2HD2  LEU  15          2HD2      LEU  15  -1.532  -2.329   4.785
  125   3HD2  LEU  15          3HD2      LEU  15  -1.337  -3.063   3.192
  126    H    LYS  16           H        LYS  16  -5.648  -2.502   1.446
  127    HA   LYS  16           HA       LYS  16  -5.023  -3.479  -1.209
  128   1HB   LYS  16          1HB       LYS  16  -5.337  -5.313   0.081
  129   2HB   LYS  16          2HB       LYS  16  -6.036  -4.347   1.356
  130   1HG   LYS  16          1HG       LYS  16  -8.209  -4.445   0.214
  131   2HG   LYS  16          2HG       LYS  16  -7.509  -5.488  -1.016
  132   1HD   LYS  16          1HD       LYS  16  -7.553  -6.076   1.942
  133   2HD   LYS  16          2HD       LYS  16  -8.658  -6.780   0.770
  134   1HE   LYS  16          1HE       LYS  16  -6.701  -7.771  -0.416
  135   2HE   LYS  16          2HE       LYS  16  -5.645  -7.123   0.861
  136   1HZ   LYS  16          1HZ       LYS  16  -6.987  -8.369   2.477
  137   2HZ   LYS  16          2HZ       LYS  16  -7.903  -9.026   1.207
  138   3HZ   LYS  16          3HZ       LYS  16  -6.254  -9.398   1.347
  139    H    SER  17           H        SER  17  -7.979  -2.571   0.538
  140    HA   SER  17           HA       SER  17  -9.820  -2.653  -1.557
  141   1HB   SER  17          1HB       SER  17  -9.741  -1.431   0.998
  142   2HB   SER  17          2HB       SER  17 -10.263  -0.196  -0.139
  143    HG   SER  17           HG       SER  17 -11.646  -2.083  -0.937
  144    H    GLU  18           H        GLU  18  -7.157  -0.486  -1.096
  145    HA   GLU  18           HA       GLU  18  -8.109   1.343  -3.207
  146   1HB   GLU  18          1HB       GLU  18  -5.365   1.450  -1.986
  147   2HB   GLU  18          2HB       GLU  18  -6.341   2.756  -2.626
  148   1HG   GLU  18          1HG       GLU  18  -7.033   1.213  -0.114
  149   2HG   GLU  18          2HG       GLU  18  -6.237   2.780  -0.112
  150    H    LEU  19           H        LEU  19  -5.129  -0.627  -2.657
  151    HA   LEU  19           HA       LEU  19  -3.832  -0.561  -5.028
  152   1HB   LEU  19          1HB       LEU  19  -4.537  -2.928  -3.324
  153   2HB   LEU  19          2HB       LEU  19  -3.744  -3.202  -4.848
  154    HG   LEU  19           HG       LEU  19  -2.527  -1.035  -3.271
  155   1HD1  LEU  19          1HD1      LEU  19  -1.952  -2.680  -5.385
  156   2HD1  LEU  19          2HD1      LEU  19  -0.752  -1.748  -4.487
  157   3HD1  LEU  19          3HD1      LEU  19  -1.047  -3.443  -4.081
  158   1HD2  LEU  19          1HD2      LEU  19  -3.125  -3.647  -2.074
  159   2HD2  LEU  19          2HD2      LEU  19  -1.392  -3.340  -2.150
  160   3HD2  LEU  19          3HD2      LEU  19  -2.450  -2.207  -1.306
  161    H    VAL  20           H        VAL  20  -6.908  -2.269  -4.541
  162    HA   VAL  20           HA       VAL  20  -7.181  -3.447  -7.091
  163    HB   VAL  20           HB       VAL  20  -9.162  -2.357  -5.084
  164   1HG1  VAL  20          1HG1      VAL  20  -7.781  -4.617  -5.026
  165   2HG1  VAL  20          2HG1      VAL  20  -9.471  -4.583  -4.523
  166   3HG1  VAL  20          3HG1      VAL  20  -9.043  -5.159  -6.135
  167   1HG2  VAL  20          1HG2      VAL  20  -9.631  -2.951  -7.928
  168   2HG2  VAL  20          2HG2      VAL  20 -10.665  -3.876  -6.839
  169   3HG2  VAL  20          3HG2      VAL  20 -10.665  -2.115  -6.770
  170    H    ALA  21           H        ALA  21  -8.544  -0.321  -6.035
  171    HA   ALA  21           HA       ALA  21  -9.256   0.582  -8.646
  172   1HB   ALA  21          1HB       ALA  21  -9.458   2.788  -7.591
  173   2HB   ALA  21          2HB       ALA  21 -10.126   1.550  -6.526
  174   3HB   ALA  21          3HB       ALA  21  -8.526   2.222  -6.201
  175    H    ASN  22           H        ASN  22  -6.176   0.287  -7.163
  176    HA   ASN  22           HA       ASN  22  -5.045   2.351  -8.986
  177   1HB   ASN  22          1HB       ASN  22  -3.679   0.938  -6.676
  178   2HB   ASN  22          2HB       ASN  22  -3.120   2.393  -7.505
  179   2HD2  ASN  22          2HD2      ASN  22  -4.727   1.476  -4.687
  180   1HD2  ASN  22          1HD2      ASN  22  -5.692   2.853  -4.462
  181    H    ASN  23           H        ASN  23  -5.848  -0.052 -10.171
  182    HA   ASN  23           HA       ASN  23  -5.070  -1.747 -11.585
  183   1HB   ASN  23          1HB       ASN  23  -4.009   0.105 -12.706
  184   2HB   ASN  23          2HB       ASN  23  -2.687   0.117 -11.540
  185   2HD2  ASN  23          2HD2      ASN  23  -0.943  -0.497 -12.906
  186   1HD2  ASN  23          1HD2      ASN  23  -0.894  -1.965 -13.760
  187    H    VAL  24           H        VAL  24  -5.004  -2.973  -9.308
  188    HA   VAL  24           HA       VAL  24  -2.474  -4.468  -9.360
  189    HB   VAL  24           HB       VAL  24  -3.466  -3.267  -6.755
  190   1HG1  VAL  24          1HG1      VAL  24  -1.511  -5.319  -7.538
  191   2HG1  VAL  24          2HG1      VAL  24  -0.819  -4.069  -6.506
  192   3HG1  VAL  24          3HG1      VAL  24  -2.216  -4.996  -5.956
  193   1HG2  VAL  24          1HG2      VAL  24  -1.256  -2.442  -8.659
  194   2HG2  VAL  24          2HG2      VAL  24  -2.555  -1.443  -8.008
  195   3HG2  VAL  24          3HG2      VAL  24  -1.244  -1.982  -6.958
  196    H    THR  25           H        THR  25  -3.099  -6.596  -9.334
  197    HA   THR  25           HA       THR  25  -5.820  -7.312  -8.734
  198    HB   THR  25           HB       THR  25  -4.422  -9.658  -8.700
  199    HG1  THR  25           HG1      THR  25  -2.472  -8.680  -9.121
  200   1HG2  THR  25          1HG2      THR  25  -5.718  -8.017 -10.838
  201   2HG2  THR  25          2HG2      THR  25  -4.912  -9.521 -11.285
  202   3HG2  THR  25          3HG2      THR  25  -6.246  -9.544 -10.132
  203    H    LEU  26           H        LEU  26  -6.494  -8.766  -7.071
  204    HA   LEU  26           HA       LEU  26  -4.864  -8.554  -4.569
  205   1HB   LEU  26          1HB       LEU  26  -7.863  -8.848  -4.857
  206   2HB   LEU  26          2HB       LEU  26  -7.006  -8.638  -3.353
  207    HG   LEU  26           HG       LEU  26  -8.080  -6.679  -5.006
  208   1HD1  LEU  26          1HD1      LEU  26  -5.099  -6.689  -5.106
  209   2HD1  LEU  26          2HD1      LEU  26  -6.250  -6.360  -6.399
  210   3HD1  LEU  26          3HD1      LEU  26  -5.986  -5.167  -5.129
  211   1HD2  LEU  26          1HD2      LEU  26  -7.136  -6.950  -2.385
  212   2HD2  LEU  26          2HD2      LEU  26  -6.337  -5.522  -3.061
  213   3HD2  LEU  26          3HD2      LEU  26  -8.099  -5.634  -3.050
  214    HA   PRO  27           HA       PRO  27  -4.856 -12.988  -5.302
  215   1HB   PRO  27          1HB       PRO  27  -2.893 -13.536  -3.447
  216   2HB   PRO  27          2HB       PRO  27  -2.559 -12.920  -5.072
  217   1HG   PRO  27          1HG       PRO  27  -2.476 -11.470  -2.472
  218   2HG   PRO  27          2HG       PRO  27  -1.554 -11.177  -3.956
  219   1HD   PRO  27          1HD       PRO  27  -3.814  -9.727  -3.100
  220   2HD   PRO  27          2HD       PRO  27  -3.113  -9.675  -4.724
  221    H    ALA  28           H        ALA  28  -3.842 -13.036  -1.962
  222    HA   ALA  28           HA       ALA  28  -5.904 -14.833  -1.180
  223   1HB   ALA  28          1HB       ALA  28  -3.650 -13.487   0.075
  224   2HB   ALA  28          2HB       ALA  28  -5.029 -13.609   1.171
  225   3HB   ALA  28          3HB       ALA  28  -4.356 -15.064   0.436
  226    H    GLY  29           H        GLY  29  -7.181 -14.192   0.996
  227   1HA   GLY  29          1HA       GLY  29  -9.447 -13.174   1.143
  228   2HA   GLY  29          2HA       GLY  29  -8.792 -11.786   0.267
  229    H    GLU  30           H        GLU  30  -8.610 -13.516   3.384
  230    HA   GLU  30           HA       GLU  30  -8.754 -11.296   5.047
  231   1HB   GLU  30          1HB       GLU  30  -8.739 -13.470   6.058
  232   2HB   GLU  30          2HB       GLU  30  -7.156 -13.847   5.381
  233   1HG   GLU  30          1HG       GLU  30  -7.126 -11.395   6.974
  234   2HG   GLU  30          2HG       GLU  30  -7.632 -12.800   7.914
  235    H    GLN  31           H        GLN  31  -5.569 -12.821   4.675
  236    HA   GLN  31           HA       GLN  31  -4.259 -10.770   3.394
  237   1HB   GLN  31          1HB       GLN  31  -4.954  -9.849   5.943
  238   2HB   GLN  31          2HB       GLN  31  -3.294 -10.383   6.152
  239   1HG   GLN  31          1HG       GLN  31  -3.052  -8.179   5.515
  240   2HG   GLN  31          2HG       GLN  31  -2.837  -8.975   3.979
  241   2HE2  GLN  31          2HE2      GLN  31  -5.421  -7.536   6.057
  242   1HE2  GLN  31          1HE2      GLN  31  -6.387  -6.997   4.769
  243    H    ARG  32           H        ARG  32  -2.951 -12.320   2.532
  244    HA   ARG  32           HA       ARG  32  -1.920 -14.617   3.495
  245   1HB   ARG  32          1HB       ARG  32  -1.376 -12.753   1.434
  246   2HB   ARG  32          2HB       ARG  32   0.164 -13.122   2.172
  247   1HG   ARG  32          1HG       ARG  32  -0.646 -15.614   1.968
  248   2HG   ARG  32          2HG       ARG  32  -1.774 -14.935   0.796
  249   1HD   ARG  32          1HD       ARG  32  -0.031 -14.253  -0.653
  250   2HD   ARG  32          2HD       ARG  32   1.181 -14.333   0.627
  251    HE   ARG  32           HE       ARG  32   0.009 -16.931   0.083
  252   1HH1  ARG  32          1HH1      ARG  32   1.605 -14.787  -1.936
  253   2HH1  ARG  32          2HH1      ARG  32   2.950 -15.824  -2.272
  254   1HH2  ARG  32          1HH2      ARG  32   2.051 -18.199   0.089
  255   2HH2  ARG  32          2HH2      ARG  32   3.203 -17.756  -1.126
  256    H    LYS  33           H        LYS  33   0.009 -11.615   3.663
  257    HA   LYS  33           HA       LYS  33   0.591 -11.716   6.441
  258   1HB   LYS  33          1HB       LYS  33   1.841 -13.815   5.169
  259   2HB   LYS  33          2HB       LYS  33   3.086 -12.568   5.112
  260   1HG   LYS  33          1HG       LYS  33   1.581 -13.212   7.654
  261   2HG   LYS  33          2HG       LYS  33   3.057 -14.065   7.200
  262   1HD   LYS  33          1HD       LYS  33   4.352 -12.061   7.263
  263   2HD   LYS  33          2HD       LYS  33   2.909 -11.046   7.322
  264   1HE   LYS  33          1HE       LYS  33   4.058 -11.307   9.548
  265   2HE   LYS  33          2HE       LYS  33   2.375 -11.835   9.552
  266   1HZ   LYS  33          1HZ       LYS  33   4.523 -13.760   8.959
  267   2HZ   LYS  33          2HZ       LYS  33   4.177 -13.349  10.571
  268   3HZ   LYS  33          3HZ       LYS  33   2.974 -14.043   9.599
  269    H    ASP  34           H        ASP  34   0.330  -9.435   6.021
  270    HA   ASP  34           HA       ASP  34   1.069  -7.276   5.408
  271   1HB   ASP  34          1HB       ASP  34   3.340  -8.775   6.356
  272   2HB   ASP  34          2HB       ASP  34   3.865  -7.786   4.990
  273    H    VAL  35           H        VAL  35   0.568  -9.536   3.359
  274    HA   VAL  35           HA       VAL  35   2.297  -9.146   1.148
  275    HB   VAL  35           HB       VAL  35   0.919 -11.055   1.064
  276   1HG1  VAL  35          1HG1      VAL  35  -0.999  -9.302   2.256
  277   2HG1  VAL  35          2HG1      VAL  35  -1.715 -10.154   0.892
  278   3HG1  VAL  35          3HG1      VAL  35  -0.971 -11.060   2.206
  279   1HG2  VAL  35          1HG2      VAL  35   0.790  -9.135  -0.997
  280   2HG2  VAL  35          2HG2      VAL  35   0.394 -10.855  -1.137
  281   3HG2  VAL  35          3HG2      VAL  35  -0.875  -9.684  -0.771
  282    H    TYR  36           H        TYR  36  -0.813  -7.559   1.932
  283    HA   TYR  36           HA       TYR  36  -0.826  -6.001  -0.469
  284   1HB   TYR  36          1HB       TYR  36  -2.267  -5.696   2.149
  285   2HB   TYR  36          2HB       TYR  36  -2.678  -4.885   0.647
  286    HD1  TYR  36           HD1      TYR  36  -3.580  -6.166  -1.246
  287    HD2  TYR  36           HD2      TYR  36  -2.539  -8.031   2.445
  288    HE1  TYR  36           HE1      TYR  36  -4.904  -8.160  -1.894
  289    HE2  TYR  36           HE2      TYR  36  -3.861 -10.038   1.838
  290    HH   TYR  36           HH       TYR  36  -6.046 -10.061  -0.767
  291    H    VAL  37           H        VAL  37   0.592  -5.635   2.677
  292    HA   VAL  37           HA       VAL  37   0.884  -2.764   2.473
  293    HB   VAL  37           HB       VAL  37   2.129  -4.877   4.255
  294   1HG1  VAL  37          1HG1      VAL  37  -0.365  -4.052   4.384
  295   2HG1  VAL  37          2HG1      VAL  37   0.589  -4.122   5.872
  296   3HG1  VAL  37          3HG1      VAL  37   0.343  -2.580   5.057
  297   1HG2  VAL  37          1HG2      VAL  37   3.039  -2.178   3.707
  298   2HG2  VAL  37          2HG2      VAL  37   2.497  -2.312   5.380
  299   3HG2  VAL  37          3HG2      VAL  37   3.752  -3.391   4.769
  300    H    GLN  38           H        GLN  38   3.260  -5.457   2.301
  301    HA   GLN  38           HA       GLN  38   5.345  -3.874   1.161
  302   1HB   GLN  38          1HB       GLN  38   5.330  -6.360   2.094
  303   2HB   GLN  38          2HB       GLN  38   4.944  -6.781   0.432
  304   1HG   GLN  38          1HG       GLN  38   7.010  -5.327  -0.182
  305   2HG   GLN  38          2HG       GLN  38   7.438  -5.497   1.522
  306   2HE2  GLN  38          2HE2      GLN  38   6.028  -8.265   1.437
  307   1HE2  GLN  38          1HE2      GLN  38   7.190  -9.274   0.717
  308    H    LEU  39           H        LEU  39   2.850  -5.928  -0.279
  309    HA   LEU  39           HA       LEU  39   3.337  -5.702  -3.018
  310   1HB   LEU  39          1HB       LEU  39   0.864  -5.934  -1.411
  311   2HB   LEU  39          2HB       LEU  39   0.589  -5.254  -2.999
  312    HG   LEU  39           HG       LEU  39   2.151  -7.805  -2.560
  313   1HD1  LEU  39          1HD1      LEU  39  -0.359  -7.811  -1.880
  314   2HD1  LEU  39          2HD1      LEU  39  -0.678  -7.591  -3.598
  315   3HD1  LEU  39          3HD1      LEU  39   0.176  -9.028  -3.039
  316   1HD2  LEU  39          1HD2      LEU  39   1.141  -6.187  -4.884
  317   2HD2  LEU  39          2HD2      LEU  39   2.717  -6.959  -4.666
  318   3HD2  LEU  39          3HD2      LEU  39   1.302  -7.938  -5.055
  319    H    TYR  40           H        TYR  40   1.613  -3.344  -0.990
  320    HA   TYR  40           HA       TYR  40   1.135  -1.370  -2.894
  321   1HB   TYR  40          1HB       TYR  40   0.211  -0.538  -1.037
  322   2HB   TYR  40          2HB       TYR  40   1.092  -1.689  -0.054
  323    HD1  TYR  40           HD1      TYR  40   2.431  -0.829   1.623
  324    HD2  TYR  40           HD2      TYR  40   1.863   1.473  -1.953
  325    HE1  TYR  40           HE1      TYR  40   3.822   0.987   2.570
  326    HE2  TYR  40           HE2      TYR  40   3.225   3.306  -0.985
  327    HH   TYR  40           HH       TYR  40   4.466   3.111   2.330
  328    H    LEU  41           H        LEU  41   3.977  -1.439  -0.659
  329    HA   LEU  41           HA       LEU  41   5.241   0.729  -2.010
  330   1HB   LEU  41          1HB       LEU  41   5.716  -0.650   0.301
  331   2HB   LEU  41          2HB       LEU  41   7.010  -1.273  -0.716
  332    HG   LEU  41           HG       LEU  41   7.456   1.240  -1.288
  333   1HD1  LEU  41          1HD1      LEU  41   8.323  -0.504   0.821
  334   2HD1  LEU  41          2HD1      LEU  41   9.244   0.738  -0.027
  335   3HD1  LEU  41          3HD1      LEU  41   8.320   1.157   1.415
  336   1HD2  LEU  41          1HD2      LEU  41   5.683   1.423   1.175
  337   2HD2  LEU  41          2HD2      LEU  41   6.872   2.666   0.786
  338   3HD2  LEU  41          3HD2      LEU  41   5.555   2.333  -0.335
  339    H    GLN  42           H        GLN  42   4.807  -2.515  -2.985
  340    HA   GLN  42           HA       GLN  42   7.253  -2.755  -4.545
  341   1HB   GLN  42          1HB       GLN  42   5.677  -4.633  -3.598
  342   2HB   GLN  42          2HB       GLN  42   4.789  -4.390  -5.094
  343   1HG   GLN  42          1HG       GLN  42   7.047  -4.663  -6.297
  344   2HG   GLN  42          2HG       GLN  42   7.657  -5.286  -4.760
  345   2HE2  GLN  42          2HE2      GLN  42   5.506  -6.798  -3.826
  346   1HE2  GLN  42          1HE2      GLN  42   5.163  -8.053  -4.915
  347    H    HIS  43           H        HIS  43   3.826  -2.569  -5.625
  348    HA   HIS  43           HA       HIS  43   4.729  -1.665  -8.290
  349   1HB   HIS  43          1HB       HIS  43   1.853  -1.755  -7.445
  350   2HB   HIS  43          2HB       HIS  43   2.563  -2.152  -9.017
  351    HD1  HIS  43           HD1      HIS  43   3.398  -4.560  -9.357
  352    HD2  HIS  43           HD2      HIS  43   2.085  -3.784  -5.482
  353    HE1  HIS  43           HE1      HIS  43   3.301  -6.802  -8.180
  354    H    LEU  44           H        LEU  44   3.210  -0.468  -5.403
  355    HA   LEU  44           HA       LEU  44   2.671   2.135  -6.689
  356   1HB   LEU  44          1HB       LEU  44   2.140   1.271  -3.834
  357   2HB   LEU  44          2HB       LEU  44   1.576   2.741  -4.600
  358    HG   LEU  44           HG       LEU  44   0.381   0.036  -4.664
  359   1HD1  LEU  44          1HD1      LEU  44  -0.388   2.589  -4.257
  360   2HD1  LEU  44          2HD1      LEU  44  -0.895   2.393  -5.924
  361   3HD1  LEU  44          3HD1      LEU  44  -1.505   1.294  -4.688
  362   1HD2  LEU  44          1HD2      LEU  44   1.175   1.365  -7.247
  363   2HD2  LEU  44          2HD2      LEU  44   0.860  -0.335  -6.920
  364   3HD2  LEU  44          3HD2      LEU  44  -0.478   0.788  -7.111
  365    H    THR  45           H        THR  45   5.037   0.610  -4.593
  366    HA   THR  45           HA       THR  45   6.895   1.556  -3.480
  367    HB   THR  45           HB       THR  45   7.588   3.550  -5.317
  368    HG1  THR  45           HG1      THR  45   6.917   2.835  -7.232
  369   1HG2  THR  45          1HG2      THR  45   8.174   0.587  -5.115
  370   2HG2  THR  45          2HG2      THR  45   9.033   1.651  -6.233
  371   3HG2  THR  45          3HG2      THR  45   9.154   1.917  -4.492
  372    H    ALA  46           H        ALA  46   4.239   3.020  -2.994
  373    HA   ALA  46           HA       ALA  46   3.558   5.066  -2.068
  374   1HB   ALA  46          1HB       ALA  46   6.435   4.836  -1.123
  375   2HB   ALA  46          2HB       ALA  46   4.969   4.488  -0.209
  376   3HB   ALA  46          3HB       ALA  46   5.379   6.156  -0.616
  377    H    ARG  47           H        ARG  47   3.852   5.359  -4.582
  378    HA   ARG  47           HA       ARG  47   5.301   6.609  -6.272
  379   1HB   ARG  47          1HB       ARG  47   3.355   8.620  -5.938
  380   2HB   ARG  47          2HB       ARG  47   3.255   7.248  -7.007
  381   1HG   ARG  47          1HG       ARG  47   2.613   6.794  -4.107
  382   2HG   ARG  47          2HG       ARG  47   1.450   7.699  -5.047
  383   1HD   ARG  47          1HD       ARG  47   1.622   4.921  -4.920
  384   2HD   ARG  47          2HD       ARG  47   0.745   5.830  -6.140
  385    HE   ARG  47           HE       ARG  47   3.592   5.387  -6.707
  386   1HH1  ARG  47          1HH1      ARG  47   0.731   3.596  -6.611
  387   2HH1  ARG  47          2HH1      ARG  47   0.827   3.042  -8.249
  388   1HH2  ARG  47          1HH2      ARG  47   3.553   5.033  -9.043
  389   2HH2  ARG  47          2HH2      ARG  47   2.425   3.854  -9.626
  390    H    ASN  48           H        ASN  48   3.899   9.268  -4.345
  391    HA   ASN  48           HA       ASN  48   6.639  10.448  -4.309
  392   1HB   ASN  48          1HB       ASN  48   4.688  12.331  -3.364
  393   2HB   ASN  48          2HB       ASN  48   5.609  12.372  -4.868
  394   2HD2  ASN  48          2HD2      ASN  48   4.658  10.355  -6.379
  395   1HD2  ASN  48          1HD2      ASN  48   3.007  10.541  -6.631
  396    H    ARG  49           H        ARG  49   7.283   9.096  -2.488
  397    HA   ARG  49           HA       ARG  49   5.960   9.015  -0.037
  398   1HB   ARG  49          1HB       ARG  49   8.857   9.114   0.300
  399   2HB   ARG  49          2HB       ARG  49   7.716   7.874   0.791
  400   1HG   ARG  49          1HG       ARG  49   7.562   7.386  -1.790
  401   2HG   ARG  49          2HG       ARG  49   9.132   8.184  -1.833
  402   1HD   ARG  49          1HD       ARG  49   8.799   6.188   0.326
  403   2HD   ARG  49          2HD       ARG  49   8.806   5.525  -1.308
  404    HE   ARG  49           HE       ARG  49  11.106   6.532   0.078
  405   1HH1  ARG  49          1HH1      ARG  49  11.000   4.703  -2.374
  406   2HH1  ARG  49          2HH1      ARG  49  11.800   5.688  -3.553
  407   1HH2  ARG  49          1HH2      ARG  49  11.508   8.605  -1.701
  408   2HH2  ARG  49          2HH2      ARG  49  12.089   7.897  -3.172
  409    HA   PRO  50           HA       PRO  50   8.345  12.918   1.296
  410   1HB   PRO  50          1HB       PRO  50   9.623  14.279  -0.727
  411   2HB   PRO  50          2HB       PRO  50  10.389  13.001   0.231
  412   1HG   PRO  50          1HG       PRO  50   9.390  12.913  -2.579
  413   2HG   PRO  50          2HG       PRO  50  10.643  11.930  -1.807
  414   1HD   PRO  50          1HD       PRO  50   7.943  11.140  -2.310
  415   2HD   PRO  50          2HD       PRO  50   9.114  10.261  -1.336
  416    HA   PRO  51           HA       PRO  51   4.905  15.361  -0.168
  417   1HB   PRO  51          1HB       PRO  51   4.956  17.207   1.869
  418   2HB   PRO  51          2HB       PRO  51   4.236  15.596   2.017
  419   1HG   PRO  51          1HG       PRO  51   6.825  16.613   3.101
  420   2HG   PRO  51          2HG       PRO  51   5.789  15.314   3.711
  421   1HD   PRO  51          1HD       PRO  51   8.164  14.988   2.205
  422   2HD   PRO  51          2HD       PRO  51   6.967  13.724   2.548
  423    H    LEU  52           H        LEU  52   8.064  16.052  -0.510
  424    HA   LEU  52           HA       LEU  52   9.249  17.776  -1.575
  425   1HB   LEU  52          1HB       LEU  52   6.411  18.322  -2.446
  426   2HB   LEU  52          2HB       LEU  52   7.750  19.342  -2.972
  427    HG   LEU  52           HG       LEU  52   7.194  17.461  -4.563
  428   1HD1  LEU  52          1HD1      LEU  52   6.728  15.869  -2.577
  429   2HD1  LEU  52          2HD1      LEU  52   7.606  15.203  -3.954
  430   3HD1  LEU  52          3HD1      LEU  52   8.479  15.670  -2.495
  431   1HD2  LEU  52          1HD2      LEU  52   9.519  18.570  -4.192
  432   2HD2  LEU  52          2HD2      LEU  52   9.944  17.059  -3.386
  433   3HD2  LEU  52          3HD2      LEU  52   9.463  17.048  -5.082
  434    HA   PRO  53           HA       PRO  53   8.615  20.759   1.770
  435   1HB   PRO  53          1HB       PRO  53  11.298  21.241   2.104
  436   2HB   PRO  53          2HB       PRO  53  10.445  19.885   2.862
  437   1HG   PRO  53          1HG       PRO  53  12.329  19.873   0.546
  438   2HG   PRO  53          2HG       PRO  53  11.955  18.576   1.690
  439   1HD   PRO  53          1HD       PRO  53  10.947  18.829  -0.957
  440   2HD   PRO  53          2HD       PRO  53  10.367  17.700   0.284
  441    H    ALA  54           H        ALA  54   9.052  21.175  -1.369
  442    HA   ALA  54           HA       ALA  54   9.030  23.143  -2.664
  443   1HB   ALA  54          1HB       ALA  54   9.637  25.102  -0.659
  444   2HB   ALA  54          2HB       ALA  54   8.437  23.973  -0.020
  445   3HB   ALA  54          3HB       ALA  54   8.121  24.848  -1.523
  446    H    GLY  55           H        GLY  55  11.228  21.952  -3.080
  447   1HA   GLY  55          1HA       GLY  55  13.708  22.512  -2.133
  448   2HA   GLY  55          2HA       GLY  55  13.323  24.015  -2.973
  449    H    THR  56           H        THR  56  11.650  22.289  -4.902
  450    HA   THR  56           HA       THR  56  11.997  21.046  -6.879
  451    HB   THR  56           HB       THR  56  13.332  22.209  -8.385
  452    HG1  THR  56           HG1      THR  56  15.342  22.875  -7.928
  453   1HG2  THR  56          1HG2      THR  56  11.837  23.767  -7.052
  454   2HG2  THR  56          2HG2      THR  56  13.262  24.204  -6.111
  455   3HG2  THR  56          3HG2      THR  56  13.210  24.546  -7.840

  No H/Q in entry =         455
  Start of MODEL    2
    1    H2   PRO   1           H2       PRO   1  -2.786   8.269  -8.461
    2    H3   PRO   1           H3       PRO   1  -2.639   8.591 -10.124
    3    HA   PRO   1           HA       PRO   1  -2.087  10.684  -9.682
    4   1HB   PRO   1          1HB       PRO   1  -4.213  11.572  -7.976
    5   2HB   PRO   1          2HB       PRO   1  -3.994  11.891  -9.702
    6   1HG   PRO   1          1HG       PRO   1  -5.920  10.183  -8.463
    7   2HG   PRO   1          2HG       PRO   1  -5.674  10.471 -10.194
    8   1HD   PRO   1          1HD       PRO   1  -4.977   8.124  -8.603
    9   2HD   PRO   1          2HD       PRO   1  -4.820   8.320 -10.353
   10    H    GLU   2           H        GLU   2  -3.618   9.430  -6.692
   11    HA   GLU   2           HA       GLU   2  -1.085   9.910  -5.249
   12   1HB   GLU   2          1HB       GLU   2  -2.546  11.064  -3.406
   13   2HB   GLU   2          2HB       GLU   2  -1.996  12.019  -4.783
   14   1HG   GLU   2          1HG       GLU   2  -4.108  11.959  -5.824
   15   2HG   GLU   2          2HG       GLU   2  -4.635  10.566  -4.879
   16    H    PHE   3           H        PHE   3  -0.770   8.019  -4.190
   17    HA   PHE   3           HA       PHE   3  -3.155   6.687  -2.973
   18   1HB   PHE   3          1HB       PHE   3  -2.655   5.074  -4.566
   19   2HB   PHE   3          2HB       PHE   3  -0.992   5.635  -4.729
   20    HD1  PHE   3           HD1      PHE   3  -3.031   3.030  -3.408
   21    HD2  PHE   3           HD2      PHE   3   0.584   5.224  -2.806
   22    HE1  PHE   3           HE1      PHE   3  -2.129   1.171  -2.086
   23    HE2  PHE   3           HE2      PHE   3   1.497   3.371  -1.535
   24    HZ   PHE   3           HZ       PHE   3   0.149   1.284  -1.188
   25    H    LEU   4           H        LEU   4  -2.649   5.444  -1.087
   26    HA   LEU   4           HA       LEU   4  -1.319   6.786   0.959
   27   1HB   LEU   4          1HB       LEU   4  -1.100   4.329   1.934
   28   2HB   LEU   4          2HB       LEU   4  -2.691   5.036   1.692
   29    HG   LEU   4           HG       LEU   4  -1.594   3.747  -0.703
   30   1HD1  LEU   4          1HD1      LEU   4  -0.675   2.275   1.060
   31   2HD1  LEU   4          2HD1      LEU   4  -2.294   2.123   1.739
   32   3HD1  LEU   4          3HD1      LEU   4  -1.946   1.467   0.136
   33   1HD2  LEU   4          1HD2      LEU   4  -4.120   4.127   0.754
   34   2HD2  LEU   4          2HD2      LEU   4  -3.832   4.082  -0.985
   35   3HD2  LEU   4          3HD2      LEU   4  -3.986   2.579  -0.080
   36    H    GLU   5           H        GLU   5   0.740   7.534   0.052
   37    HA   GLU   5           HA       GLU   5   2.753   5.685  -0.846
   38   1HB   GLU   5          1HB       GLU   5   3.088   8.469   0.306
   39   2HB   GLU   5          2HB       GLU   5   4.300   7.582  -0.618
   40   1HG   GLU   5          1HG       GLU   5   3.359   8.811  -2.327
   41   2HG   GLU   5          2HG       GLU   5   2.287   7.416  -2.386
   42    H    ASP   6           H        ASP   6   1.456   6.291   2.183
   43    HA   ASP   6           HA       ASP   6   3.537   4.659   3.480
   44   1HB   ASP   6          1HB       ASP   6   3.012   7.544   4.091
   45   2HB   ASP   6          2HB       ASP   6   3.305   6.456   5.448
   46    HA   PRO   7           HA       PRO   7  -0.788   3.765   4.645
   47   1HB   PRO   7          1HB       PRO   7  -0.544   1.046   4.331
   48   2HB   PRO   7          2HB       PRO   7  -0.986   2.146   3.021
   49   1HG   PRO   7          1HG       PRO   7   1.596   0.759   3.519
   50   2HG   PRO   7          2HG       PRO   7   0.905   1.332   1.994
   51   1HD   PRO   7          1HD       PRO   7   2.959   2.610   3.492
   52   2HD   PRO   7          2HD       PRO   7   2.057   3.325   2.140
   53    H    SER   8           H        SER   8   0.715   4.423   6.745
   54    HA   SER   8           HA       SER   8   1.006   1.958   8.405
   55   1HB   SER   8          1HB       SER   8   2.914   3.775   8.029
   56   2HB   SER   8          2HB       SER   8   2.039   4.623   9.304
   57    HG   SER   8           HG       SER   8   3.035   3.339  10.609
   58    H    VAL   9           H        VAL   9  -1.401   3.874   7.729
   59    HA   VAL   9           HA       VAL   9  -2.283   4.113  10.573
   60    HB   VAL   9           HB       VAL   9  -3.327   6.221  10.128
   61   1HG1  VAL   9          1HG1      VAL   9  -4.079   5.576   7.818
   62   2HG1  VAL   9          2HG1      VAL   9  -3.423   7.210   7.916
   63   3HG1  VAL   9          3HG1      VAL   9  -2.443   5.905   7.248
   64   1HG2  VAL   9          1HG2      VAL   9  -0.560   6.076   8.898
   65   2HG2  VAL   9          2HG2      VAL   9  -1.371   7.583   9.320
   66   3HG2  VAL   9          3HG2      VAL   9  -0.953   6.423  10.581
   67    H    LEU  10           H        LEU  10  -2.876   2.680   7.613
   68    HA   LEU  10           HA       LEU  10  -5.827   2.660   7.990
   69   1HB   LEU  10          1HB       LEU  10  -5.255   1.013   5.779
   70   2HB   LEU  10          2HB       LEU  10  -5.830   2.681   5.718
   71    HG   LEU  10           HG       LEU  10  -2.884   1.929   5.891
   72   1HD1  LEU  10          1HD1      LEU  10  -4.171   1.325   3.709
   73   2HD1  LEU  10          2HD1      LEU  10  -4.238   3.066   3.447
   74   3HD1  LEU  10          3HD1      LEU  10  -2.689   2.249   3.564
   75   1HD2  LEU  10          1HD2      LEU  10  -4.228   4.331   6.424
   76   2HD2  LEU  10          2HD2      LEU  10  -2.498   4.139   6.137
   77   3HD2  LEU  10          3HD2      LEU  10  -3.575   4.535   4.798
   78    H    THR  11           H        THR  11  -3.692   0.044   6.921
   79    HA   THR  11           HA       THR  11  -3.632  -1.711   9.005
   80    HB   THR  11           HB       THR  11  -5.953  -1.506   9.455
   81    HG1  THR  11           HG1      THR  11  -6.779  -3.531   8.224
   82   1HG2  THR  11          1HG2      THR  11  -6.087  -1.235   6.507
   83   2HG2  THR  11          2HG2      THR  11  -7.501  -1.948   7.289
   84   3HG2  THR  11          3HG2      THR  11  -6.964  -0.320   7.741
   85    H    LYS  12           H        LYS  12  -4.148  -4.113   8.003
   86    HA   LYS  12           HA       LYS  12  -2.717  -4.087   5.446
   87   1HB   LYS  12          1HB       LYS  12  -2.997  -5.916   7.615
   88   2HB   LYS  12          2HB       LYS  12  -3.650  -6.730   6.201
   89   1HG   LYS  12          1HG       LYS  12  -1.460  -7.261   5.801
   90   2HG   LYS  12          2HG       LYS  12  -1.340  -5.598   5.167
   91   1HD   LYS  12          1HD       LYS  12   0.410  -5.844   6.816
   92   2HD   LYS  12          2HD       LYS  12  -0.854  -4.851   7.548
   93   1HE   LYS  12          1HE       LYS  12  -0.650  -6.341   9.268
   94   2HE   LYS  12          2HE       LYS  12  -1.723  -7.317   8.267
   95   1HZ   LYS  12          1HZ       LYS  12   1.094  -7.524   7.633
   96   2HZ   LYS  12          2HZ       LYS  12   0.653  -8.143   9.151
   97   3HZ   LYS  12          3HZ       LYS  12  -0.088  -8.738   7.748
   98    H    ASP  13           H        ASP  13  -5.939  -3.838   6.372
   99    HA   ASP  13           HA       ASP  13  -6.924  -5.358   4.013
  100   1HB   ASP  13          1HB       ASP  13  -7.871  -5.364   6.518
  101   2HB   ASP  13          2HB       ASP  13  -8.828  -4.028   5.878
  102    H    LYS  14           H        LYS  14  -6.560  -2.011   5.067
  103    HA   LYS  14           HA       LYS  14  -8.501  -1.019   3.079
  104   1HB   LYS  14          1HB       LYS  14  -7.952  -0.030   5.362
  105   2HB   LYS  14          2HB       LYS  14  -6.493   0.576   4.611
  106   1HG   LYS  14          1HG       LYS  14  -9.308   1.084   3.633
  107   2HG   LYS  14          2HG       LYS  14  -8.324   2.223   4.551
  108   1HD   LYS  14          1HD       LYS  14  -7.770   1.145   1.758
  109   2HD   LYS  14          2HD       LYS  14  -8.106   2.774   2.232
  110   1HE   LYS  14          1HE       LYS  14  -6.044   3.059   3.341
  111   2HE   LYS  14          2HE       LYS  14  -5.758   1.322   3.325
  112   1HZ   LYS  14          1HZ       LYS  14  -5.675   1.509   0.875
  113   2HZ   LYS  14          2HZ       LYS  14  -5.676   3.193   1.071
  114   3HZ   LYS  14          3HZ       LYS  14  -4.407   2.267   1.707
  115    H    LEU  15           H        LEU  15  -4.998  -0.733   3.592
  116    HA   LEU  15           HA       LEU  15  -4.192   0.510   1.256
  117   1HB   LEU  15          1HB       LEU  15  -2.391  -1.630   1.414
  118   2HB   LEU  15          2HB       LEU  15  -2.194  -0.044   2.153
  119    HG   LEU  15           HG       LEU  15  -3.280  -0.807   4.197
  120   1HD1  LEU  15          1HD1      LEU  15  -4.235  -2.871   2.487
  121   2HD1  LEU  15          2HD1      LEU  15  -4.672  -2.559   4.169
  122   3HD1  LEU  15          3HD1      LEU  15  -3.296  -3.615   3.770
  123   1HD2  LEU  15          1HD2      LEU  15  -0.821  -1.193   3.800
  124   2HD2  LEU  15          2HD2      LEU  15  -1.553  -2.302   4.961
  125   3HD2  LEU  15          3HD2      LEU  15  -1.230  -2.838   3.313
  126    H    LYS  16           H        LYS  16  -5.606  -2.671   1.542
  127    HA   LYS  16           HA       LYS  16  -4.817  -3.493  -1.126
  128   1HB   LYS  16          1HB       LYS  16  -5.498  -5.536  -0.416
  129   2HB   LYS  16          2HB       LYS  16  -5.459  -4.812   1.167
  130   1HG   LYS  16          1HG       LYS  16  -7.828  -4.380   1.090
  131   2HG   LYS  16          2HG       LYS  16  -7.917  -4.876  -0.589
  132   1HD   LYS  16          1HD       LYS  16  -8.281  -6.987   0.076
  133   2HD   LYS  16          2HD       LYS  16  -6.704  -6.992   0.873
  134   1HE   LYS  16          1HE       LYS  16  -8.021  -5.559   2.677
  135   2HE   LYS  16          2HE       LYS  16  -9.406  -6.422   2.009
  136   1HZ   LYS  16          1HZ       LYS  16  -7.175  -8.140   2.451
  137   2HZ   LYS  16          2HZ       LYS  16  -7.677  -7.379   3.886
  138   3HZ   LYS  16          3HZ       LYS  16  -8.777  -8.301   2.979
  139    H    SER  17           H        SER  17  -7.856  -2.711   0.495
  140    HA   SER  17           HA       SER  17  -9.715  -2.842  -1.529
  141   1HB   SER  17          1HB       SER  17 -10.492  -2.125   0.555
  142   2HB   SER  17          2HB       SER  17  -9.302  -0.844   0.653
  143    HG   SER  17           HG       SER  17 -11.767  -0.685  -0.251
  144    H    GLU  18           H        GLU  18  -7.128  -0.621  -1.174
  145    HA   GLU  18           HA       GLU  18  -8.061   1.090  -3.387
  146   1HB   GLU  18          1HB       GLU  18  -5.396   1.320  -2.017
  147   2HB   GLU  18          2HB       GLU  18  -6.371   2.583  -2.749
  148   1HG   GLU  18          1HG       GLU  18  -7.091   1.038  -0.243
  149   2HG   GLU  18          2HG       GLU  18  -6.550   2.693  -0.269
  150    H    LEU  19           H        LEU  19  -5.069  -0.786  -2.653
  151    HA   LEU  19           HA       LEU  19  -3.684  -0.732  -4.987
  152   1HB   LEU  19          1HB       LEU  19  -4.353  -3.021  -3.180
  153   2HB   LEU  19          2HB       LEU  19  -3.530  -3.370  -4.676
  154    HG   LEU  19           HG       LEU  19  -2.416  -1.066  -3.223
  155   1HD1  LEU  19          1HD1      LEU  19  -1.745  -2.748  -5.250
  156   2HD1  LEU  19          2HD1      LEU  19  -0.572  -1.796  -4.339
  157   3HD1  LEU  19          3HD1      LEU  19  -0.870  -3.485  -3.910
  158   1HD2  LEU  19          1HD2      LEU  19  -2.866  -3.677  -1.910
  159   2HD2  LEU  19          2HD2      LEU  19  -1.172  -3.188  -1.923
  160   3HD2  LEU  19          3HD2      LEU  19  -2.388  -2.141  -1.183
  161    H    VAL  20           H        VAL  20  -6.801  -2.309  -4.538
  162    HA   VAL  20           HA       VAL  20  -6.955  -3.657  -7.051
  163    HB   VAL  20           HB       VAL  20  -8.983  -2.592  -5.081
  164   1HG1  VAL  20          1HG1      VAL  20  -8.269  -5.340  -6.143
  165   2HG1  VAL  20          2HG1      VAL  20  -7.831  -4.679  -4.568
  166   3HG1  VAL  20          3HG1      VAL  20  -9.522  -5.013  -4.945
  167   1HG2  VAL  20          1HG2      VAL  20  -9.427  -3.200  -7.927
  168   2HG2  VAL  20          2HG2      VAL  20 -10.449  -4.143  -6.843
  169   3HG2  VAL  20          3HG2      VAL  20 -10.483  -2.380  -6.777
  170    H    ALA  21           H        ALA  21  -8.407  -0.548  -6.080
  171    HA   ALA  21           HA       ALA  21  -9.121   0.291  -8.710
  172   1HB   ALA  21          1HB       ALA  21  -9.361   2.515  -7.699
  173   2HB   ALA  21          2HB       ALA  21 -10.017   1.287  -6.613
  174   3HB   ALA  21          3HB       ALA  21  -8.428   1.988  -6.293
  175    H    ASN  22           H        ASN  22  -6.048   0.110  -7.183
  176    HA   ASN  22           HA       ASN  22  -4.940   2.164  -9.025
  177   1HB   ASN  22          1HB       ASN  22  -3.575   0.752  -6.711
  178   2HB   ASN  22          2HB       ASN  22  -2.999   2.195  -7.550
  179   2HD2  ASN  22          2HD2      ASN  22  -4.621   1.319  -4.725
  180   1HD2  ASN  22          1HD2      ASN  22  -5.570   2.710  -4.515
  181    H    ASN  23           H        ASN  23  -5.728  -0.313 -10.169
  182    HA   ASN  23           HA       ASN  23  -4.898  -1.891 -11.685
  183   1HB   ASN  23          1HB       ASN  23  -3.397   0.304 -12.061
  184   2HB   ASN  23          2HB       ASN  23  -2.135  -0.801 -11.519
  185   2HD2  ASN  23          2HD2      ASN  23  -3.745  -3.148 -12.666
  186   1HD2  ASN  23          1HD2      ASN  23  -3.458  -3.074 -14.340
  187    H    VAL  24           H        VAL  24  -4.962  -2.844  -9.072
  188    HA   VAL  24           HA       VAL  24  -2.691  -4.734  -9.164
  189    HB   VAL  24           HB       VAL  24  -3.403  -3.383  -6.562
  190   1HG1  VAL  24          1HG1      VAL  24  -1.419  -5.350  -7.561
  191   2HG1  VAL  24          2HG1      VAL  24  -0.785  -4.138  -6.448
  192   3HG1  VAL  24          3HG1      VAL  24  -2.117  -5.183  -5.950
  193   1HG2  VAL  24          1HG2      VAL  24  -2.612  -1.696  -8.257
  194   2HG2  VAL  24          2HG2      VAL  24  -1.533  -1.865  -6.872
  195   3HG2  VAL  24          3HG2      VAL  24  -1.122  -2.624  -8.411
  196    H    THR  25           H        THR  25  -3.872  -6.619  -9.329
  197    HA   THR  25           HA       THR  25  -6.513  -6.902  -8.213
  198    HB   THR  25           HB       THR  25  -5.441  -9.462  -8.602
  199    HG1  THR  25           HG1      THR  25  -3.843  -9.137  -9.900
  200   1HG2  THR  25          1HG2      THR  25  -7.050  -7.642 -10.403
  201   2HG2  THR  25          2HG2      THR  25  -6.842  -9.372 -10.679
  202   3HG2  THR  25          3HG2      THR  25  -7.683  -8.803  -9.236
  203    H    LEU  26           H        LEU  26  -7.060  -8.591  -6.584
  204    HA   LEU  26           HA       LEU  26  -4.976  -8.695  -4.449
  205   1HB   LEU  26          1HB       LEU  26  -7.972  -8.812  -4.084
  206   2HB   LEU  26          2HB       LEU  26  -6.791  -8.708  -2.807
  207    HG   LEU  26           HG       LEU  26  -8.095  -6.636  -4.190
  208   1HD1  LEU  26          1HD1      LEU  26  -5.173  -6.788  -4.735
  209   2HD1  LEU  26          2HD1      LEU  26  -6.477  -6.233  -5.780
  210   3HD1  LEU  26          3HD1      LEU  26  -5.909  -5.215  -4.458
  211   1HD2  LEU  26          1HD2      LEU  26  -6.645  -7.066  -1.759
  212   2HD2  LEU  26          2HD2      LEU  26  -6.192  -5.510  -2.471
  213   3HD2  LEU  26          3HD2      LEU  26  -7.885  -5.868  -2.118
  214    HA   PRO  27           HA       PRO  27  -5.680 -13.052  -5.384
  215   1HB   PRO  27          1HB       PRO  27  -3.041 -13.726  -5.010
  216   2HB   PRO  27          2HB       PRO  27  -3.670 -13.068  -6.522
  217   1HG   PRO  27          1HG       PRO  27  -1.886 -11.825  -4.533
  218   2HG   PRO  27          2HG       PRO  27  -2.254 -11.289  -6.179
  219   1HD   PRO  27          1HD       PRO  27  -3.357 -10.336  -3.664
  220   2HD   PRO  27          2HD       PRO  27  -3.585  -9.663  -5.270
  221    H    ALA  28           H        ALA  28  -6.805 -12.808  -3.068
  222    HA   ALA  28           HA       ALA  28  -5.880 -14.859  -1.369
  223   1HB   ALA  28          1HB       ALA  28  -4.625 -12.227  -0.872
  224   2HB   ALA  28          2HB       ALA  28  -4.072 -13.841  -0.429
  225   3HB   ALA  28          3HB       ALA  28  -5.282 -13.022   0.561
  226    H    GLY  29           H        GLY  29  -6.953 -11.600  -0.373
  227   1HA   GLY  29          1HA       GLY  29  -9.487 -12.877   0.580
  228   2HA   GLY  29          2HA       GLY  29  -9.484 -11.288  -0.200
  229    H    GLU  30           H        GLU  30  -7.927 -13.016   2.531
  230    HA   GLU  30           HA       GLU  30  -8.545 -10.773   4.316
  231   1HB   GLU  30          1HB       GLU  30  -7.871 -13.550   4.614
  232   2HB   GLU  30          2HB       GLU  30  -6.721 -12.589   5.544
  233   1HG   GLU  30          1HG       GLU  30  -8.537 -12.957   7.030
  234   2HG   GLU  30          2HG       GLU  30  -8.772 -11.313   6.435
  235    H    GLN  31           H        GLN  31  -5.436 -12.438   4.218
  236    HA   GLN  31           HA       GLN  31  -3.880 -10.441   2.967
  237   1HB   GLN  31          1HB       GLN  31  -4.411  -9.922   5.845
  238   2HB   GLN  31          2HB       GLN  31  -2.698 -10.089   5.516
  239   1HG   GLN  31          1HG       GLN  31  -2.962  -7.876   5.265
  240   2HG   GLN  31          2HG       GLN  31  -3.189  -8.317   3.598
  241   2HE2  GLN  31          2HE2      GLN  31  -5.110  -7.954   6.651
  242   1HE2  GLN  31          1HE2      GLN  31  -6.480  -7.286   5.904
  243    H    ARG  32           H        ARG  32  -2.325 -11.586   2.224
  244    HA   ARG  32           HA       ARG  32  -1.763 -14.232   2.919
  245   1HB   ARG  32          1HB       ARG  32  -0.598 -12.016   1.284
  246   2HB   ARG  32          2HB       ARG  32   0.366 -13.444   1.518
  247   1HG   ARG  32          1HG       ARG  32  -0.784 -14.451  -0.145
  248   2HG   ARG  32          2HG       ARG  32  -2.260 -14.306   0.805
  249   1HD   ARG  32          1HD       ARG  32  -1.140 -12.210  -1.096
  250   2HD   ARG  32          2HD       ARG  32  -2.591 -13.176  -1.342
  251    HE   ARG  32           HE       ARG  32  -3.410 -11.942   0.801
  252   1HH1  ARG  32          1HH1      ARG  32  -2.603  -9.820   1.768
  253   2HH1  ARG  32          2HH1      ARG  32  -2.355  -8.568   0.601
  254   1HH2  ARG  32          1HH2      ARG  32  -2.457 -10.711  -2.116
  255   2HH2  ARG  32          2HH2      ARG  32  -2.275  -9.069  -1.599
  256    H    LYS  33           H        LYS  33   0.074 -11.247   3.574
  257    HA   LYS  33           HA       LYS  33   0.814 -11.864   6.221
  258   1HB   LYS  33          1HB       LYS  33   2.071 -13.689   4.716
  259   2HB   LYS  33          2HB       LYS  33   3.216 -12.364   4.505
  260   1HG   LYS  33          1HG       LYS  33   3.916 -13.651   6.434
  261   2HG   LYS  33          2HG       LYS  33   3.269 -12.115   7.013
  262   1HD   LYS  33          1HD       LYS  33   1.814 -13.264   8.291
  263   2HD   LYS  33          2HD       LYS  33   1.066 -13.884   6.819
  264   1HE   LYS  33          1HE       LYS  33   1.823 -15.942   7.327
  265   2HE   LYS  33          2HE       LYS  33   3.478 -15.343   7.223
  266   1HZ   LYS  33          1HZ       LYS  33   1.942 -14.776   9.651
  267   2HZ   LYS  33          2HZ       LYS  33   2.544 -16.350   9.432
  268   3HZ   LYS  33          3HZ       LYS  33   3.608 -15.026   9.461
  269    H    ASP  34           H        ASP  34   0.322  -9.514   6.100
  270    HA   ASP  34           HA       ASP  34   0.922  -7.241   5.722
  271   1HB   ASP  34          1HB       ASP  34   3.075  -8.526   6.945
  272   2HB   ASP  34          2HB       ASP  34   3.814  -7.831   5.500
  273    H    VAL  35           H        VAL  35   0.265  -8.845   3.500
  274    HA   VAL  35           HA       VAL  35   2.291  -8.332   1.456
  275    HB   VAL  35           HB       VAL  35  -0.375  -9.773   1.388
  276   1HG1  VAL  35          1HG1      VAL  35   2.329 -10.390   2.087
  277   2HG1  VAL  35          2HG1      VAL  35   0.945 -11.471   2.048
  278   3HG1  VAL  35          3HG1      VAL  35   1.944 -11.258   0.607
  279   1HG2  VAL  35          1HG2      VAL  35   1.143  -8.576  -0.773
  280   2HG2  VAL  35          2HG2      VAL  35   1.080 -10.339  -0.920
  281   3HG2  VAL  35          3HG2      VAL  35  -0.414  -9.407  -0.804
  282    H    TYR  36           H        TYR  36  -1.250  -7.412   1.640
  283    HA   TYR  36           HA       TYR  36  -1.141  -5.592  -0.470
  284   1HB   TYR  36          1HB       TYR  36  -2.578  -5.253   2.173
  285   2HB   TYR  36          2HB       TYR  36  -2.955  -4.435   0.671
  286    HD1  TYR  36           HD1      TYR  36  -3.988  -6.914   2.669
  287    HD2  TYR  36           HD2      TYR  36  -2.955  -6.273  -1.413
  288    HE1  TYR  36           HE1      TYR  36  -5.345  -8.894   2.043
  289    HE2  TYR  36           HE2      TYR  36  -4.314  -8.224  -2.074
  290    HH   TYR  36           HH       TYR  36  -5.869  -9.720  -1.371
  291    H    VAL  37           H        VAL  37   0.331  -5.485   2.658
  292    HA   VAL  37           HA       VAL  37   0.885  -2.641   2.617
  293    HB   VAL  37           HB       VAL  37   1.961  -4.952   4.271
  294   1HG1  VAL  37          1HG1      VAL  37  -0.466  -4.007   4.499
  295   2HG1  VAL  37          2HG1      VAL  37   0.508  -4.185   5.962
  296   3HG1  VAL  37          3HG1      VAL  37   0.325  -2.599   5.217
  297   1HG2  VAL  37          1HG2      VAL  37   3.276  -2.543   3.795
  298   2HG2  VAL  37          2HG2      VAL  37   2.403  -2.241   5.298
  299   3HG2  VAL  37          3HG2      VAL  37   3.530  -3.593   5.188
  300    H    GLN  38           H        GLN  38   3.003  -5.543   2.346
  301    HA   GLN  38           HA       GLN  38   5.246  -4.128   1.282
  302   1HB   GLN  38          1HB       GLN  38   4.472  -6.893   1.683
  303   2HB   GLN  38          2HB       GLN  38   5.199  -6.706   0.091
  304   1HG   GLN  38          1HG       GLN  38   6.785  -7.202   2.067
  305   2HG   GLN  38          2HG       GLN  38   7.232  -5.885   0.989
  306   2HE2  GLN  38          2HE2      GLN  38   4.613  -5.625   3.375
  307   1HE2  GLN  38          1HE2      GLN  38   5.402  -4.487   4.359
  308    H    LEU  39           H        LEU  39   2.993  -6.235  -0.486
  309    HA   LEU  39           HA       LEU  39   3.359  -5.774  -3.122
  310   1HB   LEU  39          1HB       LEU  39   0.867  -5.886  -1.490
  311   2HB   LEU  39          2HB       LEU  39   0.668  -5.226  -3.116
  312    HG   LEU  39           HG       LEU  39   2.087  -7.848  -2.597
  313   1HD1  LEU  39          1HD1      LEU  39  -0.468  -7.569  -1.901
  314   2HD1  LEU  39          2HD1      LEU  39  -0.718  -7.669  -3.643
  315   3HD1  LEU  39          3HD1      LEU  39   0.070  -8.996  -2.790
  316   1HD2  LEU  39          1HD2      LEU  39   1.165  -6.239  -4.938
  317   2HD2  LEU  39          2HD2      LEU  39   2.619  -7.226  -4.759
  318   3HD2  LEU  39          3HD2      LEU  39   1.061  -7.999  -5.062
  319    H    TYR  40           H        TYR  40   1.583  -3.446  -1.087
  320    HA   TYR  40           HA       TYR  40   1.203  -1.405  -2.921
  321   1HB   TYR  40          1HB       TYR  40   0.233  -0.633  -1.047
  322   2HB   TYR  40          2HB       TYR  40   1.123  -1.787  -0.076
  323    HD1  TYR  40           HD1      TYR  40   1.958   1.372  -1.963
  324    HD2  TYR  40           HD2      TYR  40   2.352  -0.896   1.660
  325    HE1  TYR  40           HE1      TYR  40   3.345   3.178  -0.975
  326    HE2  TYR  40           HE2      TYR  40   3.738   0.904   2.637
  327    HH   TYR  40           HH       TYR  40   4.863   2.795   2.195
  328    H    LEU  41           H        LEU  41   3.978  -1.542  -0.611
  329    HA   LEU  41           HA       LEU  41   5.305   0.647  -1.831
  330   1HB   LEU  41          1HB       LEU  41   5.750  -0.890   0.388
  331   2HB   LEU  41          2HB       LEU  41   7.049  -1.445  -0.664
  332    HG   LEU  41           HG       LEU  41   7.531   1.080  -1.061
  333   1HD1  LEU  41          1HD1      LEU  41   8.468  -0.805   0.772
  334   2HD1  LEU  41          2HD1      LEU  41   9.261   0.708   0.333
  335   3HD1  LEU  41          3HD1      LEU  41   8.201   0.644   1.740
  336   1HD2  LEU  41          1HD2      LEU  41   5.645   1.147   1.310
  337   2HD2  LEU  41          2HD2      LEU  41   6.913   2.357   1.133
  338   3HD2  LEU  41          3HD2      LEU  41   5.676   2.198  -0.108
  339    H    GLN  42           H        GLN  42   5.019  -2.650  -2.885
  340    HA   GLN  42           HA       GLN  42   7.425  -2.661  -4.511
  341   1HB   GLN  42          1HB       GLN  42   5.796  -4.609  -3.596
  342   2HB   GLN  42          2HB       GLN  42   5.227  -4.487  -5.258
  343   1HG   GLN  42          1HG       GLN  42   7.069  -6.113  -5.091
  344   2HG   GLN  42          2HG       GLN  42   7.555  -4.723  -6.062
  345   2HE2  GLN  42          2HE2      GLN  42   9.218  -3.333  -5.217
  346   1HE2  GLN  42          1HE2      GLN  42  10.067  -3.684  -3.790
  347    H    HIS  43           H        HIS  43   3.989  -2.769  -5.594
  348    HA   HIS  43           HA       HIS  43   4.775  -1.821  -8.259
  349   1HB   HIS  43          1HB       HIS  43   1.936  -1.890  -7.277
  350   2HB   HIS  43          2HB       HIS  43   2.568  -2.271  -8.891
  351    HD1  HIS  43           HD1      HIS  43   3.515  -4.656  -9.265
  352    HD2  HIS  43           HD2      HIS  43   2.169  -3.941  -5.392
  353    HE1  HIS  43           HE1      HIS  43   3.471  -6.909  -8.108
  354    H    LEU  44           H        LEU  44   3.231  -0.549  -5.391
  355    HA   LEU  44           HA       LEU  44   2.655   1.982  -6.766
  356   1HB   LEU  44          1HB       LEU  44   2.237   1.211  -3.867
  357   2HB   LEU  44          2HB       LEU  44   1.643   2.668  -4.642
  358    HG   LEU  44           HG       LEU  44   0.477  -0.063  -4.654
  359   1HD1  LEU  44          1HD1      LEU  44  -0.310   2.473  -4.184
  360   2HD1  LEU  44          2HD1      LEU  44  -0.889   2.287  -5.829
  361   3HD1  LEU  44          3HD1      LEU  44  -1.430   1.168  -4.579
  362   1HD2  LEU  44          1HD2      LEU  44   1.065   1.366  -7.255
  363   2HD2  LEU  44          2HD2      LEU  44   0.963  -0.365  -6.942
  364   3HD2  LEU  44          3HD2      LEU  44  -0.502   0.604  -7.039
  365    H    THR  45           H        THR  45   5.183   0.616  -4.793
  366    HA   THR  45           HA       THR  45   7.095   1.636  -3.854
  367    HB   THR  45           HB       THR  45   7.577   3.699  -5.651
  368    HG1  THR  45           HG1      THR  45   6.119   3.358  -7.126
  369   1HG2  THR  45          1HG2      THR  45   8.191   0.738  -5.677
  370   2HG2  THR  45          2HG2      THR  45   8.917   1.862  -6.829
  371   3HG2  THR  45          3HG2      THR  45   9.226   2.045  -5.101
  372    H    ALA  46           H        ALA  46   4.403   2.904  -3.135
  373    HA   ALA  46           HA       ALA  46   3.644   4.861  -2.103
  374   1HB   ALA  46          1HB       ALA  46   5.287   4.156  -0.411
  375   2HB   ALA  46          2HB       ALA  46   5.291   5.913  -0.566
  376   3HB   ALA  46          3HB       ALA  46   6.576   4.959  -1.309
  377    H    ARG  47           H        ARG  47   3.859   5.267  -4.634
  378    HA   ARG  47           HA       ARG  47   5.175   6.783  -6.252
  379   1HB   ARG  47          1HB       ARG  47   3.041   8.511  -5.946
  380   2HB   ARG  47          2HB       ARG  47   3.020   7.088  -6.937
  381   1HG   ARG  47          1HG       ARG  47   2.516   6.614  -4.041
  382   2HG   ARG  47          2HG       ARG  47   1.275   7.522  -4.873
  383   1HD   ARG  47          1HD       ARG  47   1.360   4.802  -4.834
  384   2HD   ARG  47          2HD       ARG  47   0.624   5.717  -6.145
  385    HE   ARG  47           HE       ARG  47   3.484   5.226  -6.486
  386   1HH1  ARG  47          1HH1      ARG  47   0.296   3.965  -6.831
  387   2HH1  ARG  47          2HH1      ARG  47   0.666   3.057  -8.258
  388   1HH2  ARG  47          1HH2      ARG  47   3.959   4.130  -8.413
  389   2HH2  ARG  47          2HH2      ARG  47   2.738   3.149  -9.153
  390    H    ASN  48           H        ASN  48   3.362   8.985  -4.172
  391    HA   ASN  48           HA       ASN  48   5.713  10.797  -4.140
  392   1HB   ASN  48          1HB       ASN  48   3.557  12.014  -2.754
  393   2HB   ASN  48          2HB       ASN  48   4.113  12.375  -4.387
  394   2HD2  ASN  48          2HD2      ASN  48   3.342  10.438  -6.002
  395   1HD2  ASN  48          1HD2      ASN  48   1.696  10.109  -5.875
  396    H    ARG  49           H        ARG  49   6.978   9.629  -2.577
  397    HA   ARG  49           HA       ARG  49   6.239   8.671  -0.143
  398   1HB   ARG  49          1HB       ARG  49   8.603  10.153   0.420
  399   2HB   ARG  49          2HB       ARG  49   8.423   8.419   0.217
  400   1HG   ARG  49          1HG       ARG  49   8.806   8.533  -2.129
  401   2HG   ARG  49          2HG       ARG  49   8.630  10.286  -2.156
  402   1HD   ARG  49          1HD       ARG  49  10.999   9.737  -2.254
  403   2HD   ARG  49          2HD       ARG  49  10.653  10.456  -0.681
  404    HE   ARG  49           HE       ARG  49  10.412   7.595  -0.531
  405   1HH1  ARG  49          1HH1      ARG  49  11.853   9.521   1.372
  406   2HH1  ARG  49          2HH1      ARG  49  13.487   8.964   1.220
  407   1HH2  ARG  49          1HH2      ARG  49  12.880   7.145  -1.669
  408   2HH2  ARG  49          2HH2      ARG  49  14.069   7.620  -0.501
  409    HA   PRO  50           HA       PRO  50   6.292  12.951   1.921
  410   1HB   PRO  50          1HB       PRO  50   6.588  15.097   0.224
  411   2HB   PRO  50          2HB       PRO  50   7.943  14.265   1.002
  412   1HG   PRO  50          1HG       PRO  50   7.021  14.123  -1.837
  413   2HG   PRO  50          2HG       PRO  50   8.641  13.860  -1.173
  414   1HD   PRO  50          1HD       PRO  50   6.810  11.827  -1.940
  415   2HD   PRO  50          2HD       PRO  50   8.269  11.588  -0.990
  416    HA   PRO  51           HA       PRO  51   2.021  13.304   0.571
  417   1HB   PRO  51          1HB       PRO  51   1.040  13.976   3.048
  418   2HB   PRO  51          2HB       PRO  51   1.374  12.313   2.540
  419   1HG   PRO  51          1HG       PRO  51   2.927  14.070   4.386
  420   2HG   PRO  51          2HG       PRO  51   2.838  12.303   4.334
  421   1HD   PRO  51          1HD       PRO  51   4.939  13.908   3.306
  422   2HD   PRO  51          2HD       PRO  51   4.703  12.176   2.999
  423    H    LEU  52           H        LEU  52   2.508  15.263  -0.682
  424    HA   LEU  52           HA       LEU  52   2.602  17.835   0.733
  425   1HB   LEU  52          1HB       LEU  52   2.397  17.261  -2.238
  426   2HB   LEU  52          2HB       LEU  52   2.812  18.808  -1.502
  427    HG   LEU  52           HG       LEU  52   4.561  16.904  -0.356
  428   1HD1  LEU  52          1HD1      LEU  52   4.382  16.657  -3.380
  429   2HD1  LEU  52          2HD1      LEU  52   5.650  15.957  -2.373
  430   3HD1  LEU  52          3HD1      LEU  52   3.987  15.386  -2.222
  431   1HD2  LEU  52          1HD2      LEU  52   5.016  18.938  -2.569
  432   2HD2  LEU  52          2HD2      LEU  52   5.050  19.282  -0.839
  433   3HD2  LEU  52          3HD2      LEU  52   6.275  18.232  -1.554
  434    HA   PRO  53           HA       PRO  53  -1.698  18.696   0.482
  435   1HB   PRO  53          1HB       PRO  53  -1.612  21.437   0.282
  436   2HB   PRO  53          2HB       PRO  53  -1.278  20.553   1.783
  437   1HG   PRO  53          1HG       PRO  53   0.629  21.911  -0.071
  438   2HG   PRO  53          2HG       PRO  53   0.792  21.587   1.660
  439   1HD   PRO  53          1HD       PRO  53   2.011  20.118  -0.441
  440   2HD   PRO  53          2HD       PRO  53   1.919  19.627   1.263
  441    H    ALA  54           H        ALA  54   0.132  18.703  -2.193
  442    HA   ALA  54           HA       ALA  54  -0.506  18.735  -4.463
  443   1HB   ALA  54          1HB       ALA  54  -2.654  18.124  -4.676
  444   2HB   ALA  54          2HB       ALA  54  -2.928  18.565  -2.986
  445   3HB   ALA  54          3HB       ALA  54  -3.170  19.760  -4.264
  446    H    GLY  55           H        GLY  55   0.989  20.733  -4.108
  447   1HA   GLY  55          1HA       GLY  55   0.923  23.256  -3.874
  448   2HA   GLY  55          2HA       GLY  55  -0.540  23.197  -4.858
  449    H    THR  56           H        THR  56   1.073  20.864  -6.287
  450    HA   THR  56           HA       THR  56   3.244  22.177  -7.645
  451    HB   THR  56           HB       THR  56   3.107  19.743  -7.598
  452    HG1  THR  56           HG1      THR  56   3.708  21.103  -9.617
  453   1HG2  THR  56          1HG2      THR  56   0.543  20.142  -9.170
  454   2HG2  THR  56          2HG2      THR  56   1.315  18.582  -8.883
  455   3HG2  THR  56          3HG2      THR  56   0.669  19.510  -7.528

  No H/Q in entry =         455
  Start of MODEL    3
    1    H2   PRO   1           H2       PRO   1  -3.553   8.504  -8.488
    2    H3   PRO   1           H3       PRO   1  -3.522   8.848 -10.153
    3    HA   PRO   1           HA       PRO   1  -2.505  10.766  -9.752
    4   1HB   PRO   1          1HB       PRO   1  -4.205  12.010  -7.805
    5   2HB   PRO   1          2HB       PRO   1  -4.113  12.338  -9.540
    6   1HG   PRO   1          1HG       PRO   1  -6.205  11.015  -8.113
    7   2HG   PRO   1          2HG       PRO   1  -6.093  11.309  -9.856
    8   1HD   PRO   1          1HD       PRO   1  -5.730   8.815  -8.385
    9   2HD   PRO   1          2HD       PRO   1  -5.724   9.036 -10.139
   10    H    GLU   2           H        GLU   2  -3.820   9.432  -6.715
   11    HA   GLU   2           HA       GLU   2  -1.124   9.595  -5.526
   12   1HB   GLU   2          1HB       GLU   2  -2.021  11.783  -4.944
   13   2HB   GLU   2          2HB       GLU   2  -3.519  11.055  -4.366
   14   1HG   GLU   2          1HG       GLU   2  -2.040   9.720  -2.735
   15   2HG   GLU   2          2HG       GLU   2  -0.756  10.853  -3.159
   16    H    PHE   3           H        PHE   3  -0.873   8.149  -3.790
   17    HA   PHE   3           HA       PHE   3  -3.230   6.567  -2.924
   18   1HB   PHE   3          1HB       PHE   3  -2.600   5.043  -4.580
   19   2HB   PHE   3          2HB       PHE   3  -0.951   5.667  -4.632
   20    HD1  PHE   3           HD1      PHE   3  -3.026   3.029  -3.398
   21    HD2  PHE   3           HD2      PHE   3   0.589   5.200  -2.770
   22    HE1  PHE   3           HE1      PHE   3  -2.162   1.168  -2.075
   23    HE2  PHE   3           HE2      PHE   3   1.483   3.330  -1.493
   24    HZ   PHE   3           HZ       PHE   3   0.110   1.267  -1.153
   25    H    LEU   4           H        LEU   4  -2.217   4.882  -1.171
   26    HA   LEU   4           HA       LEU   4  -1.102   6.538   0.895
   27   1HB   LEU   4          1HB       LEU   4  -0.908   3.521   0.872
   28   2HB   LEU   4          2HB       LEU   4  -1.019   4.586   2.261
   29    HG   LEU   4           HG       LEU   4  -3.249   4.934   0.418
   30   1HD1  LEU   4          1HD1      LEU   4  -2.403   2.235   1.393
   31   2HD1  LEU   4          2HD1      LEU   4  -4.131   2.603   1.305
   32   3HD1  LEU   4          3HD1      LEU   4  -3.136   2.673  -0.151
   33   1HD2  LEU   4          1HD2      LEU   4  -2.868   4.245   3.344
   34   2HD2  LEU   4          2HD2      LEU   4  -3.329   5.803   2.662
   35   3HD2  LEU   4          3HD2      LEU   4  -4.454   4.452   2.611
   36    H    GLU   5           H        GLU   5   0.832   7.441  -0.143
   37    HA   GLU   5           HA       GLU   5   2.971   5.805  -1.075
   38   1HB   GLU   5          1HB       GLU   5   3.032   8.554   0.207
   39   2HB   GLU   5          2HB       GLU   5   4.402   7.803  -0.611
   40   1HG   GLU   5          1HG       GLU   5   3.474   9.083  -2.332
   41   2HG   GLU   5          2HG       GLU   5   2.688   7.525  -2.619
   42    H    ASP   6           H        ASP   6   1.647   6.394   1.999
   43    HA   ASP   6           HA       ASP   6   3.609   4.593   3.245
   44   1HB   ASP   6          1HB       ASP   6   3.566   7.472   3.717
   45   2HB   ASP   6          2HB       ASP   6   3.179   6.583   5.193
   46    HA   PRO   7           HA       PRO   7  -0.767   3.828   4.383
   47   1HB   PRO   7          1HB       PRO   7  -0.549   1.106   4.096
   48   2HB   PRO   7          2HB       PRO   7  -0.996   2.201   2.780
   49   1HG   PRO   7          1HG       PRO   7   1.575   0.782   3.271
   50   2HG   PRO   7          2HG       PRO   7   0.887   1.364   1.750
   51   1HD   PRO   7          1HD       PRO   7   2.970   2.610   3.228
   52   2HD   PRO   7          2HD       PRO   7   2.067   3.342   1.887
   53    H    SER   8           H        SER   8   0.714   4.513   6.486
   54    HA   SER   8           HA       SER   8   1.117   2.085   8.169
   55   1HB   SER   8          1HB       SER   8   2.528   4.616   7.900
   56   2HB   SER   8          2HB       SER   8   2.065   4.313   9.575
   57    HG   SER   8           HG       SER   8   2.940   2.127   9.169
   58    H    VAL   9           H        VAL   9  -1.456   3.695   7.524
   59    HA   VAL   9           HA       VAL   9  -2.285   3.951  10.378
   60    HB   VAL   9           HB       VAL   9  -3.766   5.873   9.640
   61   1HG1  VAL   9          1HG1      VAL   9  -2.046   5.525   7.181
   62   2HG1  VAL   9          2HG1      VAL   9  -3.804   5.620   7.271
   63   3HG1  VAL   9          3HG1      VAL   9  -2.825   7.057   7.568
   64   1HG2  VAL   9          1HG2      VAL   9  -0.748   6.093   9.509
   65   2HG2  VAL   9          2HG2      VAL   9  -1.816   7.496   9.573
   66   3HG2  VAL   9          3HG2      VAL   9  -1.781   6.351  10.915
   67    H    LEU  10           H        LEU  10  -3.238   3.311   7.040
   68    HA   LEU  10           HA       LEU  10  -5.989   2.744   7.540
   69   1HB   LEU  10          1HB       LEU  10  -5.347   0.941   5.485
   70   2HB   LEU  10          2HB       LEU  10  -5.889   2.600   5.255
   71    HG   LEU  10           HG       LEU  10  -3.558   3.406   5.230
   72   1HD1  LEU  10          1HD1      LEU  10  -4.552   2.678   3.098
   73   2HD1  LEU  10          2HD1      LEU  10  -2.814   2.394   3.131
   74   3HD1  LEU  10          3HD1      LEU  10  -3.944   1.053   3.363
   75   1HD2  LEU  10          1HD2      LEU  10  -2.669   1.562   6.741
   76   2HD2  LEU  10          2HD2      LEU  10  -2.711   0.503   5.338
   77   3HD2  LEU  10          3HD2      LEU  10  -1.683   1.921   5.336
   78    H    THR  11           H        THR  11  -3.867   0.043   6.710
   79    HA   THR  11           HA       THR  11  -3.720  -1.495   8.941
   80    HB   THR  11           HB       THR  11  -6.023  -1.285   9.439
   81    HG1  THR  11           HG1      THR  11  -6.856  -3.404   8.377
   82   1HG2  THR  11          1HG2      THR  11  -6.264  -1.254   6.475
   83   2HG2  THR  11          2HG2      THR  11  -7.648  -1.877   7.381
   84   3HG2  THR  11          3HG2      THR  11  -7.078  -0.223   7.661
   85    H    LYS  12           H        LYS  12  -4.145  -3.983   8.167
   86    HA   LYS  12           HA       LYS  12  -2.901  -4.061   5.512
   87   1HB   LYS  12          1HB       LYS  12  -2.741  -5.706   7.794
   88   2HB   LYS  12          2HB       LYS  12  -3.552  -6.696   6.590
   89   1HG   LYS  12          1HG       LYS  12  -1.470  -7.127   5.816
   90   2HG   LYS  12          2HG       LYS  12  -1.530  -5.502   5.110
   91   1HD   LYS  12          1HD       LYS  12   0.430  -5.426   6.436
   92   2HD   LYS  12          2HD       LYS  12  -0.802  -4.675   7.458
   93   1HE   LYS  12          1HE       LYS  12  -1.168  -7.107   8.364
   94   2HE   LYS  12          2HE       LYS  12   0.440  -7.412   7.704
   95   1HZ   LYS  12          1HZ       LYS  12   0.608  -5.007   9.040
   96   2HZ   LYS  12          2HZ       LYS  12  -0.292  -6.023  10.062
   97   3HZ   LYS  12          3HZ       LYS  12   1.249  -6.501   9.535
   98    H    ASP  13           H        ASP  13  -5.903  -3.484   6.226
   99    HA   ASP  13           HA       ASP  13  -7.015  -5.428   4.239
  100   1HB   ASP  13          1HB       ASP  13  -7.784  -5.209   6.857
  101   2HB   ASP  13          2HB       ASP  13  -8.937  -4.130   6.068
  102    H    LYS  14           H        LYS  14  -6.570  -2.057   4.967
  103    HA   LYS  14           HA       LYS  14  -8.712  -1.268   3.085
  104   1HB   LYS  14          1HB       LYS  14  -8.169  -0.069   5.273
  105   2HB   LYS  14          2HB       LYS  14  -6.720   0.500   4.464
  106   1HG   LYS  14          1HG       LYS  14  -9.585   1.023   3.642
  107   2HG   LYS  14          2HG       LYS  14  -8.406   2.187   4.244
  108   1HD   LYS  14          1HD       LYS  14  -8.171   0.678   1.638
  109   2HD   LYS  14          2HD       LYS  14  -8.616   2.360   1.799
  110   1HE   LYS  14          1HE       LYS  14  -6.047   1.341   3.025
  111   2HE   LYS  14          2HE       LYS  14  -6.128   1.854   1.333
  112   1HZ   LYS  14          1HZ       LYS  14  -7.504   3.757   2.816
  113   2HZ   LYS  14          2HZ       LYS  14  -6.034   3.490   3.619
  114   3HZ   LYS  14          3HZ       LYS  14  -6.044   3.949   1.982
  115    H    LEU  15           H        LEU  15  -5.257  -0.646   3.554
  116    HA   LEU  15           HA       LEU  15  -4.499   0.533   1.216
  117   1HB   LEU  15          1HB       LEU  15  -2.576  -1.484   1.395
  118   2HB   LEU  15          2HB       LEU  15  -2.492   0.105   2.158
  119    HG   LEU  15           HG       LEU  15  -3.541  -0.759   4.178
  120   1HD1  LEU  15          1HD1      LEU  15  -4.238  -2.964   2.408
  121   2HD1  LEU  15          2HD1      LEU  15  -3.537  -3.510   3.920
  122   3HD1  LEU  15          3HD1      LEU  15  -4.975  -2.467   3.941
  123   1HD2  LEU  15          1HD2      LEU  15  -1.036  -1.106   3.640
  124   2HD2  LEU  15          2HD2      LEU  15  -1.724  -2.054   4.960
  125   3HD2  LEU  15          3HD2      LEU  15  -1.473  -2.795   3.379
  126    H    LYS  16           H        LYS  16  -5.684  -2.746   1.539
  127    HA   LYS  16           HA       LYS  16  -4.878  -3.557  -1.098
  128   1HB   LYS  16          1HB       LYS  16  -5.754  -5.584  -0.485
  129   2HB   LYS  16          2HB       LYS  16  -5.512  -4.916   1.096
  130   1HG   LYS  16          1HG       LYS  16  -7.814  -4.425   1.369
  131   2HG   LYS  16          2HG       LYS  16  -8.137  -4.617  -0.346
  132   1HD   LYS  16          1HD       LYS  16  -8.735  -6.718   0.072
  133   2HD   LYS  16          2HD       LYS  16  -7.031  -7.034   0.370
  134   1HE   LYS  16          1HE       LYS  16  -7.372  -6.364   2.753
  135   2HE   LYS  16          2HE       LYS  16  -9.094  -6.194   2.424
  136   1HZ   LYS  16          1HZ       LYS  16  -7.817  -8.706   1.656
  137   2HZ   LYS  16          2HZ       LYS  16  -8.059  -8.434   3.316
  138   3HZ   LYS  16          3HZ       LYS  16  -9.382  -8.421   2.255
  139    H    SER  17           H        SER  17  -7.940  -2.682   0.428
  140    HA   SER  17           HA       SER  17  -9.729  -2.751  -1.660
  141   1HB   SER  17          1HB       SER  17 -10.752  -1.913   0.199
  142   2HB   SER  17          2HB       SER  17  -9.358  -0.946   0.639
  143    HG   SER  17           HG       SER  17 -11.516  -0.321  -0.941
  144    H    GLU  18           H        GLU  18  -7.360  -0.210  -1.023
  145    HA   GLU  18           HA       GLU  18  -8.084   1.341  -3.353
  146   1HB   GLU  18          1HB       GLU  18  -5.412   1.471  -1.985
  147   2HB   GLU  18          2HB       GLU  18  -6.335   2.762  -2.730
  148   1HG   GLU  18          1HG       GLU  18  -6.990   1.353  -0.122
  149   2HG   GLU  18          2HG       GLU  18  -6.545   3.037  -0.346
  150    H    LEU  19           H        LEU  19  -5.183  -0.652  -2.598
  151    HA   LEU  19           HA       LEU  19  -3.749  -0.642  -4.897
  152   1HB   LEU  19          1HB       LEU  19  -4.526  -2.938  -3.139
  153   2HB   LEU  19          2HB       LEU  19  -3.699  -3.290  -4.628
  154    HG   LEU  19           HG       LEU  19  -2.503  -1.057  -3.145
  155   1HD1  LEU  19          1HD1      LEU  19  -1.845  -3.407  -4.793
  156   2HD1  LEU  19          2HD1      LEU  19  -1.122  -1.800  -4.789
  157   3HD1  LEU  19          3HD1      LEU  19  -0.636  -2.989  -3.578
  158   1HD2  LEU  19          1HD2      LEU  19  -2.970  -3.738  -1.902
  159   2HD2  LEU  19          2HD2      LEU  19  -1.332  -3.097  -1.769
  160   3HD2  LEU  19          3HD2      LEU  19  -2.693  -2.184  -1.111
  161    H    VAL  20           H        VAL  20  -6.942  -2.111  -4.570
  162    HA   VAL  20           HA       VAL  20  -6.961  -3.265  -7.238
  163    HB   VAL  20           HB       VAL  20  -9.100  -2.680  -5.176
  164   1HG1  VAL  20          1HG1      VAL  20  -7.830  -5.177  -6.321
  165   2HG1  VAL  20          2HG1      VAL  20  -7.732  -4.585  -4.661
  166   3HG1  VAL  20          3HG1      VAL  20  -9.260  -5.204  -5.289
  167   1HG2  VAL  20          1HG2      VAL  20  -9.419  -3.052  -8.038
  168   2HG2  VAL  20          2HG2      VAL  20 -10.166  -4.381  -7.151
  169   3HG2  VAL  20          3HG2      VAL  20 -10.648  -2.718  -6.818
  170    H    ALA  21           H        ALA  21  -8.550  -0.433  -5.770
  171    HA   ALA  21           HA       ALA  21  -9.669   0.634  -8.153
  172   1HB   ALA  21          1HB       ALA  21  -9.801   2.743  -6.892
  173   2HB   ALA  21          2HB       ALA  21 -10.265   1.383  -5.866
  174   3HB   ALA  21          3HB       ALA  21  -8.661   2.108  -5.701
  175    H    ASN  22           H        ASN  22  -6.395   0.416  -7.200
  176    HA   ASN  22           HA       ASN  22  -5.640   2.734  -8.890
  177   1HB   ASN  22          1HB       ASN  22  -3.940   1.022  -7.048
  178   2HB   ASN  22          2HB       ASN  22  -3.445   2.545  -7.797
  179   2HD2  ASN  22          2HD2      ASN  22  -4.645   1.386  -4.852
  180   1HD2  ASN  22          1HD2      ASN  22  -5.537   2.747  -4.378
  181    H    ASN  23           H        ASN  23  -4.231  -0.559  -8.434
  182    HA   ASN  23           HA       ASN  23  -4.570  -1.402 -11.111
  183   1HB   ASN  23          1HB       ASN  23  -2.865   0.746 -11.098
  184   2HB   ASN  23          2HB       ASN  23  -1.734  -0.603 -10.995
  185   2HD2  ASN  23          2HD2      ASN  23  -3.741  -2.383 -12.471
  186   1HD2  ASN  23          1HD2      ASN  23  -3.605  -1.914 -14.099
  187    H    VAL  24           H        VAL  24  -4.624  -2.722  -8.702
  188    HA   VAL  24           HA       VAL  24  -2.458  -4.699  -9.078
  189    HB   VAL  24           HB       VAL  24  -3.093  -3.683  -6.316
  190   1HG1  VAL  24          1HG1      VAL  24  -1.297  -5.620  -7.538
  191   2HG1  VAL  24          2HG1      VAL  24  -0.404  -4.436  -6.583
  192   3HG1  VAL  24          3HG1      VAL  24  -1.687  -5.387  -5.833
  193   1HG2  VAL  24          1HG2      VAL  24  -1.158  -2.548  -8.339
  194   2HG2  VAL  24          2HG2      VAL  24  -2.363  -1.687  -7.381
  195   3HG2  VAL  24          3HG2      VAL  24  -0.919  -2.338  -6.606
  196    H    THR  25           H        THR  25  -3.462  -6.695  -9.080
  197    HA   THR  25           HA       THR  25  -6.228  -6.921  -8.227
  198    HB   THR  25           HB       THR  25  -5.205  -9.491  -8.547
  199    HG1  THR  25           HG1      THR  25  -4.153  -9.098 -10.666
  200   1HG2  THR  25          1HG2      THR  25  -7.342  -8.554  -9.406
  201   2HG2  THR  25          2HG2      THR  25  -6.432  -7.685 -10.643
  202   3HG2  THR  25          3HG2      THR  25  -6.456  -9.449 -10.642
  203    H    LEU  26           H        LEU  26  -6.916  -8.557  -6.614
  204    HA   LEU  26           HA       LEU  26  -4.974  -8.679  -4.349
  205   1HB   LEU  26          1HB       LEU  26  -7.996  -8.768  -4.242
  206   2HB   LEU  26          2HB       LEU  26  -6.932  -8.750  -2.857
  207    HG   LEU  26           HG       LEU  26  -8.074  -6.583  -4.153
  208   1HD1  LEU  26          1HD1      LEU  26  -5.139  -6.753  -4.708
  209   2HD1  LEU  26          2HD1      LEU  26  -6.443  -6.318  -5.810
  210   3HD1  LEU  26          3HD1      LEU  26  -5.949  -5.198  -4.543
  211   1HD2  LEU  26          1HD2      LEU  26  -6.693  -7.155  -1.761
  212   2HD2  LEU  26          2HD2      LEU  26  -5.982  -5.690  -2.454
  213   3HD2  LEU  26          3HD2      LEU  26  -7.714  -5.763  -2.119
  214    HA   PRO  27           HA       PRO  27  -5.433 -13.048  -5.392
  215   1HB   PRO  27          1HB       PRO  27  -3.087 -13.800  -4.162
  216   2HB   PRO  27          2HB       PRO  27  -3.152 -13.112  -5.792
  217   1HG   PRO  27          1HG       PRO  27  -2.274 -11.828  -3.254
  218   2HG   PRO  27          2HG       PRO  27  -1.780 -11.484  -4.919
  219   1HD   PRO  27          1HD       PRO  27  -3.630  -9.998  -3.390
  220   2HD   PRO  27          2HD       PRO  27  -3.378  -9.852  -5.136
  221    H    ALA  28           H        ALA  28  -3.687 -12.738  -2.309
  222    HA   ALA  28           HA       ALA  28  -4.727 -14.781  -0.857
  223   1HB   ALA  28          1HB       ALA  28  -3.366 -13.627   0.558
  224   2HB   ALA  28          2HB       ALA  28  -4.854 -12.841   1.097
  225   3HB   ALA  28          3HB       ALA  28  -3.823 -12.066  -0.117
  226    H    GLY  29           H        GLY  29  -6.445 -11.725  -1.419
  227   1HA   GLY  29          1HA       GLY  29  -8.969 -13.067  -0.579
  228   2HA   GLY  29          2HA       GLY  29  -8.858 -11.498  -1.414
  229    H    GLU  30           H        GLU  30  -7.199 -12.867   1.395
  230    HA   GLU  30           HA       GLU  30  -8.094 -10.573   3.061
  231   1HB   GLU  30          1HB       GLU  30  -8.477 -13.159   3.691
  232   2HB   GLU  30          2HB       GLU  30  -6.811 -13.007   4.250
  233   1HG   GLU  30          1HG       GLU  30  -7.398 -11.686   6.004
  234   2HG   GLU  30          2HG       GLU  30  -8.554 -10.766   5.041
  235    H    GLN  31           H        GLN  31  -5.711 -11.589   4.830
  236    HA   GLN  31           HA       GLN  31  -3.589 -10.369   3.133
  237   1HB   GLN  31          1HB       GLN  31  -4.056 -10.058   6.131
  238   2HB   GLN  31          2HB       GLN  31  -2.525  -9.646   5.379
  239   1HG   GLN  31          1HG       GLN  31  -3.921  -7.692   5.643
  240   2HG   GLN  31          2HG       GLN  31  -3.650  -7.982   3.945
  241   2HE2  GLN  31          2HE2      GLN  31  -5.900  -9.930   5.919
  242   1HE2  GLN  31          1HE2      GLN  31  -7.321  -9.348   5.200
  243    H    ARG  32           H        ARG  32  -1.814 -11.413   2.870
  244    HA   ARG  32           HA       ARG  32  -1.608 -14.180   3.670
  245   1HB   ARG  32          1HB       ARG  32  -0.447 -12.205   1.790
  246   2HB   ARG  32          2HB       ARG  32   0.650 -13.461   2.285
  247   1HG   ARG  32          1HG       ARG  32  -0.475 -15.063   1.093
  248   2HG   ARG  32          2HG       ARG  32  -2.047 -14.399   1.535
  249   1HD   ARG  32          1HD       ARG  32  -1.690 -14.125  -0.879
  250   2HD   ARG  32          2HD       ARG  32  -1.705 -12.536  -0.100
  251    HE   ARG  32           HE       ARG  32   0.843 -12.692  -0.181
  252   1HH1  ARG  32          1HH1      ARG  32   0.685 -15.563  -1.289
  253   2HH1  ARG  32          2HH1      ARG  32   1.046 -15.279  -2.959
  254   1HH2  ARG  32          1HH2      ARG  32   0.504 -11.859  -2.768
  255   2HH2  ARG  32          2HH2      ARG  32   0.943 -13.181  -3.796
  256    H    LYS  33           H        LYS  33   0.302 -11.224   4.082
  257    HA   LYS  33           HA       LYS  33   1.026 -11.635   6.782
  258   1HB   LYS  33          1HB       LYS  33   2.295 -13.568   5.494
  259   2HB   LYS  33          2HB       LYS  33   3.386 -12.266   5.023
  260   1HG   LYS  33          1HG       LYS  33   4.125 -13.406   7.113
  261   2HG   LYS  33          2HG       LYS  33   3.773 -11.698   7.371
  262   1HD   LYS  33          1HD       LYS  33   1.893 -12.133   8.625
  263   2HD   LYS  33          2HD       LYS  33   1.517 -13.611   7.737
  264   1HE   LYS  33          1HE       LYS  33   3.047 -14.893   8.972
  265   2HE   LYS  33          2HE       LYS  33   3.968 -13.477   9.480
  266   1HZ   LYS  33          1HZ       LYS  33   2.039 -12.785  10.806
  267   2HZ   LYS  33          2HZ       LYS  33   1.237 -14.220  10.377
  268   3HZ   LYS  33          3HZ       LYS  33   2.656 -14.287  11.304
  269    H    ASP  34           H        ASP  34   0.483  -9.336   6.489
  270    HA   ASP  34           HA       ASP  34   1.011  -7.087   5.964
  271   1HB   ASP  34          1HB       ASP  34   3.260  -8.224   7.157
  272   2HB   ASP  34          2HB       ASP  34   3.906  -7.608   5.633
  273    H    VAL  35           H        VAL  35   0.256  -8.795   3.874
  274    HA   VAL  35           HA       VAL  35   2.185  -8.408   1.708
  275    HB   VAL  35           HB       VAL  35  -0.428  -9.916   1.935
  276   1HG1  VAL  35          1HG1      VAL  35   2.435 -10.381   2.067
  277   2HG1  VAL  35          2HG1      VAL  35   1.121 -11.484   2.450
  278   3HG1  VAL  35          3HG1      VAL  35   1.719 -11.360   0.794
  279   1HG2  VAL  35          1HG2      VAL  35   0.788  -8.737  -0.469
  280   2HG2  VAL  35          2HG2      VAL  35   0.547 -10.490  -0.554
  281   3HG2  VAL  35          3HG2      VAL  35  -0.821  -9.425  -0.217
  282    H    TYR  36           H        TYR  36  -1.349  -7.511   1.959
  283    HA   TYR  36           HA       TYR  36  -1.325  -5.799  -0.233
  284   1HB   TYR  36          1HB       TYR  36  -2.691  -5.439   2.440
  285   2HB   TYR  36          2HB       TYR  36  -3.064  -4.532   0.994
  286    HD1  TYR  36           HD1      TYR  36  -4.502  -6.735   2.836
  287    HD2  TYR  36           HD2      TYR  36  -2.894  -6.604  -1.119
  288    HE1  TYR  36           HE1      TYR  36  -6.023  -8.557   2.167
  289    HE2  TYR  36           HE2      TYR  36  -4.418  -8.428  -1.805
  290    HH   TYR  36           HH       TYR  36  -5.680 -10.454  -0.230
  291    H    VAL  37           H        VAL  37   0.232  -5.478   2.843
  292    HA   VAL  37           HA       VAL  37   0.704  -2.627   2.591
  293    HB   VAL  37           HB       VAL  37   1.744  -4.806   4.414
  294   1HG1  VAL  37          1HG1      VAL  37  -0.579  -3.752   4.675
  295   2HG1  VAL  37          2HG1      VAL  37   0.481  -3.626   6.087
  296   3HG1  VAL  37          3HG1      VAL  37   0.259  -2.236   5.032
  297   1HG2  VAL  37          1HG2      VAL  37   2.713  -1.975   4.044
  298   2HG2  VAL  37          2HG2      VAL  37   2.776  -2.734   5.635
  299   3HG2  VAL  37          3HG2      VAL  37   3.658  -3.445   4.283
  300    H    GLN  38           H        GLN  38   2.943  -5.447   2.571
  301    HA   GLN  38           HA       GLN  38   5.131  -4.097   1.373
  302   1HB   GLN  38          1HB       GLN  38   4.376  -6.836   1.908
  303   2HB   GLN  38          2HB       GLN  38   5.046  -6.727   0.284
  304   1HG   GLN  38          1HG       GLN  38   6.704  -7.137   2.214
  305   2HG   GLN  38          2HG       GLN  38   7.111  -5.860   1.073
  306   2HE2  GLN  38          2HE2      GLN  38   6.013  -6.505   4.372
  307   1HE2  GLN  38          1HE2      GLN  38   6.228  -4.918   4.938
  308    H    LEU  39           H        LEU  39   2.825  -6.242  -0.273
  309    HA   LEU  39           HA       LEU  39   3.209  -5.877  -2.932
  310   1HB   LEU  39          1HB       LEU  39   0.754  -6.092  -1.294
  311   2HB   LEU  39          2HB       LEU  39   0.477  -5.358  -2.875
  312    HG   LEU  39           HG       LEU  39   2.048  -7.919  -2.578
  313   1HD1  LEU  39          1HD1      LEU  39  -0.571  -7.683  -1.788
  314   2HD1  LEU  39          2HD1      LEU  39  -0.754  -8.059  -3.500
  315   3HD1  LEU  39          3HD1      LEU  39   0.136  -9.160  -2.449
  316   1HD2  LEU  39          1HD2      LEU  39   0.960  -6.207  -4.739
  317   2HD2  LEU  39          2HD2      LEU  39   2.361  -7.283  -4.751
  318   3HD2  LEU  39          3HD2      LEU  39   0.740  -7.944  -4.965
  319    H    TYR  40           H        TYR  40   1.447  -3.477  -0.943
  320    HA   TYR  40           HA       TYR  40   1.024  -1.514  -2.854
  321   1HB   TYR  40          1HB       TYR  40   0.139  -0.598  -0.999
  322   2HB   TYR  40          2HB       TYR  40   0.985  -1.777  -0.007
  323    HD1  TYR  40           HD1      TYR  40   2.360  -0.927   1.662
  324    HD2  TYR  40           HD2      TYR  40   1.888   1.313  -1.969
  325    HE1  TYR  40           HE1      TYR  40   3.852   0.835   2.553
  326    HE2  TYR  40           HE2      TYR  40   3.353   3.091  -1.056
  327    HH   TYR  40           HH       TYR  40   4.687   2.862   2.231
  328    H    LEU  41           H        LEU  41   3.881  -1.633  -0.650
  329    HA   LEU  41           HA       LEU  41   5.203   0.508  -1.972
  330   1HB   LEU  41          1HB       LEU  41   5.672  -0.918   0.295
  331   2HB   LEU  41          2HB       LEU  41   6.914  -1.592  -0.754
  332    HG   LEU  41           HG       LEU  41   7.474   0.894  -1.316
  333   1HD1  LEU  41          1HD1      LEU  41   8.128  -0.733   1.080
  334   2HD1  LEU  41          2HD1      LEU  41   9.192  -0.085  -0.168
  335   3HD1  LEU  41          3HD1      LEU  41   8.616   0.960   1.130
  336   1HD2  LEU  41          1HD2      LEU  41   5.733   1.146   1.158
  337   2HD2  LEU  41          2HD2      LEU  41   7.006   2.315   0.807
  338   3HD2  LEU  41          3HD2      LEU  41   5.677   2.101  -0.328
  339    H    GLN  42           H        GLN  42   4.838  -2.807  -2.924
  340    HA   GLN  42           HA       GLN  42   7.229  -2.948  -4.558
  341   1HB   GLN  42          1HB       GLN  42   5.593  -4.829  -3.613
  342   2HB   GLN  42          2HB       GLN  42   4.874  -4.648  -5.210
  343   1HG   GLN  42          1HG       GLN  42   7.731  -5.378  -4.535
  344   2HG   GLN  42          2HG       GLN  42   6.555  -6.332  -5.438
  345   2HE2  GLN  42          2HE2      GLN  42   5.801  -5.295  -7.576
  346   1HE2  GLN  42          1HE2      GLN  42   6.935  -4.381  -8.447
  347    H    HIS  43           H        HIS  43   3.786  -2.820  -5.594
  348    HA   HIS  43           HA       HIS  43   4.614  -1.958  -8.285
  349   1HB   HIS  43          1HB       HIS  43   1.774  -1.928  -7.308
  350   2HB   HIS  43          2HB       HIS  43   2.397  -2.345  -8.916
  351    HD1  HIS  43           HD1      HIS  43   3.199  -4.769  -9.286
  352    HD2  HIS  43           HD2      HIS  43   1.993  -3.971  -5.382
  353    HE1  HIS  43           HE1      HIS  43   3.082  -7.011  -8.110
  354    H    LEU  44           H        LEU  44   3.107  -0.620  -5.428
  355    HA   LEU  44           HA       LEU  44   2.612   1.936  -6.799
  356   1HB   LEU  44          1HB       LEU  44   2.202   1.203  -3.888
  357   2HB   LEU  44          2HB       LEU  44   1.612   2.646  -4.688
  358    HG   LEU  44           HG       LEU  44   0.418  -0.074  -4.624
  359   1HD1  LEU  44          1HD1      LEU  44  -0.341   2.461  -4.187
  360   2HD1  LEU  44          2HD1      LEU  44  -0.918   2.282  -5.835
  361   3HD1  LEU  44          3HD1      LEU  44  -1.478   1.176  -4.581
  362   1HD2  LEU  44          1HD2      LEU  44   1.088   1.202  -7.265
  363   2HD2  LEU  44          2HD2      LEU  44   0.743  -0.485  -6.899
  364   3HD2  LEU  44          3HD2      LEU  44  -0.571   0.677  -7.041
  365    H    THR  45           H        THR  45   5.110   0.470  -4.882
  366    HA   THR  45           HA       THR  45   7.063   1.413  -3.943
  367    HB   THR  45           HB       THR  45   7.623   3.465  -5.723
  368    HG1  THR  45           HG1      THR  45   6.486   1.444  -7.276
  369   1HG2  THR  45          1HG2      THR  45   8.091   0.478  -5.807
  370   2HG2  THR  45          2HG2      THR  45   8.859   1.587  -6.946
  371   3HG2  THR  45          3HG2      THR  45   9.195   1.723  -5.219
  372    H    ALA  46           H        ALA  46   4.428   2.767  -3.188
  373    HA   ALA  46           HA       ALA  46   3.734   4.737  -2.148
  374   1HB   ALA  46          1HB       ALA  46   5.251   4.030  -0.405
  375   2HB   ALA  46          2HB       ALA  46   5.509   5.757  -0.656
  376   3HB   ALA  46          3HB       ALA  46   6.650   4.588  -1.322
  377    H    ARG  47           H        ARG  47   4.001   5.189  -4.675
  378    HA   ARG  47           HA       ARG  47   5.421   6.682  -6.228
  379   1HB   ARG  47          1HB       ARG  47   3.254   8.435  -5.918
  380   2HB   ARG  47          2HB       ARG  47   3.338   7.094  -7.024
  381   1HG   ARG  47          1HG       ARG  47   2.651   6.516  -4.167
  382   2HG   ARG  47          2HG       ARG  47   1.440   7.346  -5.112
  383   1HD   ARG  47          1HD       ARG  47   1.987   4.589  -5.085
  384   2HD   ARG  47          2HD       ARG  47   0.873   5.409  -6.158
  385    HE   ARG  47           HE       ARG  47   3.726   5.294  -6.936
  386   1HH1  ARG  47          1HH1      ARG  47   3.357   5.513  -9.324
  387   2HH1  ARG  47          2HH1      ARG  47   2.324   4.304 -10.011
  388   1HH2  ARG  47          1HH2      ARG  47   1.136   3.198  -6.947
  389   2HH2  ARG  47          2HH2      ARG  47   1.067   2.993  -8.665
  390    H    ASN  48           H        ASN  48   3.630   8.950  -4.170
  391    HA   ASN  48           HA       ASN  48   6.033  10.685  -4.115
  392   1HB   ASN  48          1HB       ASN  48   3.883  11.808  -2.563
  393   2HB   ASN  48          2HB       ASN  48   4.518  12.360  -4.114
  394   2HD2  ASN  48          2HD2      ASN  48   3.805  10.706  -6.001
  395   1HD2  ASN  48          1HD2      ASN  48   2.164  10.339  -5.971
  396    H    ARG  49           H        ARG  49   7.278   9.272  -2.654
  397    HA   ARG  49           HA       ARG  49   6.630   8.362  -0.121
  398   1HB   ARG  49          1HB       ARG  49   9.142   9.872  -0.865
  399   2HB   ARG  49          2HB       ARG  49   8.927   8.960   0.621
  400   1HG   ARG  49          1HG       ARG  49   8.612   6.886  -0.632
  401   2HG   ARG  49          2HG       ARG  49   8.644   7.764  -2.160
  402   1HD   ARG  49          1HD       ARG  49  10.900   7.720  -2.215
  403   2HD   ARG  49          2HD       ARG  49  11.016   8.344  -0.569
  404    HE   ARG  49           HE       ARG  49  10.273   5.659  -0.294
  405   1HH1  ARG  49          1HH1      ARG  49  11.699   4.277  -2.009
  406   2HH1  ARG  49          2HH1      ARG  49  13.384   4.454  -1.651
  407   1HH2  ARG  49          1HH2      ARG  49  12.941   7.281   0.308
  408   2HH2  ARG  49          2HH2      ARG  49  14.087   6.156  -0.339
  409    HA   PRO  50           HA       PRO  50   5.745  11.967   2.176
  410   1HB   PRO  50          1HB       PRO  50   6.111  10.988   4.720
  411   2HB   PRO  50          2HB       PRO  50   4.688  10.624   3.729
  412   1HG   PRO  50          1HG       PRO  50   7.024   8.887   4.387
  413   2HG   PRO  50          2HG       PRO  50   5.376   8.423   3.941
  414   1HD   PRO  50          1HD       PRO  50   7.657   8.406   2.236
  415   2HD   PRO  50          2HD       PRO  50   5.964   8.188   1.743
  416    HA   PRO  51           HA       PRO  51   9.985  13.333   2.809
  417   1HB   PRO  51          1HB       PRO  51   9.432  15.994   2.414
  418   2HB   PRO  51          2HB       PRO  51   9.714  14.844   1.097
  419   1HG   PRO  51          1HG       PRO  51   7.151  16.051   2.028
  420   2HG   PRO  51          2HG       PRO  51   7.574  15.416   0.431
  421   1HD   PRO  51          1HD       PRO  51   6.036  14.095   2.426
  422   2HD   PRO  51          2HD       PRO  51   6.663  13.369   0.934
  423    H    LEU  52           H        LEU  52   9.750  12.764   5.133
  424    HA   LEU  52           HA       LEU  52   9.565  15.186   6.799
  425   1HB   LEU  52          1HB       LEU  52   8.094  13.597   8.406
  426   2HB   LEU  52          2HB       LEU  52   7.360  14.699   7.243
  427    HG   LEU  52           HG       LEU  52   7.302  12.852   5.570
  428   1HD1  LEU  52          1HD1      LEU  52   8.370  11.260   7.926
  429   2HD1  LEU  52          2HD1      LEU  52   7.676  10.520   6.482
  430   3HD1  LEU  52          3HD1      LEU  52   9.147  11.486   6.359
  431   1HD2  LEU  52          1HD2      LEU  52   5.990  12.238   8.243
  432   2HD2  LEU  52          2HD2      LEU  52   5.331  13.282   6.984
  433   3HD2  LEU  52          3HD2      LEU  52   5.501  11.549   6.695
  434    HA   PRO  53           HA       PRO  53  12.697  13.052   9.011
  435   1HB   PRO  53          1HB       PRO  53  12.459  14.316  11.443
  436   2HB   PRO  53          2HB       PRO  53  13.187  15.070  10.014
  437   1HG   PRO  53          1HG       PRO  53  10.508  15.552  11.247
  438   2HG   PRO  53          2HG       PRO  53  11.512  16.650  10.290
  439   1HD   PRO  53          1HD       PRO  53   9.253  15.216   9.353
  440   2HD   PRO  53          2HD       PRO  53  10.452  16.050   8.344
  441    H    ALA  54           H        ALA  54  12.687  12.508  11.800
  442    HA   ALA  54           HA       ALA  54  10.359  11.221  12.771
  443   1HB   ALA  54          1HB       ALA  54  11.537   9.907  10.544
  444   2HB   ALA  54          2HB       ALA  54  11.876   8.918  11.969
  445   3HB   ALA  54          3HB       ALA  54  10.209   9.330  11.560
  446    H    GLY  55           H        GLY  55  11.173   9.217  14.274
  447   1HA   GLY  55          1HA       GLY  55  12.422   9.884  16.478
  448   2HA   GLY  55          2HA       GLY  55  13.833   9.933  15.419
  449    H    THR  56           H        THR  56  12.271   7.603  13.952
  450    HA   THR  56           HA       THR  56  12.975   5.450  15.893
  451    HB   THR  56           HB       THR  56  10.741   5.151  15.127
  452    HG1  THR  56           HG1      THR  56  12.408   3.610  13.427
  453   1HG2  THR  56          1HG2      THR  56  11.848   5.722  12.363
  454   2HG2  THR  56          2HG2      THR  56  10.200   5.179  12.676
  455   3HG2  THR  56          3HG2      THR  56  10.745   6.740  13.289

  No H/Q in entry =         455
  Start of MODEL    4
    1    H2   PRO   1           H2       PRO   1  -3.582  11.675  -8.089
    2    H3   PRO   1           H3       PRO   1  -4.898  11.705  -9.165
    3    HA   PRO   1           HA       PRO   1  -5.786   9.972  -8.119
    4   1HB   PRO   1          1HB       PRO   1  -3.678   8.030  -8.207
    5   2HB   PRO   1          2HB       PRO   1  -5.101   8.134  -9.244
    6   1HG   PRO   1          1HG       PRO   1  -2.420   8.637  -9.958
    7   2HG   PRO   1          2HG       PRO   1  -3.861   8.867 -10.956
    8   1HD   PRO   1          1HD       PRO   1  -2.207  10.934  -9.637
    9   2HD   PRO   1          2HD       PRO   1  -3.516  11.177 -10.803
   10    H    GLU   2           H        GLU   2  -2.312   9.896  -7.223
   11    HA   GLU   2           HA       GLU   2  -1.304   9.829  -5.104
   12   1HB   GLU   2          1HB       GLU   2  -2.817  11.878  -4.839
   13   2HB   GLU   2          2HB       GLU   2  -3.960  10.807  -4.030
   14   1HG   GLU   2          1HG       GLU   2  -2.799  11.108  -2.123
   15   2HG   GLU   2          2HG       GLU   2  -1.442  10.267  -2.872
   16    H    PHE   3           H        PHE   3  -0.995   8.140  -3.723
   17    HA   PHE   3           HA       PHE   3  -3.326   6.475  -2.930
   18   1HB   PHE   3          1HB       PHE   3  -2.672   5.043  -4.635
   19   2HB   PHE   3          2HB       PHE   3  -1.047   5.724  -4.692
   20    HD1  PHE   3           HD1      PHE   3   0.530   5.223  -2.836
   21    HD2  PHE   3           HD2      PHE   3  -2.989   2.929  -3.626
   22    HE1  PHE   3           HE1      PHE   3   1.503   3.304  -1.657
   23    HE2  PHE   3           HE2      PHE   3  -2.017   1.025  -2.429
   24    HZ   PHE   3           HZ       PHE   3   0.206   1.165  -1.491
   25    H    LEU   4           H        LEU   4  -2.686   4.994  -1.114
   26    HA   LEU   4           HA       LEU   4  -1.492   6.399   1.016
   27   1HB   LEU   4          1HB       LEU   4  -1.062   4.050   2.000
   28   2HB   LEU   4          2HB       LEU   4  -2.725   4.451   1.620
   29    HG   LEU   4           HG       LEU   4  -1.558   3.443  -0.750
   30   1HD1  LEU   4          1HD1      LEU   4  -0.747   2.099   1.780
   31   2HD1  LEU   4          2HD1      LEU   4  -1.095   1.098   0.376
   32   3HD1  LEU   4          3HD1      LEU   4   0.176   2.316   0.307
   33   1HD2  LEU   4          1HD2      LEU   4  -3.467   2.231   1.264
   34   2HD2  LEU   4          2HD2      LEU   4  -3.912   3.239  -0.112
   35   3HD2  LEU   4          3HD2      LEU   4  -3.228   1.634  -0.377
   36    H    GLU   5           H        GLU   5   0.474   7.355   0.281
   37    HA   GLU   5           HA       GLU   5   2.637   5.754  -0.792
   38   1HB   GLU   5          1HB       GLU   5   2.663   8.510   0.484
   39   2HB   GLU   5          2HB       GLU   5   4.009   7.791  -0.399
   40   1HG   GLU   5          1HG       GLU   5   2.674   7.714  -2.458
   41   2HG   GLU   5          2HG       GLU   5   1.254   8.286  -1.597
   42    H    ASP   6           H        ASP   6   1.263   5.942   2.233
   43    HA   ASP   6           HA       ASP   6   3.366   4.366   3.466
   44   1HB   ASP   6          1HB       ASP   6   2.995   7.261   4.144
   45   2HB   ASP   6          2HB       ASP   6   3.307   6.135   5.465
   46    HA   PRO   7           HA       PRO   7  -0.896   3.538   4.817
   47   1HB   PRO   7          1HB       PRO   7  -0.596   0.804   4.747
   48   2HB   PRO   7          2HB       PRO   7  -1.118   1.778   3.371
   49   1HG   PRO   7          1HG       PRO   7   1.510   0.471   3.883
   50   2HG   PRO   7          2HG       PRO   7   0.788   0.959   2.346
   51   1HD   PRO   7          1HD       PRO   7   2.858   2.335   3.752
   52   2HD   PRO   7          2HD       PRO   7   1.957   2.948   2.353
   53    H    SER   8           H        SER   8   0.668   4.362   6.851
   54    HA   SER   8           HA       SER   8   0.972   2.038   8.691
   55   1HB   SER   8          1HB       SER   8   2.410   3.411  10.013
   56   2HB   SER   8          2HB       SER   8   2.867   3.736   8.341
   57    HG   SER   8           HG       SER   8   1.049   5.439   8.691
   58    H    VAL   9           H        VAL   9  -1.361   4.205   7.829
   59    HA   VAL   9           HA       VAL   9  -2.415   4.401  10.588
   60    HB   VAL   9           HB       VAL   9  -2.182   6.302   8.363
   61   1HG1  VAL   9          1HG1      VAL   9  -4.593   5.857   8.296
   62   2HG1  VAL   9          2HG1      VAL   9  -4.707   6.241  10.015
   63   3HG1  VAL   9          3HG1      VAL   9  -4.243   7.493   8.859
   64   1HG2  VAL   9          1HG2      VAL   9  -1.065   6.480  10.540
   65   2HG2  VAL   9          2HG2      VAL   9  -2.094   7.873  10.205
   66   3HG2  VAL   9          3HG2      VAL   9  -2.639   6.622  11.324
   67    H    LEU  10           H        LEU  10  -2.874   2.753   7.680
   68    HA   LEU  10           HA       LEU  10  -5.825   2.655   8.091
   69   1HB   LEU  10          1HB       LEU  10  -5.477   1.194   5.806
   70   2HB   LEU  10          2HB       LEU  10  -5.770   2.931   5.814
   71    HG   LEU  10           HG       LEU  10  -2.992   1.728   5.850
   72   1HD1  LEU  10          1HD1      LEU  10  -4.200   1.188   3.750
   73   2HD1  LEU  10          2HD1      LEU  10  -4.556   2.897   3.551
   74   3HD1  LEU  10          3HD1      LEU  10  -2.894   2.338   3.471
   75   1HD2  LEU  10          1HD2      LEU  10  -4.063   4.376   6.247
   76   2HD2  LEU  10          2HD2      LEU  10  -2.375   3.866   6.277
   77   3HD2  LEU  10          3HD2      LEU  10  -3.123   4.349   4.755
   78    H    THR  11           H        THR  11  -3.767   0.077   6.779
   79    HA   THR  11           HA       THR  11  -3.510  -1.713   8.840
   80    HB   THR  11           HB       THR  11  -5.786  -1.479   9.491
   81    HG1  THR  11           HG1      THR  11  -6.198  -3.609   7.777
   82   1HG2  THR  11          1HG2      THR  11  -6.188  -1.315   6.542
   83   2HG2  THR  11          2HG2      THR  11  -7.537  -1.903   7.521
   84   3HG2  THR  11          3HG2      THR  11  -6.875  -0.285   7.812
   85    H    LYS  12           H        LYS  12  -4.133  -4.113   7.924
   86    HA   LYS  12           HA       LYS  12  -3.073  -4.101   5.176
   87   1HB   LYS  12          1HB       LYS  12  -3.112  -6.027   7.375
   88   2HB   LYS  12          2HB       LYS  12  -3.689  -6.772   5.884
   89   1HG   LYS  12          1HG       LYS  12  -1.497  -7.060   5.374
   90   2HG   LYS  12          2HG       LYS  12  -1.460  -5.329   5.032
   91   1HD   LYS  12          1HD       LYS  12   0.318  -5.833   6.610
   92   2HD   LYS  12          2HD       LYS  12  -0.932  -4.918   7.452
   93   1HE   LYS  12          1HE       LYS  12  -1.899  -7.243   8.092
   94   2HE   LYS  12          2HE       LYS  12  -0.312  -7.863   7.636
   95   1HZ   LYS  12          1HZ       LYS  12  -0.626  -5.598   9.509
   96   2HZ   LYS  12          2HZ       LYS  12  -0.646  -7.207  10.044
   97   3HZ   LYS  12          3HZ       LYS  12   0.733  -6.588   9.269
   98    H    ASP  13           H        ASP  13  -5.556  -2.946   5.278
   99    HA   ASP  13           HA       ASP  13  -7.190  -4.857   3.713
  100   1HB   ASP  13          1HB       ASP  13  -7.796  -4.534   6.375
  101   2HB   ASP  13          2HB       ASP  13  -8.746  -3.235   5.655
  102    H    LYS  14           H        LYS  14  -6.990  -1.471   4.988
  103    HA   LYS  14           HA       LYS  14  -8.642  -0.360   2.926
  104   1HB   LYS  14          1HB       LYS  14  -7.787   0.760   5.074
  105   2HB   LYS  14          2HB       LYS  14  -6.293   1.034   4.193
  106   1HG   LYS  14          1HG       LYS  14  -9.058   2.049   3.480
  107   2HG   LYS  14          2HG       LYS  14  -7.665   3.004   3.966
  108   1HD   LYS  14          1HD       LYS  14  -7.946   1.416   1.403
  109   2HD   LYS  14          2HD       LYS  14  -7.927   3.167   1.544
  110   1HE   LYS  14          1HE       LYS  14  -5.596   1.672   2.672
  111   2HE   LYS  14          2HE       LYS  14  -5.718   1.809   0.919
  112   1HZ   LYS  14          1HZ       LYS  14  -5.977   4.212   1.145
  113   2HZ   LYS  14          2HZ       LYS  14  -5.799   4.082   2.827
  114   3HZ   LYS  14          3HZ       LYS  14  -4.505   3.686   1.803
  115    H    LEU  15           H        LEU  15  -5.118  -0.380   3.306
  116    HA   LEU  15           HA       LEU  15  -4.271   0.586   0.888
  117   1HB   LEU  15          1HB       LEU  15  -2.594  -1.612   1.134
  118   2HB   LEU  15          2HB       LEU  15  -2.338  -0.025   1.871
  119    HG   LEU  15           HG       LEU  15  -3.454  -0.732   3.901
  120   1HD1  LEU  15          1HD1      LEU  15  -4.412  -2.837   2.151
  121   2HD1  LEU  15          2HD1      LEU  15  -3.738  -3.474   3.642
  122   3HD1  LEU  15          3HD1      LEU  15  -5.050  -2.281   3.709
  123   1HD2  LEU  15          1HD2      LEU  15  -1.031  -1.290   3.495
  124   2HD2  LEU  15          2HD2      LEU  15  -1.839  -2.336   4.665
  125   3HD2  LEU  15          3HD2      LEU  15  -1.558  -2.905   3.018
  126    H    LYS  16           H        LYS  16  -5.960  -2.370   1.432
  127    HA   LYS  16           HA       LYS  16  -5.415  -3.522  -1.185
  128   1HB   LYS  16          1HB       LYS  16  -6.788  -4.173   1.331
  129   2HB   LYS  16          2HB       LYS  16  -7.759  -4.611  -0.055
  130   1HG   LYS  16          1HG       LYS  16  -6.014  -5.994  -0.906
  131   2HG   LYS  16          2HG       LYS  16  -4.884  -5.418   0.288
  132   1HD   LYS  16          1HD       LYS  16  -7.474  -6.698   1.103
  133   2HD   LYS  16          2HD       LYS  16  -6.104  -7.705   0.659
  134   1HE   LYS  16          1HE       LYS  16  -6.638  -6.482   3.165
  135   2HE   LYS  16          2HE       LYS  16  -5.257  -7.455   2.721
  136   1HZ   LYS  16          1HZ       LYS  16  -4.497  -5.138   1.706
  137   2HZ   LYS  16          2HZ       LYS  16  -5.482  -4.568   2.943
  138   3HZ   LYS  16          3HZ       LYS  16  -4.173  -5.590   3.284
  139    H    SER  17           H        SER  17  -8.289  -2.205   0.466
  140    HA   SER  17           HA       SER  17 -10.126  -2.066  -1.584
  141   1HB   SER  17          1HB       SER  17 -10.701  -1.274   0.598
  142   2HB   SER  17          2HB       SER  17  -9.474  -0.026   0.513
  143    HG   SER  17           HG       SER  17 -11.551   0.797   0.047
  144    H    GLU  18           H        GLU  18  -7.260  -0.203  -1.128
  145    HA   GLU  18           HA       GLU  18  -7.854   1.668  -3.306
  146   1HB   GLU  18          1HB       GLU  18  -5.362   1.206  -1.681
  147   2HB   GLU  18          2HB       GLU  18  -5.595   2.562  -2.756
  148   1HG   GLU  18          1HG       GLU  18  -7.337   1.902  -0.347
  149   2HG   GLU  18          2HG       GLU  18  -6.066   3.118  -0.342
  150    H    LEU  19           H        LEU  19  -5.184  -0.696  -2.722
  151    HA   LEU  19           HA       LEU  19  -3.919  -0.753  -5.125
  152   1HB   LEU  19          1HB       LEU  19  -4.706  -3.033  -3.335
  153   2HB   LEU  19          2HB       LEU  19  -3.897  -3.362  -4.840
  154    HG   LEU  19           HG       LEU  19  -2.641  -1.186  -3.332
  155   1HD1  LEU  19          1HD1      LEU  19  -2.034  -2.870  -5.358
  156   2HD1  LEU  19          2HD1      LEU  19  -0.810  -2.083  -4.366
  157   3HD1  LEU  19          3HD1      LEU  19  -1.299  -3.748  -4.015
  158   1HD2  LEU  19          1HD2      LEU  19  -3.406  -3.666  -1.990
  159   2HD2  LEU  19          2HD2      LEU  19  -1.652  -3.475  -2.040
  160   3HD2  LEU  19          3HD2      LEU  19  -2.656  -2.223  -1.305
  161    H    VAL  20           H        VAL  20  -7.051  -2.353  -4.519
  162    HA   VAL  20           HA       VAL  20  -7.368  -3.499  -7.099
  163    HB   VAL  20           HB       VAL  20  -9.345  -2.485  -5.041
  164   1HG1  VAL  20          1HG1      VAL  20  -8.182  -5.113  -5.888
  165   2HG1  VAL  20          2HG1      VAL  20  -8.479  -4.491  -4.264
  166   3HG1  VAL  20          3HG1      VAL  20  -9.822  -5.090  -5.238
  167   1HG2  VAL  20          1HG2      VAL  20  -9.878  -3.711  -7.761
  168   2HG2  VAL  20          2HG2      VAL  20 -11.064  -3.727  -6.455
  169   3HG2  VAL  20          3HG2      VAL  20 -10.507  -2.192  -7.122
  170    H    ALA  21           H        ALA  21  -8.491  -0.354  -5.850
  171    HA   ALA  21           HA       ALA  21  -9.452   0.619  -8.378
  172   1HB   ALA  21          1HB       ALA  21  -9.531   2.793  -7.256
  173   2HB   ALA  21          2HB       ALA  21 -10.120   1.543  -6.159
  174   3HB   ALA  21          3HB       ALA  21  -8.486   2.186  -5.968
  175    H    ASN  22           H        ASN  22  -6.277   0.165  -7.208
  176    HA   ASN  22           HA       ASN  22  -5.247   2.201  -9.130
  177   1HB   ASN  22          1HB       ASN  22  -3.662   0.909  -6.895
  178   2HB   ASN  22          2HB       ASN  22  -3.282   2.401  -7.757
  179   2HD2  ASN  22          2HD2      ASN  22  -4.591   1.328  -4.841
  180   1HD2  ASN  22          1HD2      ASN  22  -5.599   2.638  -4.483
  181    H    ASN  23           H        ASN  23  -6.093  -0.046 -10.287
  182    HA   ASN  23           HA       ASN  23  -5.499  -1.920 -11.557
  183   1HB   ASN  23          1HB       ASN  23  -3.464  -1.539 -12.920
  184   2HB   ASN  23          2HB       ASN  23  -4.507  -0.121 -12.855
  185   2HD2  ASN  23          2HD2      ASN  23  -3.410   1.786 -12.398
  186   1HD2  ASN  23          1HD2      ASN  23  -1.944   1.890 -11.544
  187    H    VAL  24           H        VAL  24  -5.233  -2.945  -9.171
  188    HA   VAL  24           HA       VAL  24  -2.765  -4.550  -9.393
  189    HB   VAL  24           HB       VAL  24  -3.543  -3.259  -6.753
  190   1HG1  VAL  24          1HG1      VAL  24  -1.681  -5.384  -7.633
  191   2HG1  VAL  24          2HG1      VAL  24  -0.957  -4.177  -6.574
  192   3HG1  VAL  24          3HG1      VAL  24  -2.370  -5.089  -6.038
  193   1HG2  VAL  24          1HG2      VAL  24  -1.628  -2.470  -8.918
  194   2HG2  VAL  24          2HG2      VAL  24  -2.556  -1.452  -7.818
  195   3HG2  VAL  24          3HG2      VAL  24  -1.101  -2.269  -7.248
  196    H    THR  25           H        THR  25  -3.814  -6.499  -9.691
  197    HA   THR  25           HA       THR  25  -6.362  -7.148  -8.646
  198    HB   THR  25           HB       THR  25  -4.975  -9.551  -8.846
  199    HG1  THR  25           HG1      THR  25  -3.392  -9.244 -10.166
  200   1HG2  THR  25          1HG2      THR  25  -6.721  -7.932 -10.668
  201   2HG2  THR  25          2HG2      THR  25  -6.060  -9.471 -11.219
  202   3HG2  THR  25          3HG2      THR  25  -7.105  -9.418  -9.798
  203    H    LEU  26           H        LEU  26  -6.827  -8.772  -6.974
  204    HA   LEU  26           HA       LEU  26  -4.913  -8.552  -4.690
  205   1HB   LEU  26          1HB       LEU  26  -7.907  -8.978  -4.615
  206   2HB   LEU  26          2HB       LEU  26  -6.877  -8.788  -3.218
  207    HG   LEU  26           HG       LEU  26  -8.223  -6.815  -4.644
  208   1HD1  LEU  26          1HD1      LEU  26  -5.276  -6.696  -5.104
  209   2HD1  LEU  26          2HD1      LEU  26  -6.588  -6.380  -6.235
  210   3HD1  LEU  26          3HD1      LEU  26  -6.220  -5.218  -4.962
  211   1HD2  LEU  26          1HD2      LEU  26  -6.912  -7.157  -2.174
  212   2HD2  LEU  26          2HD2      LEU  26  -6.332  -5.641  -2.873
  213   3HD2  LEU  26          3HD2      LEU  26  -8.060  -5.901  -2.627
  214    HA   PRO  27           HA       PRO  27  -4.820 -12.983  -5.506
  215   1HB   PRO  27          1HB       PRO  27  -2.547 -13.431  -4.011
  216   2HB   PRO  27          2HB       PRO  27  -2.515 -12.822  -5.674
  217   1HG   PRO  27          1HG       PRO  27  -2.055 -11.339  -3.130
  218   2HG   PRO  27          2HG       PRO  27  -1.405 -11.029  -4.748
  219   1HD   PRO  27          1HD       PRO  27  -3.539  -9.651  -3.541
  220   2HD   PRO  27          2HD       PRO  27  -3.134  -9.606  -5.262
  221    H    ALA  28           H        ALA  28  -3.253 -12.881  -2.379
  222    HA   ALA  28           HA       ALA  28  -4.848 -14.788  -1.134
  223   1HB   ALA  28          1HB       ALA  28  -3.061 -14.303   0.218
  224   2HB   ALA  28          2HB       ALA  28  -4.242 -13.264   1.016
  225   3HB   ALA  28          3HB       ALA  28  -3.113 -12.581  -0.157
  226    H    GLY  29           H        GLY  29  -6.335 -14.306   0.838
  227   1HA   GLY  29          1HA       GLY  29  -8.725 -13.726   1.001
  228   2HA   GLY  29          2HA       GLY  29  -8.406 -12.376  -0.097
  229    H    GLU  30           H        GLU  30  -8.285 -13.447   3.231
  230    HA   GLU  30           HA       GLU  30  -8.518 -10.879   4.337
  231   1HB   GLU  30          1HB       GLU  30  -8.845 -12.342   6.049
  232   2HB   GLU  30          2HB       GLU  30  -7.802 -13.562   5.332
  233   1HG   GLU  30          1HG       GLU  30  -5.870 -12.674   6.338
  234   2HG   GLU  30          2HG       GLU  30  -6.612 -11.093   6.585
  235    H    GLN  31           H        GLN  31  -5.448 -12.755   4.406
  236    HA   GLN  31           HA       GLN  31  -3.891 -10.844   3.112
  237   1HB   GLN  31          1HB       GLN  31  -4.283  -9.208   4.810
  238   2HB   GLN  31          2HB       GLN  31  -4.113 -10.400   6.091
  239   1HG   GLN  31          1HG       GLN  31  -1.721  -9.944   4.343
  240   2HG   GLN  31          2HG       GLN  31  -2.182  -8.688   5.474
  241   2HE2  GLN  31          2HE2      GLN  31  -1.900  -9.072   7.736
  242   1HE2  GLN  31          1HE2      GLN  31  -1.204 -10.493   8.350
  243    H    ARG  32           H        ARG  32  -2.123 -11.956   2.532
  244    HA   ARG  32           HA       ARG  32  -1.474 -14.520   3.492
  245   1HB   ARG  32          1HB       ARG  32  -0.392 -14.339   1.499
  246   2HB   ARG  32          2HB       ARG  32  -0.695 -12.623   1.480
  247   1HG   ARG  32          1HG       ARG  32   1.337 -12.110   2.502
  248   2HG   ARG  32          2HG       ARG  32   1.572 -13.751   3.098
  249   1HD   ARG  32          1HD       ARG  32   1.428 -13.202   0.136
  250   2HD   ARG  32          2HD       ARG  32   2.945 -12.992   1.011
  251    HE   ARG  32           HE       ARG  32   2.749 -15.415   1.656
  252   1HH1  ARG  32          1HH1      ARG  32   0.983 -17.102   1.168
  253   2HH1  ARG  32          2HH1      ARG  32   0.714 -17.332  -0.527
  254   1HH2  ARG  32          1HH2      ARG  32   2.364 -14.426  -1.452
  255   2HH2  ARG  32          2HH2      ARG  32   1.496 -15.816  -2.011
  256    H    LYS  33           H        LYS  33   0.272 -11.454   3.843
  257    HA   LYS  33           HA       LYS  33   0.768 -11.564   6.621
  258   1HB   LYS  33          1HB       LYS  33   2.528 -13.258   4.995
  259   2HB   LYS  33          2HB       LYS  33   3.421 -12.048   5.915
  260   1HG   LYS  33          1HG       LYS  33   1.256 -13.646   7.259
  261   2HG   LYS  33          2HG       LYS  33   2.855 -14.356   7.033
  262   1HD   LYS  33          1HD       LYS  33   3.905 -12.644   8.319
  263   2HD   LYS  33          2HD       LYS  33   2.466 -11.626   8.274
  264   1HE   LYS  33          1HE       LYS  33   1.277 -13.543   9.511
  265   2HE   LYS  33          2HE       LYS  33   2.890 -14.194   9.810
  266   1HZ   LYS  33          1HZ       LYS  33   3.257 -11.673  10.531
  267   2HZ   LYS  33          2HZ       LYS  33   1.608 -11.825  10.908
  268   3HZ   LYS  33          3HZ       LYS  33   2.744 -12.874  11.612
  269    H    ASP  34           H        ASP  34   0.212  -9.310   5.979
  270    HA   ASP  34           HA       ASP  34   0.840  -7.108   5.355
  271   1HB   ASP  34          1HB       ASP  34   3.158  -8.348   6.513
  272   2HB   ASP  34          2HB       ASP  34   3.693  -7.455   5.086
  273    H    VAL  35           H        VAL  35   0.218  -9.138   3.383
  274    HA   VAL  35           HA       VAL  35   2.126  -9.006   1.214
  275    HB   VAL  35           HB       VAL  35   0.409 -10.844   1.532
  276   1HG1  VAL  35          1HG1      VAL  35  -1.482  -9.324   2.028
  277   2HG1  VAL  35          2HG1      VAL  35  -1.386  -8.703   0.384
  278   3HG1  VAL  35          3HG1      VAL  35  -1.834 -10.381   0.658
  279   1HG2  VAL  35          1HG2      VAL  35   0.987  -9.301  -0.965
  280   2HG2  VAL  35          2HG2      VAL  35   1.357 -10.994  -0.562
  281   3HG2  VAL  35          3HG2      VAL  35  -0.275 -10.542  -1.047
  282    H    TYR  36           H        TYR  36  -0.874  -7.325   2.015
  283    HA   TYR  36           HA       TYR  36  -0.930  -5.864  -0.475
  284   1HB   TYR  36          1HB       TYR  36  -2.399  -5.550   2.133
  285   2HB   TYR  36          2HB       TYR  36  -2.812  -4.758   0.622
  286    HD1  TYR  36           HD1      TYR  36  -3.331  -6.224  -1.409
  287    HD2  TYR  36           HD2      TYR  36  -3.000  -7.747   2.586
  288    HE1  TYR  36           HE1      TYR  36  -4.552  -8.277  -2.092
  289    HE2  TYR  36           HE2      TYR  36  -4.222  -9.770   1.917
  290    HH   TYR  36           HH       TYR  36  -5.996 -10.045  -0.867
  291    H    VAL  37           H        VAL  37   0.341  -5.432   2.732
  292    HA   VAL  37           HA       VAL  37   0.737  -2.578   2.437
  293    HB   VAL  37           HB       VAL  37   1.936  -4.625   4.350
  294   1HG1  VAL  37          1HG1      VAL  37  -0.631  -3.910   4.270
  295   2HG1  VAL  37          2HG1      VAL  37   0.217  -4.065   5.813
  296   3HG1  VAL  37          3HG1      VAL  37  -0.020  -2.473   5.095
  297   1HG2  VAL  37          1HG2      VAL  37   2.818  -1.989   3.769
  298   2HG2  VAL  37          2HG2      VAL  37   1.949  -1.892   5.300
  299   3HG2  VAL  37          3HG2      VAL  37   3.308  -3.003   5.126
  300    H    GLN  38           H        GLN  38   2.902  -5.449   2.318
  301    HA   GLN  38           HA       GLN  38   5.165  -3.972   1.326
  302   1HB   GLN  38          1HB       GLN  38   4.929  -6.440   2.346
  303   2HB   GLN  38          2HB       GLN  38   4.731  -6.877   0.656
  304   1HG   GLN  38          1HG       GLN  38   6.911  -5.528   0.252
  305   2HG   GLN  38          2HG       GLN  38   7.124  -5.649   2.001
  306   2HE2  GLN  38          2HE2      GLN  38   5.648  -8.362   1.880
  307   1HE2  GLN  38          1HE2      GLN  38   6.839  -9.438   1.325
  308    H    LEU  39           H        LEU  39   2.669  -5.969  -0.192
  309    HA   LEU  39           HA       LEU  39   3.357  -5.895  -2.908
  310   1HB   LEU  39          1HB       LEU  39   0.721  -5.798  -1.492
  311   2HB   LEU  39          2HB       LEU  39   0.699  -5.375  -3.183
  312    HG   LEU  39           HG       LEU  39   2.045  -7.900  -2.309
  313   1HD1  LEU  39          1HD1      LEU  39  -0.872  -7.471  -3.062
  314   2HD1  LEU  39          2HD1      LEU  39  -0.096  -9.039  -2.850
  315   3HD1  LEU  39          3HD1      LEU  39  -0.294  -7.959  -1.470
  316   1HD2  LEU  39          1HD2      LEU  39   0.996  -6.596  -4.809
  317   2HD2  LEU  39          2HD2      LEU  39   2.557  -7.381  -4.538
  318   3HD2  LEU  39          3HD2      LEU  39   1.103  -8.362  -4.728
  319    H    TYR  40           H        TYR  40   1.430  -3.480  -1.190
  320    HA   TYR  40           HA       TYR  40   1.175  -1.505  -3.089
  321   1HB   TYR  40          1HB       TYR  40   0.127  -0.668  -1.282
  322   2HB   TYR  40          2HB       TYR  40   0.941  -1.825  -0.256
  323    HD1  TYR  40           HD1      TYR  40   2.011  -0.916   1.558
  324    HD2  TYR  40           HD2      TYR  40   2.017   1.286  -2.122
  325    HE1  TYR  40           HE1      TYR  40   3.401   0.840   2.608
  326    HE2  TYR  40           HE2      TYR  40   3.382   3.059  -1.056
  327    HH   TYR  40           HH       TYR  40   4.259   2.876   2.381
  328    H    LEU  41           H        LEU  41   3.866  -1.732  -0.732
  329    HA   LEU  41           HA       LEU  41   5.186   0.556  -1.847
  330   1HB   LEU  41          1HB       LEU  41   5.619  -0.799   0.480
  331   2HB   LEU  41          2HB       LEU  41   6.899  -1.485  -0.502
  332    HG   LEU  41           HG       LEU  41   7.372   1.055  -1.090
  333   1HD1  LEU  41          1HD1      LEU  41   8.130  -0.641   1.207
  334   2HD1  LEU  41          2HD1      LEU  41   9.151   0.201   0.041
  335   3HD1  LEU  41          3HD1      LEU  41   8.468   1.078   1.410
  336   1HD2  LEU  41          1HD2      LEU  41   5.537   1.156   1.322
  337   2HD2  LEU  41          2HD2      LEU  41   6.836   2.340   1.162
  338   3HD2  LEU  41          3HD2      LEU  41   5.593   2.229  -0.081
  339    H    GLN  42           H        GLN  42   5.027  -2.731  -2.857
  340    HA   GLN  42           HA       GLN  42   7.468  -2.709  -4.432
  341   1HB   GLN  42          1HB       GLN  42   5.747  -4.655  -3.563
  342   2HB   GLN  42          2HB       GLN  42   5.386  -4.579  -5.285
  343   1HG   GLN  42          1HG       GLN  42   7.218  -6.181  -4.806
  344   2HG   GLN  42          2HG       GLN  42   7.772  -4.841  -5.810
  345   2HE2  GLN  42          2HE2      GLN  42  10.007  -5.164  -4.972
  346   1HE2  GLN  42          1HE2      GLN  42  10.421  -4.645  -3.407
  347    H    HIS  43           H        HIS  43   4.040  -2.873  -5.508
  348    HA   HIS  43           HA       HIS  43   4.765  -1.974  -8.196
  349   1HB   HIS  43          1HB       HIS  43   1.950  -1.958  -7.171
  350   2HB   HIS  43          2HB       HIS  43   2.552  -2.449  -8.764
  351    HD1  HIS  43           HD1      HIS  43   3.537  -4.867  -8.961
  352    HD2  HIS  43           HD2      HIS  43   2.040  -3.905  -5.201
  353    HE1  HIS  43           HE1      HIS  43   3.398  -7.048  -7.681
  354    H    LEU  44           H        LEU  44   3.105  -0.621  -5.394
  355    HA   LEU  44           HA       LEU  44   2.680   1.914  -6.822
  356   1HB   LEU  44          1HB       LEU  44   2.037   1.126  -3.975
  357   2HB   LEU  44          2HB       LEU  44   1.542   2.614  -4.759
  358    HG   LEU  44           HG       LEU  44   0.266  -0.054  -4.863
  359   1HD1  LEU  44          1HD1      LEU  44  -0.416   2.635  -4.707
  360   2HD1  LEU  44          2HD1      LEU  44  -0.949   2.189  -6.318
  361   3HD1  LEU  44          3HD1      LEU  44  -1.543   1.299  -4.927
  362   1HD2  LEU  44          1HD2      LEU  44   1.233   1.172  -7.432
  363   2HD2  LEU  44          2HD2      LEU  44   0.867  -0.509  -7.059
  364   3HD2  LEU  44          3HD2      LEU  44  -0.434   0.634  -7.358
  365    H    THR  45           H        THR  45   5.144   0.532  -4.840
  366    HA   THR  45           HA       THR  45   6.999   1.538  -3.774
  367    HB   THR  45           HB       THR  45   7.478   3.641  -5.554
  368    HG1  THR  45           HG1      THR  45   6.684   3.015  -7.430
  369   1HG2  THR  45          1HG2      THR  45   8.243   0.711  -5.522
  370   2HG2  THR  45          2HG2      THR  45   8.985   1.881  -6.617
  371   3HG2  THR  45          3HG2      THR  45   9.172   2.064  -4.870
  372    H    ALA  46           H        ALA  46   4.272   2.929  -3.131
  373    HA   ALA  46           HA       ALA  46   3.612   4.933  -2.093
  374   1HB   ALA  46          1HB       ALA  46   4.974   4.376  -0.249
  375   2HB   ALA  46          2HB       ALA  46   5.594   5.960  -0.711
  376   3HB   ALA  46          3HB       ALA  46   6.462   4.499  -1.187
  377    H    ARG  47           H        ARG  47   3.792   5.403  -4.553
  378    HA   ARG  47           HA       ARG  47   5.136   6.708  -6.264
  379   1HB   ARG  47          1HB       ARG  47   3.307   8.777  -5.495
  380   2HB   ARG  47          2HB       ARG  47   3.147   7.653  -6.818
  381   1HG   ARG  47          1HG       ARG  47   2.551   6.737  -3.991
  382   2HG   ARG  47          2HG       ARG  47   1.349   7.684  -4.847
  383   1HD   ARG  47          1HD       ARG  47   2.623   5.170  -5.997
  384   2HD   ARG  47          2HD       ARG  47   1.132   5.146  -5.062
  385    HE   ARG  47           HE       ARG  47   0.605   7.021  -7.018
  386   1HH1  ARG  47          1HH1      ARG  47  -0.221   3.970  -6.746
  387   2HH1  ARG  47          2HH1      ARG  47   0.022   3.477  -8.389
  388   1HH2  ARG  47          1HH2      ARG  47   1.805   6.323  -9.256
  389   2HH2  ARG  47          2HH2      ARG  47   1.169   4.811  -9.810
  390    H    ASN  48           H        ASN  48   4.069   9.254  -3.987
  391    HA   ASN  48           HA       ASN  48   6.688  10.543  -4.416
  392   1HB   ASN  48          1HB       ASN  48   4.963  11.973  -2.547
  393   2HB   ASN  48          2HB       ASN  48   5.568  12.473  -4.128
  394   2HD2  ASN  48          2HD2      ASN  48   4.450  10.662  -5.856
  395   1HD2  ASN  48          1HD2      ASN  48   2.776  10.800  -5.797
  396    H    ARG  49           H        ARG  49   7.858   8.879  -3.202
  397    HA   ARG  49           HA       ARG  49   7.694   8.026  -0.612
  398   1HB   ARG  49          1HB       ARG  49  10.090   9.065  -2.089
  399   2HB   ARG  49          2HB       ARG  49  10.231   8.720  -0.380
  400   1HG   ARG  49          1HG       ARG  49   9.009   6.683  -2.252
  401   2HG   ARG  49          2HG       ARG  49  10.751   6.834  -2.100
  402   1HD   ARG  49          1HD       ARG  49  10.208   5.150  -0.566
  403   2HD   ARG  49          2HD       ARG  49  10.419   6.585   0.425
  404    HE   ARG  49           HE       ARG  49   7.653   6.206  -0.403
  405   1HH1  ARG  49          1HH1      ARG  49  10.080   4.843   1.607
  406   2HH1  ARG  49          2HH1      ARG  49   9.013   4.561   2.942
  407   1HH2  ARG  49          1HH2      ARG  49   6.276   6.040   1.411
  408   2HH2  ARG  49          2HH2      ARG  49   6.860   5.239   2.832
  409    HA   PRO  50           HA       PRO  50   7.796  11.440   2.084
  410   1HB   PRO  50          1HB       PRO  50   9.054  10.313   4.259
  411   2HB   PRO  50          2HB       PRO  50   7.364   9.998   3.833
  412   1HG   PRO  50          1HG       PRO  50   9.771   8.260   3.443
  413   2HG   PRO  50          2HG       PRO  50   8.080   7.792   3.676
  414   1HD   PRO  50          1HD       PRO  50   9.444   7.830   1.202
  415   2HD   PRO  50          2HD       PRO  50   7.682   7.759   1.414
  416    HA   PRO  51           HA       PRO  51  11.781  13.291   1.577
  417   1HB   PRO  51          1HB       PRO  51  11.413  15.453   3.243
  418   2HB   PRO  51          2HB       PRO  51  10.716  15.335   1.619
  419   1HG   PRO  51          1HG       PRO  51   9.386  14.993   4.279
  420   2HG   PRO  51          2HG       PRO  51   8.703  15.566   2.751
  421   1HD   PRO  51          1HD       PRO  51   8.371  12.980   3.819
  422   2HD   PRO  51          2HD       PRO  51   8.063  13.450   2.132
  423    H    LEU  52           H        LEU  52  13.138  11.723   2.649
  424    HA   LEU  52           HA       LEU  52  13.479  12.095   5.590
  425   1HB   LEU  52          1HB       LEU  52  13.877   9.815   3.708
  426   2HB   LEU  52          2HB       LEU  52  14.971   9.926   5.087
  427    HG   LEU  52           HG       LEU  52  12.929   8.570   5.581
  428   1HD1  LEU  52          1HD1      LEU  52  11.533  11.234   5.153
  429   2HD1  LEU  52          2HD1      LEU  52  11.356   9.802   4.139
  430   3HD1  LEU  52          3HD1      LEU  52  10.772   9.782   5.803
  431   1HD2  LEU  52          1HD2      LEU  52  14.184   9.937   7.324
  432   2HD2  LEU  52          2HD2      LEU  52  12.944  11.176   7.129
  433   3HD2  LEU  52          3HD2      LEU  52  12.505   9.576   7.728
  434    HA   PRO  53           HA       PRO  53  17.180  14.224   4.085
  435   1HB   PRO  53          1HB       PRO  53  17.448  15.766   6.335
  436   2HB   PRO  53          2HB       PRO  53  16.341  16.147   5.012
  437   1HG   PRO  53          1HG       PRO  53  15.700  15.054   7.695
  438   2HG   PRO  53          2HG       PRO  53  14.733  16.098   6.640
  439   1HD   PRO  53          1HD       PRO  53  14.434  13.330   6.935
  440   2HD   PRO  53          2HD       PRO  53  13.726  14.294   5.641
  441    H    ALA  54           H        ALA  54  16.808  11.716   6.102
  442    HA   ALA  54           HA       ALA  54  18.426  10.305   7.074
  443   1HB   ALA  54          1HB       ALA  54  19.867  12.042   5.346
  444   2HB   ALA  54          2HB       ALA  54  20.385  10.474   5.976
  445   3HB   ALA  54          3HB       ALA  54  20.770  11.951   6.862
  446    H    GLY  55           H        GLY  55  17.006  12.532   8.481
  447   1HA   GLY  55          1HA       GLY  55  18.484  14.003  10.301
  448   2HA   GLY  55          2HA       GLY  55  18.508  12.371  10.979
  449    H    THR  56           H        THR  56  17.257  13.965  12.650
  450    HA   THR  56           HA       THR  56  14.623  13.037  12.901
  451    HB   THR  56           HB       THR  56  14.276  14.996  14.429
  452    HG1  THR  56           HG1      THR  56  16.857  15.675  13.467
  453   1HG2  THR  56          1HG2      THR  56  16.950  13.583  14.679
  454   2HG2  THR  56          2HG2      THR  56  16.094  14.386  15.996
  455   3HG2  THR  56          3HG2      THR  56  15.399  12.954  15.235

  No H/Q in entry =         455
  Start of MODEL    5
    1    H2   PRO   1           H2       PRO   1  -1.323   9.142  -9.132
    2    H3   PRO   1           H3       PRO   1  -2.387  10.058 -10.091
    3    HA   PRO   1           HA       PRO   1  -3.809  10.166  -8.401
    4   1HB   PRO   1          1HB       PRO   1  -4.205   7.407  -7.727
    5   2HB   PRO   1          2HB       PRO   1  -5.258   8.452  -8.681
    6   1HG   PRO   1          1HG       PRO   1  -3.701   6.288  -9.600
    7   2HG   PRO   1          2HG       PRO   1  -4.659   7.414 -10.570
    8   1HD   PRO   1          1HD       PRO   1  -1.720   7.307 -10.275
    9   2HD   PRO   1          2HD       PRO   1  -2.659   8.302 -11.399
   10    H    GLU   2           H        GLU   2  -3.134  10.858  -6.430
   11    HA   GLU   2           HA       GLU   2  -0.857   9.881  -5.050
   12   1HB   GLU   2          1HB       GLU   2  -2.787  11.912  -4.658
   13   2HB   GLU   2          2HB       GLU   2  -2.799  10.934  -3.190
   14   1HG   GLU   2          1HG       GLU   2  -0.369  11.173  -2.981
   15   2HG   GLU   2          2HG       GLU   2  -0.310  12.085  -4.489
   16    H    PHE   3           H        PHE   3  -0.563   8.165  -3.706
   17    HA   PHE   3           HA       PHE   3  -2.965   6.766  -2.636
   18   1HB   PHE   3          1HB       PHE   3  -2.510   5.259  -4.353
   19   2HB   PHE   3          2HB       PHE   3  -0.822   5.758  -4.453
   20    HD1  PHE   3           HD1      PHE   3  -3.032   3.199  -3.249
   21    HD2  PHE   3           HD2      PHE   3   0.728   5.141  -2.639
   22    HE1  PHE   3           HE1      PHE   3  -2.215   1.219  -2.068
   23    HE2  PHE   3           HE2      PHE   3   1.562   3.163  -1.511
   24    HZ   PHE   3           HZ       PHE   3   0.099   1.145  -1.238
   25    H    LEU   4           H        LEU   4  -2.228   5.207  -0.872
   26    HA   LEU   4           HA       LEU   4  -0.855   6.665   1.142
   27   1HB   LEU   4          1HB       LEU   4  -0.754   4.455   2.361
   28   2HB   LEU   4          2HB       LEU   4  -2.354   4.850   1.732
   29    HG   LEU   4           HG       LEU   4  -1.152   3.584  -0.388
   30   1HD1  LEU   4          1HD1      LEU   4  -3.444   3.360   0.551
   31   2HD1  LEU   4          2HD1      LEU   4  -2.711   1.811   0.125
   32   3HD1  LEU   4          3HD1      LEU   4  -2.760   2.332   1.811
   33   1HD2  LEU   4          1HD2      LEU   4   0.159   2.784   2.084
   34   2HD2  LEU   4          2HD2      LEU   4  -0.663   1.417   1.333
   35   3HD2  LEU   4          3HD2      LEU   4   0.556   2.316   0.431
   36    H    GLU   5           H        GLU   5   1.240   7.353   0.479
   37    HA   GLU   5           HA       GLU   5   3.155   5.421  -0.564
   38   1HB   GLU   5          1HB       GLU   5   3.659   8.136   0.701
   39   2HB   GLU   5          2HB       GLU   5   4.804   7.216  -0.274
   40   1HG   GLU   5          1HG       GLU   5   3.929   8.636  -1.895
   41   2HG   GLU   5          2HG       GLU   5   2.810   7.275  -2.064
   42    H    ASP   6           H        ASP   6   1.723   5.860   2.396
   43    HA   ASP   6           HA       ASP   6   3.552   4.033   3.736
   44   1HB   ASP   6          1HB       ASP   6   3.628   6.927   4.263
   45   2HB   ASP   6          2HB       ASP   6   3.292   5.973   5.708
   46    HA   PRO   7           HA       PRO   7  -0.870   3.551   4.729
   47   1HB   PRO   7          1HB       PRO   7  -0.769   0.807   4.711
   48   2HB   PRO   7          2HB       PRO   7  -1.041   1.785   3.258
   49   1HG   PRO   7          1HG       PRO   7   1.422   0.338   4.142
   50   2HG   PRO   7          2HG       PRO   7   0.884   0.752   2.512
   51   1HD   PRO   7          1HD       PRO   7   2.885   2.110   3.983
   52   2HD   PRO   7          2HD       PRO   7   2.085   2.724   2.521
   53    H    SER   8           H        SER   8   0.576   4.312   6.888
   54    HA   SER   8           HA       SER   8   0.618   2.007   8.772
   55   1HB   SER   8          1HB       SER   8   1.949   4.691   8.706
   56   2HB   SER   8          2HB       SER   8   1.656   3.933  10.271
   57    HG   SER   8           HG       SER   8   2.602   1.996   9.039
   58    H    VAL   9           H        VAL   9  -1.566   4.267   7.765
   59    HA   VAL   9           HA       VAL   9  -2.721   4.600  10.473
   60    HB   VAL   9           HB       VAL   9  -2.415   6.358   8.146
   61   1HG1  VAL   9          1HG1      VAL   9  -4.812   5.893   7.966
   62   2HG1  VAL   9          2HG1      VAL   9  -5.029   6.356   9.654
   63   3HG1  VAL   9          3HG1      VAL   9  -4.512   7.558   8.468
   64   1HG2  VAL   9          1HG2      VAL   9  -1.416   6.698  10.356
   65   2HG2  VAL   9          2HG2      VAL   9  -2.458   8.044   9.892
   66   3HG2  VAL   9          3HG2      VAL   9  -3.028   6.847  11.056
   67    H    LEU  10           H        LEU  10  -3.110   2.907   7.559
   68    HA   LEU  10           HA       LEU  10  -6.057   2.685   7.944
   69   1HB   LEU  10          1HB       LEU  10  -5.419   1.174   5.656
   70   2HB   LEU  10          2HB       LEU  10  -6.086   2.807   5.670
   71    HG   LEU  10           HG       LEU  10  -3.099   2.235   5.821
   72   1HD1  LEU  10          1HD1      LEU  10  -4.331   1.597   3.616
   73   2HD1  LEU  10          2HD1      LEU  10  -4.479   3.339   3.388
   74   3HD1  LEU  10          3HD1      LEU  10  -2.892   2.600   3.521
   75   1HD2  LEU  10          1HD2      LEU  10  -4.557   4.518   6.440
   76   2HD2  LEU  10          2HD2      LEU  10  -2.838   4.472   6.046
   77   3HD2  LEU  10          3HD2      LEU  10  -4.023   4.811   4.784
   78    H    THR  11           H        THR  11  -3.823   0.204   6.727
   79    HA   THR  11           HA       THR  11  -3.575  -1.562   8.803
   80    HB   THR  11           HB       THR  11  -5.875  -1.493   9.346
   81    HG1  THR  11           HG1      THR  11  -6.718  -3.516   8.383
   82   1HG2  THR  11          1HG2      THR  11  -6.144  -1.144   6.423
   83   2HG2  THR  11          2HG2      THR  11  -7.487  -1.968   7.224
   84   3HG2  THR  11          3HG2      THR  11  -7.026  -0.328   7.721
   85    H    LYS  12           H        LYS  12  -4.059  -4.002   7.789
   86    HA   LYS  12           HA       LYS  12  -2.693  -3.907   5.179
   87   1HB   LYS  12          1HB       LYS  12  -2.854  -5.776   7.370
   88   2HB   LYS  12          2HB       LYS  12  -3.374  -6.585   5.896
   89   1HG   LYS  12          1HG       LYS  12  -1.142  -6.911   5.557
   90   2HG   LYS  12          2HG       LYS  12  -1.134  -5.229   5.024
   91   1HD   LYS  12          1HD       LYS  12   0.584  -5.446   6.707
   92   2HD   LYS  12          2HD       LYS  12  -0.760  -4.568   7.441
   93   1HE   LYS  12          1HE       LYS  12  -1.600  -6.781   8.335
   94   2HE   LYS  12          2HE       LYS  12  -0.093  -7.508   7.779
   95   1HZ   LYS  12          1HZ       LYS  12   0.676  -5.269   9.151
   96   2HZ   LYS  12          2HZ       LYS  12  -0.584  -5.915  10.090
   97   3HZ   LYS  12          3HZ       LYS  12   0.767  -6.869   9.705
   98    H    ASP  13           H        ASP  13  -5.733  -3.364   5.859
   99    HA   ASP  13           HA       ASP  13  -6.797  -5.152   3.694
  100   1HB   ASP  13          1HB       ASP  13  -7.643  -4.949   6.380
  101   2HB   ASP  13          2HB       ASP  13  -8.844  -4.055   5.449
  102    H    LYS  14           H        LYS  14  -6.761  -1.806   4.990
  103    HA   LYS  14           HA       LYS  14  -8.704  -0.940   3.011
  104   1HB   LYS  14          1HB       LYS  14  -8.267   0.183   5.223
  105   2HB   LYS  14          2HB       LYS  14  -6.762   0.775   4.547
  106   1HG   LYS  14          1HG       LYS  14  -9.534   1.276   3.409
  107   2HG   LYS  14          2HG       LYS  14  -8.583   2.430   4.347
  108   1HD   LYS  14          1HD       LYS  14  -7.944   1.311   1.604
  109   2HD   LYS  14          2HD       LYS  14  -8.249   2.991   2.002
  110   1HE   LYS  14          1HE       LYS  14  -6.200   3.152   3.253
  111   2HE   LYS  14          2HE       LYS  14  -5.963   1.400   3.209
  112   1HZ   LYS  14          1HZ       LYS  14  -5.878   1.692   0.737
  113   2HZ   LYS  14          2HZ       LYS  14  -5.694   3.357   1.044
  114   3HZ   LYS  14          3HZ       LYS  14  -4.579   2.252   1.647
  115    H    LEU  15           H        LEU  15  -5.170  -0.679   3.437
  116    HA   LEU  15           HA       LEU  15  -4.443   0.580   1.050
  117   1HB   LEU  15          1HB       LEU  15  -2.673  -1.612   1.175
  118   2HB   LEU  15          2HB       LEU  15  -2.385   0.010   1.808
  119    HG   LEU  15           HG       LEU  15  -3.385  -0.645   3.955
  120   1HD1  LEU  15          1HD1      LEU  15  -4.480  -2.706   2.405
  121   2HD1  LEU  15          2HD1      LEU  15  -3.360  -3.482   3.526
  122   3HD1  LEU  15          3HD1      LEU  15  -4.674  -2.458   4.144
  123   1HD2  LEU  15          1HD2      LEU  15  -0.927  -1.071   3.345
  124   2HD2  LEU  15          2HD2      LEU  15  -1.569  -2.012   4.692
  125   3HD2  LEU  15          3HD2      LEU  15  -1.398  -2.754   3.100
  126    H    LYS  16           H        LYS  16  -6.000  -2.471   1.486
  127    HA   LYS  16           HA       LYS  16  -5.379  -3.546  -1.107
  128   1HB   LYS  16          1HB       LYS  16  -6.775  -4.267   1.358
  129   2HB   LYS  16          2HB       LYS  16  -7.729  -4.666  -0.029
  130   1HG   LYS  16          1HG       LYS  16  -5.474  -5.708  -0.884
  131   2HG   LYS  16          2HG       LYS  16  -5.080  -5.694   0.829
  132   1HD   LYS  16          1HD       LYS  16  -7.774  -6.689   0.068
  133   2HD   LYS  16          2HD       LYS  16  -6.413  -7.738  -0.323
  134   1HE   LYS  16          1HE       LYS  16  -6.482  -8.444   1.809
  135   2HE   LYS  16          2HE       LYS  16  -5.896  -6.847   2.272
  136   1HZ   LYS  16          1HZ       LYS  16  -8.764  -7.349   1.789
  137   2HZ   LYS  16          2HZ       LYS  16  -8.061  -7.679   3.299
  138   3HZ   LYS  16          3HZ       LYS  16  -8.043  -6.098   2.677
  139    H    SER  17           H        SER  17  -8.352  -2.354   0.464
  140    HA   SER  17           HA       SER  17 -10.111  -2.331  -1.669
  141   1HB   SER  17          1HB       SER  17  -9.851  -0.822   0.804
  142   2HB   SER  17          2HB       SER  17 -10.657   0.096  -0.459
  143    HG   SER  17           HG       SER  17 -11.329  -2.505   0.444
  144    H    GLU  18           H        GLU  18  -7.340  -0.302  -1.204
  145    HA   GLU  18           HA       GLU  18  -8.179   1.489  -3.397
  146   1HB   GLU  18          1HB       GLU  18  -5.555   1.574  -1.903
  147   2HB   GLU  18          2HB       GLU  18  -6.373   2.872  -2.757
  148   1HG   GLU  18          1HG       GLU  18  -7.428   1.509  -0.254
  149   2HG   GLU  18          2HG       GLU  18  -6.717   3.114  -0.293
  150    H    LEU  19           H        LEU  19  -5.338  -0.590  -2.642
  151    HA   LEU  19           HA       LEU  19  -3.903  -0.572  -4.956
  152   1HB   LEU  19          1HB       LEU  19  -4.723  -2.881  -3.216
  153   2HB   LEU  19          2HB       LEU  19  -3.858  -3.204  -4.696
  154    HG   LEU  19           HG       LEU  19  -2.722  -1.006  -3.119
  155   1HD1  LEU  19          1HD1      LEU  19  -1.998  -2.543  -5.196
  156   2HD1  LEU  19          2HD1      LEU  19  -0.813  -1.819  -4.106
  157   3HD1  LEU  19          3HD1      LEU  19  -1.304  -3.507  -3.893
  158   1HD2  LEU  19          1HD2      LEU  19  -3.415  -3.550  -1.870
  159   2HD2  LEU  19          2HD2      LEU  19  -1.666  -3.325  -1.906
  160   3HD2  LEU  19          3HD2      LEU  19  -2.696  -2.120  -1.128
  161    H    VAL  20           H        VAL  20  -6.950  -2.382  -4.547
  162    HA   VAL  20           HA       VAL  20  -7.110  -3.506  -7.131
  163    HB   VAL  20           HB       VAL  20  -9.204  -2.576  -5.152
  164   1HG1  VAL  20          1HG1      VAL  20  -8.186  -5.245  -6.161
  165   2HG1  VAL  20          2HG1      VAL  20  -8.057  -4.589  -4.530
  166   3HG1  VAL  20          3HG1      VAL  20  -9.628  -5.082  -5.159
  167   1HG2  VAL  20          1HG2      VAL  20  -9.547  -3.413  -8.001
  168   2HG2  VAL  20          2HG2      VAL  20 -10.671  -4.087  -6.821
  169   3HG2  VAL  20          3HG2      VAL  20 -10.543  -2.339  -7.018
  170    H    ALA  21           H        ALA  21  -8.468  -0.410  -5.990
  171    HA   ALA  21           HA       ALA  21  -9.321   0.491  -8.574
  172   1HB   ALA  21          1HB       ALA  21  -9.550   2.675  -7.492
  173   2HB   ALA  21          2HB       ALA  21 -10.140   1.413  -6.409
  174   3HB   ALA  21          3HB       ALA  21  -8.549   2.132  -6.143
  175    H    ASN  22           H        ASN  22  -6.191   0.338  -7.129
  176    HA   ASN  22           HA       ASN  22  -5.160   2.417  -8.979
  177   1HB   ASN  22          1HB       ASN  22  -3.721   0.967  -6.734
  178   2HB   ASN  22          2HB       ASN  22  -3.150   2.403  -7.587
  179   2HD2  ASN  22          2HD2      ASN  22  -4.707   1.520  -4.716
  180   1HD2  ASN  22          1HD2      ASN  22  -5.591   2.940  -4.452
  181    H    ASN  23           H        ASN  23  -5.984  -0.039 -10.136
  182    HA   ASN  23           HA       ASN  23  -5.210  -1.625 -11.672
  183   1HB   ASN  23          1HB       ASN  23  -3.256   0.551 -11.658
  184   2HB   ASN  23          2HB       ASN  23  -2.558  -0.991 -12.154
  185   2HD2  ASN  23          2HD2      ASN  23  -4.141   1.696 -13.378
  186   1HD2  ASN  23          1HD2      ASN  23  -4.810   1.001 -14.777
  187    H    VAL  24           H        VAL  24  -5.138  -2.609  -9.102
  188    HA   VAL  24           HA       VAL  24  -2.742  -4.351  -9.254
  189    HB   VAL  24           HB       VAL  24  -3.638  -3.164  -6.617
  190   1HG1  VAL  24          1HG1      VAL  24  -1.620  -5.093  -7.565
  191   2HG1  VAL  24          2HG1      VAL  24  -0.969  -3.860  -6.487
  192   3HG1  VAL  24          3HG1      VAL  24  -2.300  -4.886  -5.953
  193   1HG2  VAL  24          1HG2      VAL  24  -2.766  -1.452  -8.332
  194   2HG2  VAL  24          2HG2      VAL  24  -1.927  -1.519  -6.783
  195   3HG2  VAL  24          3HG2      VAL  24  -1.218  -2.284  -8.205
  196    H    THR  25           H        THR  25  -3.617  -6.382  -9.385
  197    HA   THR  25           HA       THR  25  -6.309  -6.921  -8.478
  198    HB   THR  25           HB       THR  25  -5.034  -9.362  -8.800
  199    HG1  THR  25           HG1      THR  25  -3.304  -8.926  -9.881
  200   1HG2  THR  25          1HG2      THR  25  -6.482  -7.633 -10.816
  201   2HG2  THR  25          2HG2      THR  25  -6.196  -9.363 -11.001
  202   3HG2  THR  25          3HG2      THR  25  -7.224  -8.775  -9.695
  203    H    LEU  26           H        LEU  26  -6.808  -8.571  -6.851
  204    HA   LEU  26           HA       LEU  26  -4.846  -8.506  -4.593
  205   1HB   LEU  26          1HB       LEU  26  -7.850  -8.860  -4.497
  206   2HB   LEU  26          2HB       LEU  26  -6.794  -8.757  -3.107
  207    HG   LEU  26           HG       LEU  26  -8.111  -6.690  -4.389
  208   1HD1  LEU  26          1HD1      LEU  26  -5.179  -6.609  -4.970
  209   2HD1  LEU  26          2HD1      LEU  26  -6.526  -6.284  -6.060
  210   3HD1  LEU  26          3HD1      LEU  26  -6.118  -5.129  -4.793
  211   1HD2  LEU  26          1HD2      LEU  26  -6.801  -7.169  -2.002
  212   2HD2  LEU  26          2HD2      LEU  26  -6.010  -5.739  -2.674
  213   3HD2  LEU  26          3HD2      LEU  26  -7.753  -5.747  -2.408
  214    HA   PRO  27           HA       PRO  27  -4.917 -12.885  -5.723
  215   1HB   PRO  27          1HB       PRO  27  -2.458 -13.402  -4.587
  216   2HB   PRO  27          2HB       PRO  27  -2.679 -12.780  -6.233
  217   1HG   PRO  27          1HG       PRO  27  -1.766 -11.362  -3.772
  218   2HG   PRO  27          2HG       PRO  27  -1.430 -10.988  -5.468
  219   1HD   PRO  27          1HD       PRO  27  -3.310  -9.678  -3.805
  220   2HD   PRO  27          2HD       PRO  27  -3.190  -9.515  -5.568
  221    H    ALA  28           H        ALA  28  -3.344 -12.067  -2.590
  222    HA   ALA  28           HA       ALA  28  -4.146 -14.344  -1.175
  223   1HB   ALA  28          1HB       ALA  28  -2.853 -13.163   0.268
  224   2HB   ALA  28          2HB       ALA  28  -4.351 -12.354   0.734
  225   3HB   ALA  28          3HB       ALA  28  -3.296 -11.623  -0.473
  226    H    GLY  29           H        GLY  29  -5.828 -14.064   0.805
  227   1HA   GLY  29          1HA       GLY  29  -8.282 -14.513   0.718
  228   2HA   GLY  29          2HA       GLY  29  -8.388 -13.227  -0.488
  229    H    GLU  30           H        GLU  30  -6.325 -12.789   2.280
  230    HA   GLU  30           HA       GLU  30  -8.130 -10.618   3.200
  231   1HB   GLU  30          1HB       GLU  30  -7.854 -13.115   4.547
  232   2HB   GLU  30          2HB       GLU  30  -7.012 -11.902   5.511
  233   1HG   GLU  30          1HG       GLU  30  -9.396 -10.668   4.645
  234   2HG   GLU  30          2HG       GLU  30  -9.858 -12.290   5.162
  235    H    GLN  31           H        GLN  31  -5.090 -12.265   4.130
  236    HA   GLN  31           HA       GLN  31  -3.296 -10.209   3.360
  237   1HB   GLN  31          1HB       GLN  31  -4.563  -8.833   5.051
  238   2HB   GLN  31          2HB       GLN  31  -4.157 -10.016   6.286
  239   1HG   GLN  31          1HG       GLN  31  -1.700  -9.471   5.301
  240   2HG   GLN  31          2HG       GLN  31  -2.507  -7.930   5.074
  241   2HE2  GLN  31          2HE2      GLN  31  -0.868  -9.801   7.387
  242   1HE2  GLN  31          1HE2      GLN  31  -1.420  -9.016   8.784
  243    H    ARG  32           H        ARG  32  -2.311 -12.264   2.895
  244    HA   ARG  32           HA       ARG  32  -1.642 -14.379   4.355
  245   1HB   ARG  32          1HB       ARG  32  -0.887 -13.726   2.057
  246   2HB   ARG  32          2HB       ARG  32   0.262 -12.609   2.788
  247   1HG   ARG  32          1HG       ARG  32   0.293 -15.385   3.756
  248   2HG   ARG  32          2HG       ARG  32   0.911 -15.090   2.137
  249   1HD   ARG  32          1HD       ARG  32   1.790 -13.102   4.125
  250   2HD   ARG  32          2HD       ARG  32   2.385 -14.740   4.458
  251    HE   ARG  32           HE       ARG  32   2.839 -14.268   1.716
  252   1HH1  ARG  32          1HH1      ARG  32   5.222 -14.543   1.668
  253   2HH1  ARG  32          2HH1      ARG  32   6.129 -13.321   2.497
  254   1HH2  ARG  32          1HH2      ARG  32   3.370 -12.007   4.134
  255   2HH2  ARG  32          2HH2      ARG  32   5.081 -11.886   3.892
  256    H    LYS  33           H        LYS  33   0.263 -11.374   4.407
  257    HA   LYS  33           HA       LYS  33   0.475 -11.070   7.198
  258   1HB   LYS  33          1HB       LYS  33   1.806 -13.296   6.800
  259   2HB   LYS  33          2HB       LYS  33   3.057 -12.226   6.162
  260   1HG   LYS  33          1HG       LYS  33   3.646 -12.307   8.411
  261   2HG   LYS  33          2HG       LYS  33   2.609 -10.881   8.385
  262   1HD   LYS  33          1HD       LYS  33   1.050 -11.875   9.689
  263   2HD   LYS  33          2HD       LYS  33   1.090 -13.356   8.730
  264   1HE   LYS  33          1HE       LYS  33   1.857 -13.583  11.157
  265   2HE   LYS  33          2HE       LYS  33   2.974 -14.198   9.938
  266   1HZ   LYS  33          1HZ       LYS  33   3.404 -11.433  10.433
  267   2HZ   LYS  33          2HZ       LYS  33   3.519 -12.325  11.871
  268   3HZ   LYS  33          3HZ       LYS  33   4.497 -12.728  10.542
  269    H    ASP  34           H        ASP  34   0.091  -8.972   6.072
  270    HA   ASP  34           HA       ASP  34   1.006  -6.840   5.540
  271   1HB   ASP  34          1HB       ASP  34   3.191  -8.241   6.641
  272   2HB   ASP  34          2HB       ASP  34   3.775  -7.616   5.096
  273    H    VAL  35           H        VAL  35   0.796  -9.522   3.647
  274    HA   VAL  35           HA       VAL  35   2.344  -9.043   1.375
  275    HB   VAL  35           HB       VAL  35   0.098 -10.692   2.077
  276   1HG1  VAL  35          1HG1      VAL  35   2.418 -11.135   1.039
  277   2HG1  VAL  35          2HG1      VAL  35   1.040 -12.138   0.568
  278   3HG1  VAL  35          3HG1      VAL  35   1.602 -10.853  -0.495
  279   1HG2  VAL  35          1HG2      VAL  35  -0.181  -9.115  -0.542
  280   2HG2  VAL  35          2HG2      VAL  35  -0.861 -10.741  -0.346
  281   3HG2  VAL  35          3HG2      VAL  35  -1.413  -9.430   0.684
  282    H    TYR  36           H        TYR  36  -0.629  -7.365   2.408
  283    HA   TYR  36           HA       TYR  36  -0.901  -6.037  -0.165
  284   1HB   TYR  36          1HB       TYR  36  -2.249  -5.680   2.510
  285   2HB   TYR  36          2HB       TYR  36  -2.669  -4.776   1.070
  286    HD1  TYR  36           HD1      TYR  36  -3.273  -7.657   2.943
  287    HD2  TYR  36           HD2      TYR  36  -3.066  -6.248  -1.107
  288    HE1  TYR  36           HE1      TYR  36  -4.550  -9.633   2.187
  289    HE2  TYR  36           HE2      TYR  36  -4.374  -8.229  -1.878
  290    HH   TYR  36           HH       TYR  36  -5.388 -10.745   0.452
  291    H    VAL  37           H        VAL  37   0.566  -5.360   2.929
  292    HA   VAL  37           HA       VAL  37   0.897  -2.523   2.394
  293    HB   VAL  37           HB       VAL  37   2.152  -4.417   4.417
  294   1HG1  VAL  37          1HG1      VAL  37  -0.403  -3.661   4.356
  295   2HG1  VAL  37          2HG1      VAL  37   0.490  -3.705   5.881
  296   3HG1  VAL  37          3HG1      VAL  37   0.258  -2.173   5.042
  297   1HG2  VAL  37          1HG2      VAL  37   2.989  -1.792   3.608
  298   2HG2  VAL  37          2HG2      VAL  37   2.284  -1.674   5.220
  299   3HG2  VAL  37          3HG2      VAL  37   3.625  -2.780   4.923
  300    H    GLN  38           H        GLN  38   2.744  -5.464   1.872
  301    HA   GLN  38           HA       GLN  38   5.141  -4.069   0.946
  302   1HB   GLN  38          1HB       GLN  38   5.487  -6.240   1.958
  303   2HB   GLN  38          2HB       GLN  38   4.236  -6.970   0.955
  304   1HG   GLN  38          1HG       GLN  38   5.972  -7.597  -0.368
  305   2HG   GLN  38          2HG       GLN  38   5.909  -5.935  -0.944
  306   2HE2  GLN  38          2HE2      GLN  38   7.218  -7.571   2.002
  307   1HE2  GLN  38          1HE2      GLN  38   8.731  -6.797   1.936
  308    H    LEU  39           H        LEU  39   2.594  -6.117  -0.401
  309    HA   LEU  39           HA       LEU  39   3.066  -5.986  -3.145
  310   1HB   LEU  39          1HB       LEU  39   0.621  -6.203  -1.497
  311   2HB   LEU  39          2HB       LEU  39   0.307  -5.529  -3.081
  312    HG   LEU  39           HG       LEU  39   1.966  -8.014  -2.743
  313   1HD1  LEU  39          1HD1      LEU  39  -0.714  -7.808  -2.024
  314   2HD1  LEU  39          2HD1      LEU  39  -0.782  -8.354  -3.699
  315   3HD1  LEU  39          3HD1      LEU  39   0.108  -9.295  -2.503
  316   1HD2  LEU  39          1HD2      LEU  39   0.629  -6.456  -4.941
  317   2HD2  LEU  39          2HD2      LEU  39   2.255  -7.146  -4.896
  318   3HD2  LEU  39          3HD2      LEU  39   0.863  -8.200  -5.139
  319    H    TYR  40           H        TYR  40   1.419  -3.571  -1.143
  320    HA   TYR  40           HA       TYR  40   0.963  -1.623  -3.096
  321   1HB   TYR  40          1HB       TYR  40   0.040  -0.730  -1.256
  322   2HB   TYR  40          2HB       TYR  40   0.834  -1.929  -0.270
  323    HD1  TYR  40           HD1      TYR  40   1.863  -1.040   1.552
  324    HD2  TYR  40           HD2      TYR  40   2.073   1.101  -2.155
  325    HE1  TYR  40           HE1      TYR  40   3.294   0.678   2.622
  326    HE2  TYR  40           HE2      TYR  40   3.494   2.827  -1.080
  327    HH   TYR  40           HH       TYR  40   4.158   2.747   2.387
  328    H    LEU  41           H        LEU  41   3.807  -1.816  -0.856
  329    HA   LEU  41           HA       LEU  41   5.158   0.349  -2.105
  330   1HB   LEU  41          1HB       LEU  41   6.537  -2.038  -0.850
  331   2HB   LEU  41          2HB       LEU  41   7.144  -0.388  -0.971
  332    HG   LEU  41           HG       LEU  41   4.533  -0.743   0.421
  333   1HD1  LEU  41          1HD1      LEU  41   6.859  -2.278   1.138
  334   2HD1  LEU  41          2HD1      LEU  41   6.548  -1.076   2.391
  335   3HD1  LEU  41          3HD1      LEU  41   5.288  -2.224   1.937
  336   1HD2  LEU  41          1HD2      LEU  41   5.690   1.467   0.131
  337   2HD2  LEU  41          2HD2      LEU  41   5.408   1.043   1.824
  338   3HD2  LEU  41          3HD2      LEU  41   7.020   0.850   1.118
  339    H    GLN  42           H        GLN  42   4.620  -2.859  -3.277
  340    HA   GLN  42           HA       GLN  42   6.963  -2.924  -5.008
  341   1HB   GLN  42          1HB       GLN  42   5.313  -4.841  -4.059
  342   2HB   GLN  42          2HB       GLN  42   4.673  -4.659  -5.689
  343   1HG   GLN  42          1HG       GLN  42   7.502  -5.347  -4.869
  344   2HG   GLN  42          2HG       GLN  42   6.395  -6.305  -5.853
  345   2HE2  GLN  42          2HE2      GLN  42   5.707  -5.176  -7.995
  346   1HE2  GLN  42          1HE2      GLN  42   6.890  -4.258  -8.793
  347    H    HIS  43           H        HIS  43   3.477  -2.892  -5.915
  348    HA   HIS  43           HA       HIS  43   4.162  -1.899  -8.588
  349   1HB   HIS  43          1HB       HIS  43   1.370  -1.884  -7.497
  350   2HB   HIS  43          2HB       HIS  43   1.927  -2.290  -9.129
  351    HD1  HIS  43           HD1      HIS  43   2.690  -4.724  -9.549
  352    HD2  HIS  43           HD2      HIS  43   1.621  -3.949  -5.602
  353    HE1  HIS  43           HE1      HIS  43   2.557  -6.978  -8.396
  354    H    LEU  44           H        LEU  44   2.984  -0.635  -5.576
  355    HA   LEU  44           HA       LEU  44   2.380   1.965  -6.841
  356   1HB   LEU  44          1HB       LEU  44   2.032   1.040  -3.982
  357   2HB   LEU  44          2HB       LEU  44   1.511   2.586  -4.621
  358    HG   LEU  44           HG       LEU  44   0.148  -0.036  -4.755
  359   1HD1  LEU  44          1HD1      LEU  44  -0.434   2.545  -4.200
  360   2HD1  LEU  44          2HD1      LEU  44  -1.072   2.427  -5.828
  361   3HD1  LEU  44          3HD1      LEU  44  -1.646   1.324  -4.580
  362   1HD2  LEU  44          1HD2      LEU  44   0.699   1.513  -7.308
  363   2HD2  LEU  44          2HD2      LEU  44   0.701  -0.233  -7.069
  364   3HD2  LEU  44          3HD2      LEU  44  -0.818   0.657  -7.076
  365    H    THR  45           H        THR  45   4.960   0.402  -5.135
  366    HA   THR  45           HA       THR  45   6.954   1.274  -4.225
  367    HB   THR  45           HB       THR  45   7.390   3.464  -5.890
  368    HG1  THR  45           HG1      THR  45   6.107   1.441  -7.379
  369   1HG2  THR  45          1HG2      THR  45   7.940   0.500  -6.160
  370   2HG2  THR  45          2HG2      THR  45   8.630   1.696  -7.260
  371   3HG2  THR  45          3HG2      THR  45   9.031   1.743  -5.541
  372    H    ALA  46           H        ALA  46   4.409   2.580  -3.151
  373    HA   ALA  46           HA       ALA  46   3.832   4.513  -1.939
  374   1HB   ALA  46          1HB       ALA  46   6.827   4.422  -1.404
  375   2HB   ALA  46          2HB       ALA  46   5.652   5.350  -0.470
  376   3HB   ALA  46          3HB       ALA  46   5.591   3.586  -0.463
  377    H    ARG  47           H        ARG  47   3.839   5.103  -4.419
  378    HA   ARG  47           HA       ARG  47   5.086   6.604  -6.069
  379   1HB   ARG  47          1HB       ARG  47   3.104   8.450  -5.365
  380   2HB   ARG  47          2HB       ARG  47   2.969   7.201  -6.563
  381   1HG   ARG  47          1HG       ARG  47   2.591   6.342  -3.726
  382   2HG   ARG  47          2HG       ARG  47   1.345   7.371  -4.388
  383   1HD   ARG  47          1HD       ARG  47   1.296   4.693  -4.696
  384   2HD   ARG  47          2HD       ARG  47   0.652   5.773  -5.929
  385    HE   ARG  47           HE       ARG  47   3.488   5.210  -6.256
  386   1HH1  ARG  47          1HH1      ARG  47   0.291   4.020  -6.724
  387   2HH1  ARG  47          2HH1      ARG  47   0.664   3.212  -8.209
  388   1HH2  ARG  47          1HH2      ARG  47   3.971   4.256  -8.254
  389   2HH2  ARG  47          2HH2      ARG  47   2.746   3.345  -9.076
  390    H    ASN  48           H        ASN  48   3.732   8.946  -3.728
  391    HA   ASN  48           HA       ASN  48   6.287  10.447  -4.010
  392   1HB   ASN  48          1HB       ASN  48   4.443  12.031  -2.570
  393   2HB   ASN  48          2HB       ASN  48   4.901  12.201  -4.264
  394   2HD2  ASN  48          2HD2      ASN  48   3.723  10.348  -5.688
  395   1HD2  ASN  48          1HD2      ASN  48   2.069  10.251  -5.392
  396    H    ARG  49           H        ARG  49   6.632   8.366  -2.235
  397    HA   ARG  49           HA       ARG  49   7.195   7.855  -0.007
  398   1HB   ARG  49          1HB       ARG  49   8.239  10.458  -0.810
  399   2HB   ARG  49          2HB       ARG  49   8.090  10.285   0.937
  400   1HG   ARG  49          1HG       ARG  49   9.464   8.306   0.931
  401   2HG   ARG  49          2HG       ARG  49   9.340   8.158  -0.826
  402   1HD   ARG  49          1HD       ARG  49  11.501   9.213   0.348
  403   2HD   ARG  49          2HD       ARG  49  10.918   9.819  -1.201
  404    HE   ARG  49           HE       ARG  49   9.691  11.204   1.036
  405   1HH1  ARG  49          1HH1      ARG  49  12.380  10.981  -1.115
  406   2HH1  ARG  49          2HH1      ARG  49  12.924  12.596  -0.807
  407   1HH2  ARG  49          1HH2      ARG  49  10.440  13.284   1.509
  408   2HH2  ARG  49          2HH2      ARG  49  11.828  13.898   0.676
  409    HA   PRO  50           HA       PRO  50   4.398   9.406   2.973
  410   1HB   PRO  50          1HB       PRO  50   5.868   9.265   5.293
  411   2HB   PRO  50          2HB       PRO  50   5.222   7.846   4.458
  412   1HG   PRO  50          1HG       PRO  50   8.026   8.813   4.613
  413   2HG   PRO  50          2HG       PRO  50   7.425   7.190   4.247
  414   1HD   PRO  50          1HD       PRO  50   8.378   9.149   2.391
  415   2HD   PRO  50          2HD       PRO  50   7.664   7.573   1.999
  416    HA   PRO  51           HA       PRO  51   5.113  13.698   3.747
  417   1HB   PRO  51          1HB       PRO  51   3.309  14.112   5.781
  418   2HB   PRO  51          2HB       PRO  51   2.844  13.917   4.083
  419   1HG   PRO  51          1HG       PRO  51   2.610  11.972   6.344
  420   2HG   PRO  51          2HG       PRO  51   1.619  12.116   4.884
  421   1HD   PRO  51          1HD       PRO  51   3.664  10.210   5.311
  422   2HD   PRO  51          2HD       PRO  51   2.924  10.609   3.745
  423    H    LEU  52           H        LEU  52   7.318  13.332   4.650
  424    HA   LEU  52           HA       LEU  52   7.371  13.469   7.637
  425   1HB   LEU  52          1HB       LEU  52   9.121  12.124   5.637
  426   2HB   LEU  52          2HB       LEU  52   9.917  12.835   7.042
  427    HG   LEU  52           HG       LEU  52   8.477  11.563   8.549
  428   1HD1  LEU  52          1HD1      LEU  52  10.524  10.460   7.700
  429   2HD1  LEU  52          2HD1      LEU  52   9.241   9.282   7.979
  430   3HD1  LEU  52          3HD1      LEU  52   9.608   9.814   6.338
  431   1HD2  LEU  52          1HD2      LEU  52   7.210  10.544   5.984
  432   2HD2  LEU  52          2HD2      LEU  52   6.881   9.892   7.589
  433   3HD2  LEU  52          3HD2      LEU  52   6.432  11.554   7.203
  434    HA   PRO  53           HA       PRO  53   9.183  17.465   7.228
  435   1HB   PRO  53          1HB       PRO  53  10.474  17.585   9.646
  436   2HB   PRO  53          2HB       PRO  53   8.718  17.744   9.464
  437   1HG   PRO  53          1HG       PRO  53  10.308  15.434  10.495
  438   2HG   PRO  53          2HG       PRO  53   8.639  15.895  10.860
  439   1HD   PRO  53          1HD       PRO  53   9.462  13.840   9.078
  440   2HD   PRO  53          2HD       PRO  53   7.822  14.503   9.231
  441    H    ALA  54           H        ALA  54  10.757  15.345   5.959
  442    HA   ALA  54           HA       ALA  54  12.922  15.214   5.045
  443   1HB   ALA  54          1HB       ALA  54  12.653  17.866   6.079
  444   2HB   ALA  54          2HB       ALA  54  14.274  17.284   6.474
  445   3HB   ALA  54          3HB       ALA  54  13.729  17.300   4.796
  446    H    GLY  55           H        GLY  55  12.057  14.580   8.116
  447   1HA   GLY  55          1HA       GLY  55  14.537  14.366   9.535
  448   2HA   GLY  55          2HA       GLY  55  14.229  12.849   8.685
  449    H    THR  56           H        THR  56  14.217  12.402  11.278
  450    HA   THR  56           HA       THR  56  11.834  13.073  12.728
  451    HB   THR  56           HB       THR  56  10.532  11.740  11.294
  452    HG1  THR  56           HG1      THR  56   9.877  10.258  12.669
  453   1HG2  THR  56          1HG2      THR  56  12.432  10.851   9.978
  454   2HG2  THR  56          2HG2      THR  56  12.805   9.728  11.287
  455   3HG2  THR  56          3HG2      THR  56  11.292   9.571  10.395

  No H/Q in entry =         455
  Start of MODEL    6
    1    H2   PRO   1           H2       PRO   1  -1.983  11.161  -8.909
    2    H3   PRO   1           H3       PRO   1  -3.472  11.345  -9.708
    3    HA   PRO   1           HA       PRO   1  -4.269   9.573  -8.657
    4   1HB   PRO   1          1HB       PRO   1  -2.303   7.557  -9.198
    5   2HB   PRO   1          2HB       PRO   1  -3.874   7.786  -9.979
    6   1HG   PRO   1          1HG       PRO   1  -1.282   8.280 -11.073
    7   2HG   PRO   1          2HG       PRO   1  -2.856   8.547 -11.840
    8   1HD   PRO   1          1HD       PRO   1  -0.983  10.506 -10.756
    9   2HD   PRO   1          2HD       PRO   1  -2.492  10.828 -11.619
   10    H    GLU   2           H        GLU   2  -3.546  10.748  -6.638
   11    HA   GLU   2           HA       GLU   2  -1.113   9.898  -5.305
   12   1HB   GLU   2          1HB       GLU   2  -3.199  11.817  -4.857
   13   2HB   GLU   2          2HB       GLU   2  -3.013  10.841  -3.401
   14   1HG   GLU   2          1HG       GLU   2  -0.458  11.225  -3.757
   15   2HG   GLU   2          2HG       GLU   2  -0.966  12.555  -4.797
   16    H    PHE   3           H        PHE   3  -0.858   8.288  -3.774
   17    HA   PHE   3           HA       PHE   3  -3.250   6.738  -2.930
   18   1HB   PHE   3          1HB       PHE   3  -2.665   5.242  -4.608
   19   2HB   PHE   3          2HB       PHE   3  -1.009   5.845  -4.678
   20    HD1  PHE   3           HD1      PHE   3  -3.057   3.147  -3.577
   21    HD2  PHE   3           HD2      PHE   3   0.523   5.333  -2.765
   22    HE1  PHE   3           HE1      PHE   3  -2.150   1.219  -2.355
   23    HE2  PHE   3           HE2      PHE   3   1.437   3.407  -1.597
   24    HZ   PHE   3           HZ       PHE   3   0.093   1.298  -1.402
   25    H    LEU   4           H        LEU   4  -2.674   5.287  -1.101
   26    HA   LEU   4           HA       LEU   4  -1.405   6.642   1.007
   27   1HB   LEU   4          1HB       LEU   4  -1.082   4.217   1.951
   28   2HB   LEU   4          2HB       LEU   4  -2.713   4.806   1.683
   29    HG   LEU   4           HG       LEU   4  -1.716   3.685  -0.761
   30   1HD1  LEU   4          1HD1      LEU   4  -1.407   2.067   1.745
   31   2HD1  LEU   4          2HD1      LEU   4  -1.530   1.330   0.149
   32   3HD1  LEU   4          3HD1      LEU   4  -0.178   2.396   0.536
   33   1HD2  LEU   4          1HD2      LEU   4  -3.952   3.326   1.172
   34   2HD2  LEU   4          2HD2      LEU   4  -4.012   3.589  -0.571
   35   3HD2  LEU   4          3HD2      LEU   4  -3.636   1.988   0.066
   36    H    GLU   5           H        GLU   5   0.643   7.487   0.161
   37    HA   GLU   5           HA       GLU   5   2.714   5.751  -0.829
   38   1HB   GLU   5          1HB       GLU   5   2.931   8.446   0.553
   39   2HB   GLU   5          2HB       GLU   5   4.242   7.644  -0.309
   40   1HG   GLU   5          1HG       GLU   5   3.408   9.066  -1.953
   41   2HG   GLU   5          2HG       GLU   5   2.505   7.589  -2.316
   42    H    ASP   6           H        ASP   6   1.338   6.149   2.233
   43    HA   ASP   6           HA       ASP   6   3.308   4.331   3.407
   44   1HB   ASP   6          1HB       ASP   6   4.498   6.143   4.180
   45   2HB   ASP   6          2HB       ASP   6   3.099   7.213   4.171
   46    HA   PRO   7           HA       PRO   7  -0.950   3.496   4.755
   47   1HB   PRO   7          1HB       PRO   7  -0.572   0.772   4.801
   48   2HB   PRO   7          2HB       PRO   7  -1.065   1.676   3.370
   49   1HG   PRO   7          1HG       PRO   7   1.582   0.477   4.025
   50   2HG   PRO   7          2HG       PRO   7   0.873   0.835   2.443
   51   1HD   PRO   7          1HD       PRO   7   2.868   2.378   3.759
   52   2HD   PRO   7          2HD       PRO   7   1.915   2.887   2.350
   53    H    SER   8           H        SER   8   1.133   4.283   6.627
   54    HA   SER   8           HA       SER   8   1.481   2.187   8.599
   55   1HB   SER   8          1HB       SER   8   2.885   3.673   9.597
   56   2HB   SER   8          2HB       SER   8   2.689   4.616   8.118
   57    HG   SER   8           HG       SER   8   1.564   4.976  10.639
   58    H    VAL   9           H        VAL   9  -1.242   3.800   7.653
   59    HA   VAL   9           HA       VAL   9  -2.374   3.724  10.413
   60    HB   VAL   9           HB       VAL   9  -3.821   5.525   9.871
   61   1HG1  VAL   9          1HG1      VAL   9  -4.400   4.647   7.597
   62   2HG1  VAL   9          2HG1      VAL   9  -4.116   6.388   7.620
   63   3HG1  VAL   9          3HG1      VAL   9  -2.874   5.301   7.004
   64   1HG2  VAL   9          1HG2      VAL   9  -0.997   5.747   9.517
   65   2HG2  VAL   9          2HG2      VAL   9  -1.772   6.828   8.359
   66   3HG2  VAL   9          3HG2      VAL   9  -2.121   6.982  10.081
   67    H    LEU  10           H        LEU  10  -2.878   2.807   7.017
   68    HA   LEU  10           HA       LEU  10  -5.489   1.591   7.740
   69   1HB   LEU  10          1HB       LEU  10  -5.073   0.654   5.223
   70   2HB   LEU  10          2HB       LEU  10  -5.826   2.229   5.539
   71    HG   LEU  10           HG       LEU  10  -2.824   1.990   5.321
   72   1HD1  LEU  10          1HD1      LEU  10  -4.224   1.024   3.285
   73   2HD1  LEU  10          2HD1      LEU  10  -4.448   2.733   2.920
   74   3HD1  LEU  10          3HD1      LEU  10  -2.826   2.063   3.005
   75   1HD2  LEU  10          1HD2      LEU  10  -4.640   4.070   5.839
   76   2HD2  LEU  10          2HD2      LEU  10  -2.923   4.237   5.473
   77   3HD2  LEU  10          3HD2      LEU  10  -4.114   4.321   4.176
   78    H    THR  11           H        THR  11  -5.764  -0.319   8.264
   79    HA   THR  11           HA       THR  11  -3.962  -2.293   8.995
   80    HB   THR  11           HB       THR  11  -6.282  -2.555   9.501
   81    HG1  THR  11           HG1      THR  11  -6.785  -4.548   8.546
   82   1HG2  THR  11          1HG2      THR  11  -6.603  -2.154   6.516
   83   2HG2  THR  11          2HG2      THR  11  -7.933  -2.738   7.532
   84   3HG2  THR  11          3HG2      THR  11  -7.239  -1.132   7.816
   85    H    LYS  12           H        LYS  12  -4.037  -4.542   7.715
   86    HA   LYS  12           HA       LYS  12  -2.777  -4.021   5.124
   87   1HB   LYS  12          1HB       LYS  12  -2.783  -6.156   7.038
   88   2HB   LYS  12          2HB       LYS  12  -3.311  -6.809   5.491
   89   1HG   LYS  12          1HG       LYS  12  -1.056  -6.994   5.144
   90   2HG   LYS  12          2HG       LYS  12  -1.225  -5.313   4.640
   91   1HD   LYS  12          1HD       LYS  12   0.592  -5.397   6.236
   92   2HD   LYS  12          2HD       LYS  12  -0.780  -4.630   7.033
   93   1HE   LYS  12          1HE       LYS  12  -1.388  -6.874   8.001
   94   2HE   LYS  12          2HE       LYS  12   0.116  -7.514   7.335
   95   1HZ   LYS  12          1HZ       LYS  12   0.695  -5.143   8.697
   96   2HZ   LYS  12          2HZ       LYS  12  -0.264  -6.101   9.720
   97   3HZ   LYS  12          3HZ       LYS  12   1.185  -6.720   9.082
   98    H    ASP  13           H        ASP  13  -5.915  -4.158   6.130
   99    HA   ASP  13           HA       ASP  13  -6.924  -5.663   3.785
  100   1HB   ASP  13          1HB       ASP  13  -7.812  -5.274   6.485
  101   2HB   ASP  13          2HB       ASP  13  -9.068  -4.697   5.388
  102    H    LYS  14           H        LYS  14  -6.451  -2.354   4.736
  103    HA   LYS  14           HA       LYS  14  -8.632  -1.386   2.968
  104   1HB   LYS  14          1HB       LYS  14  -7.953  -0.411   5.224
  105   2HB   LYS  14          2HB       LYS  14  -6.568   0.239   4.364
  106   1HG   LYS  14          1HG       LYS  14  -9.473   0.749   3.724
  107   2HG   LYS  14          2HG       LYS  14  -8.322   1.890   4.427
  108   1HD   LYS  14          1HD       LYS  14  -8.087   0.667   1.658
  109   2HD   LYS  14          2HD       LYS  14  -8.582   2.284   2.043
  110   1HE   LYS  14          1HE       LYS  14  -5.972   1.225   3.005
  111   2HE   LYS  14          2HE       LYS  14  -6.126   2.040   1.459
  112   1HZ   LYS  14          1HZ       LYS  14  -7.468   3.538   3.416
  113   2HZ   LYS  14          2HZ       LYS  14  -5.903   3.206   3.974
  114   3HZ   LYS  14          3HZ       LYS  14  -6.121   3.984   2.481
  115    H    LEU  15           H        LEU  15  -5.179  -0.779   3.374
  116    HA   LEU  15           HA       LEU  15  -4.493   0.533   1.090
  117   1HB   LEU  15          1HB       LEU  15  -2.564  -1.507   1.136
  118   2HB   LEU  15          2HB       LEU  15  -2.463   0.069   1.914
  119    HG   LEU  15           HG       LEU  15  -3.445  -0.797   3.959
  120   1HD1  LEU  15          1HD1      LEU  15  -4.354  -2.875   2.241
  121   2HD1  LEU  15          2HD1      LEU  15  -3.301  -3.602   3.451
  122   3HD1  LEU  15          3HD1      LEU  15  -4.716  -2.647   3.965
  123   1HD2  LEU  15          1HD2      LEU  15  -0.955  -1.084   3.348
  124   2HD2  LEU  15          2HD2      LEU  15  -1.578  -2.054   4.682
  125   3HD2  LEU  15          3HD2      LEU  15  -1.352  -2.782   3.090
  126    H    LYS  16           H        LYS  16  -5.665  -2.786   1.199
  127    HA   LYS  16           HA       LYS  16  -4.845  -3.294  -1.503
  128   1HB   LYS  16          1HB       LYS  16  -5.476  -5.429  -1.073
  129   2HB   LYS  16          2HB       LYS  16  -5.172  -4.893   0.546
  130   1HG   LYS  16          1HG       LYS  16  -7.438  -4.603   0.986
  131   2HG   LYS  16          2HG       LYS  16  -7.891  -4.723  -0.697
  132   1HD   LYS  16          1HD       LYS  16  -8.207  -6.934  -0.408
  133   2HD   LYS  16          2HD       LYS  16  -6.474  -7.081  -0.118
  134   1HE   LYS  16          1HE       LYS  16  -7.802  -8.017   1.756
  135   2HE   LYS  16          2HE       LYS  16  -6.809  -6.652   2.266
  136   1HZ   LYS  16          1HZ       LYS  16  -9.120  -5.489   1.448
  137   2HZ   LYS  16          2HZ       LYS  16  -9.666  -6.913   2.195
  138   3HZ   LYS  16          3HZ       LYS  16  -8.702  -5.815   3.057
  139    H    SER  17           H        SER  17  -7.865  -2.775   0.212
  140    HA   SER  17           HA       SER  17  -9.709  -2.833  -1.870
  141   1HB   SER  17          1HB       SER  17  -9.517  -1.437   0.667
  142   2HB   SER  17          2HB       SER  17 -10.394  -0.490  -0.525
  143    HG   SER  17           HG       SER  17 -11.035  -2.905   0.665
  144    H    GLU  18           H        GLU  18  -7.159  -0.527  -1.288
  145    HA   GLU  18           HA       GLU  18  -8.093   1.304  -3.389
  146   1HB   GLU  18          1HB       GLU  18  -5.321   1.378  -2.294
  147   2HB   GLU  18          2HB       GLU  18  -6.372   2.708  -2.730
  148   1HG   GLU  18          1HG       GLU  18  -7.785   1.579  -0.673
  149   2HG   GLU  18          2HG       GLU  18  -6.141   1.262  -0.157
  150    H    LEU  19           H        LEU  19  -5.075  -0.603  -2.895
  151    HA   LEU  19           HA       LEU  19  -3.849  -0.544  -5.320
  152   1HB   LEU  19          1HB       LEU  19  -4.422  -2.848  -3.505
  153   2HB   LEU  19          2HB       LEU  19  -3.660  -3.178  -5.029
  154    HG   LEU  19           HG       LEU  19  -2.485  -0.896  -3.587
  155   1HD1  LEU  19          1HD1      LEU  19  -1.813  -2.384  -5.649
  156   2HD1  LEU  19          2HD1      LEU  19  -0.578  -1.738  -4.569
  157   3HD1  LEU  19          3HD1      LEU  19  -1.114  -3.412  -4.402
  158   1HD2  LEU  19          1HD2      LEU  19  -2.871  -3.553  -2.298
  159   2HD2  LEU  19          2HD2      LEU  19  -1.222  -2.929  -2.244
  160   3HD2  LEU  19          3HD2      LEU  19  -2.547  -1.992  -1.536
  161    H    VAL  20           H        VAL  20  -6.852  -2.234  -4.631
  162    HA   VAL  20           HA       VAL  20  -7.243  -3.644  -7.025
  163    HB   VAL  20           HB       VAL  20  -9.387  -2.180  -5.450
  164   1HG1  VAL  20          1HG1      VAL  20  -7.478  -4.016  -4.446
  165   2HG1  VAL  20          2HG1      VAL  20  -8.939  -3.432  -3.649
  166   3HG1  VAL  20          3HG1      VAL  20  -8.994  -4.905  -4.614
  167   1HG2  VAL  20          1HG2      VAL  20  -9.840  -3.477  -7.666
  168   2HG2  VAL  20          2HG2      VAL  20  -9.548  -4.922  -6.698
  169   3HG2  VAL  20          3HG2      VAL  20 -10.863  -3.826  -6.272
  170    H    ALA  21           H        ALA  21  -8.524  -0.430  -6.183
  171    HA   ALA  21           HA       ALA  21  -9.305   0.263  -8.859
  172   1HB   ALA  21          1HB       ALA  21  -9.572   2.522  -7.929
  173   2HB   ALA  21          2HB       ALA  21 -10.222   1.324  -6.807
  174   3HB   ALA  21          3HB       ALA  21  -8.639   2.054  -6.503
  175    H    ASN  22           H        ASN  22  -6.232   0.288  -7.257
  176    HA   ASN  22           HA       ASN  22  -5.152   2.303  -9.132
  177   1HB   ASN  22          1HB       ASN  22  -3.800   0.856  -6.834
  178   2HB   ASN  22          2HB       ASN  22  -3.147   2.243  -7.708
  179   2HD2  ASN  22          2HD2      ASN  22  -4.785   1.527  -4.857
  180   1HD2  ASN  22          1HD2      ASN  22  -5.651   2.970  -4.669
  181    H    ASN  23           H        ASN  23  -5.955  -0.205 -10.261
  182    HA   ASN  23           HA       ASN  23  -5.153  -1.814 -11.759
  183   1HB   ASN  23          1HB       ASN  23  -4.156   0.143 -12.820
  184   2HB   ASN  23          2HB       ASN  23  -2.771   0.056 -11.732
  185   2HD2  ASN  23          2HD2      ASN  23  -4.165  -2.952 -12.876
  186   1HD2  ASN  23          1HD2      ASN  23  -2.920  -3.340 -13.966
  187    H    VAL  24           H        VAL  24  -4.952  -2.872  -9.307
  188    HA   VAL  24           HA       VAL  24  -2.432  -4.405  -9.496
  189    HB   VAL  24           HB       VAL  24  -3.331  -3.187  -6.867
  190   1HG1  VAL  24          1HG1      VAL  24  -1.329  -5.174  -7.723
  191   2HG1  VAL  24          2HG1      VAL  24  -0.672  -3.902  -6.695
  192   3HG1  VAL  24          3HG1      VAL  24  -2.015  -4.893  -6.125
  193   1HG2  VAL  24          1HG2      VAL  24  -1.403  -2.259  -8.974
  194   2HG2  VAL  24          2HG2      VAL  24  -2.503  -1.310  -7.977
  195   3HG2  VAL  24          3HG2      VAL  24  -1.019  -1.959  -7.280
  196    H    THR  25           H        THR  25  -2.769  -6.576  -8.876
  197    HA   THR  25           HA       THR  25  -5.569  -7.295  -8.471
  198    HB   THR  25           HB       THR  25  -4.121  -9.615  -8.350
  199    HG1  THR  25           HG1      THR  25  -2.899  -7.916 -10.250
  200   1HG2  THR  25          1HG2      THR  25  -5.217  -8.126 -10.743
  201   2HG2  THR  25          2HG2      THR  25  -4.771  -9.832 -10.758
  202   3HG2  THR  25          3HG2      THR  25  -6.088  -9.275  -9.727
  203    H    LEU  26           H        LEU  26  -6.258  -8.685  -6.832
  204    HA   LEU  26           HA       LEU  26  -4.682  -8.691  -4.332
  205   1HB   LEU  26          1HB       LEU  26  -7.636  -8.154  -4.757
  206   2HB   LEU  26          2HB       LEU  26  -6.907  -8.399  -3.174
  207    HG   LEU  26           HG       LEU  26  -5.263  -6.520  -4.013
  208   1HD1  LEU  26          1HD1      LEU  26  -6.218  -6.470  -6.248
  209   2HD1  LEU  26          2HD1      LEU  26  -7.690  -5.815  -5.553
  210   3HD1  LEU  26          3HD1      LEU  26  -6.170  -4.917  -5.427
  211   1HD2  LEU  26          1HD2      LEU  26  -6.891  -6.403  -2.079
  212   2HD2  LEU  26          2HD2      LEU  26  -6.628  -4.862  -2.900
  213   3HD2  LEU  26          3HD2      LEU  26  -8.086  -5.799  -3.226
  214    HA   PRO  27           HA       PRO  27  -5.794 -13.006  -4.998
  215   1HB   PRO  27          1HB       PRO  27  -3.596 -13.987  -3.653
  216   2HB   PRO  27          2HB       PRO  27  -3.532 -13.434  -5.337
  217   1HG   PRO  27          1HG       PRO  27  -2.396 -12.163  -2.921
  218   2HG   PRO  27          2HG       PRO  27  -2.033 -11.841  -4.622
  219   1HD   PRO  27          1HD       PRO  27  -3.759 -10.348  -2.837
  220   2HD   PRO  27          2HD       PRO  27  -3.320  -9.930  -4.491
  221    H    ALA  28           H        ALA  28  -3.987 -13.049  -1.977
  222    HA   ALA  28           HA       ALA  28  -5.708 -14.626  -0.494
  223   1HB   ALA  28          1HB       ALA  28  -3.566 -12.734   0.133
  224   2HB   ALA  28          2HB       ALA  28  -4.774 -12.833   1.416
  225   3HB   ALA  28          3HB       ALA  28  -3.943 -14.290   0.875
  226    H    GLY  29           H        GLY  29  -6.993 -13.842   1.520
  227   1HA   GLY  29          1HA       GLY  29  -9.313 -13.011   1.735
  228   2HA   GLY  29          2HA       GLY  29  -8.893 -11.743   0.577
  229    H    GLU  30           H        GLU  30  -8.794 -12.689   3.940
  230    HA   GLU  30           HA       GLU  30  -8.712 -10.101   4.974
  231   1HB   GLU  30          1HB       GLU  30  -9.070 -11.536   6.716
  232   2HB   GLU  30          2HB       GLU  30  -8.065 -12.801   6.024
  233   1HG   GLU  30          1HG       GLU  30  -7.151 -11.857   8.161
  234   2HG   GLU  30          2HG       GLU  30  -6.044 -11.679   6.801
  235    H    GLN  31           H        GLN  31  -5.792 -12.210   4.831
  236    HA   GLN  31           HA       GLN  31  -4.219 -10.411   3.414
  237   1HB   GLN  31          1HB       GLN  31  -4.308  -8.778   5.143
  238   2HB   GLN  31          2HB       GLN  31  -4.091  -9.989   6.399
  239   1HG   GLN  31          1HG       GLN  31  -1.872  -9.794   4.407
  240   2HG   GLN  31          2HG       GLN  31  -2.099  -8.431   5.490
  241   2HE2  GLN  31          2HE2      GLN  31  -1.492  -8.689   7.691
  242   1HE2  GLN  31          1HE2      GLN  31  -0.911 -10.145   8.338
  243    H    ARG  32           H        ARG  32  -2.592 -11.579   2.707
  244    HA   ARG  32           HA       ARG  32  -1.983 -14.196   3.512
  245   1HB   ARG  32          1HB       ARG  32  -1.144 -12.161   1.620
  246   2HB   ARG  32          2HB       ARG  32   0.252 -13.003   2.248
  247   1HG   ARG  32          1HG       ARG  32  -1.093 -15.169   1.690
  248   2HG   ARG  32          2HG       ARG  32  -2.094 -14.082   0.718
  249   1HD   ARG  32          1HD       ARG  32  -0.528 -14.046  -0.918
  250   2HD   ARG  32          2HD       ARG  32   0.711 -13.550   0.238
  251    HE   ARG  32           HE       ARG  32   1.081 -15.971   0.714
  252   1HH1  ARG  32          1HH1      ARG  32  -0.279 -17.970  -0.033
  253   2HH1  ARG  32          2HH1      ARG  32  -0.233 -18.183  -1.752
  254   1HH2  ARG  32          1HH2      ARG  32   0.937 -14.980  -2.382
  255   2HH2  ARG  32          2HH2      ARG  32   0.456 -16.490  -3.082
  256    H    LYS  33           H        LYS  33   0.015 -11.263   3.812
  257    HA   LYS  33           HA       LYS  33   0.629 -11.479   6.568
  258   1HB   LYS  33          1HB       LYS  33   1.766 -13.569   6.047
  259   2HB   LYS  33          2HB       LYS  33   2.631 -12.808   4.712
  260   1HG   LYS  33          1HG       LYS  33   4.127 -12.920   6.619
  261   2HG   LYS  33          2HG       LYS  33   3.674 -11.234   6.374
  262   1HD   LYS  33          1HD       LYS  33   2.026 -11.361   8.151
  263   2HD   LYS  33          2HD       LYS  33   2.285 -13.097   8.322
  264   1HE   LYS  33          1HE       LYS  33   4.837 -12.137   8.603
  265   2HE   LYS  33          2HE       LYS  33   3.893 -10.845   9.345
  266   1HZ   LYS  33          1HZ       LYS  33   2.862 -13.326  10.164
  267   2HZ   LYS  33          2HZ       LYS  33   4.540 -13.328  10.427
  268   3HZ   LYS  33          3HZ       LYS  33   3.578 -12.112  11.113
  269    H    ASP  34           H        ASP  34   0.303  -9.149   6.076
  270    HA   ASP  34           HA       ASP  34   1.147  -6.993   5.532
  271   1HB   ASP  34          1HB       ASP  34   3.334  -8.533   6.536
  272   2HB   ASP  34          2HB       ASP  34   3.930  -7.669   5.115
  273    H    VAL  35           H        VAL  35   0.336  -8.952   3.467
  274    HA   VAL  35           HA       VAL  35   2.163  -8.685   1.238
  275    HB   VAL  35           HB       VAL  35   0.580 -10.584   1.434
  276   1HG1  VAL  35          1HG1      VAL  35  -1.268  -9.194   2.378
  277   2HG1  VAL  35          2HG1      VAL  35  -1.519  -8.544   0.759
  278   3HG1  VAL  35          3HG1      VAL  35  -1.753 -10.262   1.056
  279   1HG2  VAL  35          1HG2      VAL  35   0.511  -8.700  -0.920
  280   2HG2  VAL  35          2HG2      VAL  35   1.329 -10.264  -0.773
  281   3HG2  VAL  35          3HG2      VAL  35  -0.425 -10.203  -0.947
  282    H    TYR  36           H        TYR  36  -0.990  -7.220   2.032
  283    HA   TYR  36           HA       TYR  36  -1.056  -5.654  -0.336
  284   1HB   TYR  36          1HB       TYR  36  -2.394  -5.379   2.349
  285   2HB   TYR  36          2HB       TYR  36  -2.860  -4.516   0.892
  286    HD1  TYR  36           HD1      TYR  36  -3.104  -7.552   2.750
  287    HD2  TYR  36           HD2      TYR  36  -3.396  -5.917  -1.191
  288    HE1  TYR  36           HE1      TYR  36  -4.441  -9.489   2.052
  289    HE2  TYR  36           HE2      TYR  36  -4.741  -7.852  -1.913
  290    HH   TYR  36           HH       TYR  36  -4.860 -10.475  -0.901
  291    H    VAL  37           H        VAL  37   0.511  -5.294   2.726
  292    HA   VAL  37           HA       VAL  37   0.948  -2.422   2.382
  293    HB   VAL  37           HB       VAL  37   2.067  -4.500   4.314
  294   1HG1  VAL  37          1HG1      VAL  37  -0.391  -3.669   4.409
  295   2HG1  VAL  37          2HG1      VAL  37   0.566  -3.561   5.892
  296   3HG1  VAL  37          3HG1      VAL  37   0.298  -2.121   4.912
  297   1HG2  VAL  37          1HG2      VAL  37   3.203  -1.999   3.597
  298   2HG2  VAL  37          2HG2      VAL  37   2.420  -1.755   5.158
  299   3HG2  VAL  37          3HG2      VAL  37   3.640  -3.016   4.970
  300    H    GLN  38           H        GLN  38   2.743  -5.463   1.921
  301    HA   GLN  38           HA       GLN  38   5.188  -4.206   1.006
  302   1HB   GLN  38          1HB       GLN  38   4.032  -6.980   0.532
  303   2HB   GLN  38          2HB       GLN  38   5.685  -6.501   0.218
  304   1HG   GLN  38          1HG       GLN  38   4.653  -5.972   2.950
  305   2HG   GLN  38          2HG       GLN  38   4.950  -7.656   2.526
  306   2HE2  GLN  38          2HE2      GLN  38   7.108  -8.361   2.541
  307   1HE2  GLN  38          1HE2      GLN  38   8.447  -7.332   2.731
  308    H    LEU  39           H        LEU  39   2.858  -6.216  -0.734
  309    HA   LEU  39           HA       LEU  39   3.244  -5.779  -3.374
  310   1HB   LEU  39          1HB       LEU  39   0.764  -5.973  -1.753
  311   2HB   LEU  39          2HB       LEU  39   0.518  -5.250  -3.332
  312    HG   LEU  39           HG       LEU  39   2.029  -7.840  -2.987
  313   1HD1  LEU  39          1HD1      LEU  39  -0.626  -7.512  -2.303
  314   2HD1  LEU  39          2HD1      LEU  39  -0.736  -7.936  -4.011
  315   3HD1  LEU  39          3HD1      LEU  39   0.078  -9.022  -2.888
  316   1HD2  LEU  39          1HD2      LEU  39   0.978  -6.146  -5.207
  317   2HD2  LEU  39          2HD2      LEU  39   2.446  -7.126  -5.139
  318   3HD2  LEU  39          3HD2      LEU  39   0.883  -7.897  -5.418
  319    H    TYR  40           H        TYR  40   1.416  -3.454  -1.373
  320    HA   TYR  40           HA       TYR  40   1.111  -1.403  -3.223
  321   1HB   TYR  40          1HB       TYR  40   0.076  -0.636  -1.373
  322   2HB   TYR  40          2HB       TYR  40   0.913  -1.818  -0.397
  323    HD1  TYR  40           HD1      TYR  40   1.955   1.331  -2.195
  324    HD2  TYR  40           HD2      TYR  40   1.960  -0.964   1.426
  325    HE1  TYR  40           HE1      TYR  40   3.306   3.087  -1.085
  326    HE2  TYR  40           HE2      TYR  40   3.314   0.788   2.533
  327    HH   TYR  40           HH       TYR  40   4.220   2.792   2.343
  328    H    LEU  41           H        LEU  41   3.791  -1.578  -0.806
  329    HA   LEU  41           HA       LEU  41   5.200   0.617  -1.888
  330   1HB   LEU  41          1HB       LEU  41   5.541  -1.071   0.252
  331   2HB   LEU  41          2HB       LEU  41   6.883  -1.548  -0.781
  332    HG   LEU  41           HG       LEU  41   7.376   0.997  -0.977
  333   1HD1  LEU  41          1HD1      LEU  41   7.727  -0.492   1.639
  334   2HD1  LEU  41          2HD1      LEU  41   8.811  -0.547   0.249
  335   3HD1  LEU  41          3HD1      LEU  41   8.635   0.946   1.171
  336   1HD2  LEU  41          1HD2      LEU  41   5.335   0.913   1.253
  337   2HD2  LEU  41          2HD2      LEU  41   6.647   2.088   1.312
  338   3HD2  LEU  41          3HD2      LEU  41   5.523   2.099  -0.044
  339    H    GLN  42           H        GLN  42   4.909  -2.628  -3.106
  340    HA   GLN  42           HA       GLN  42   7.356  -2.571  -4.672
  341   1HB   GLN  42          1HB       GLN  42   5.677  -4.548  -3.882
  342   2HB   GLN  42          2HB       GLN  42   5.207  -4.373  -5.570
  343   1HG   GLN  42          1HG       GLN  42   7.958  -4.971  -4.459
  344   2HG   GLN  42          2HG       GLN  42   6.992  -5.964  -5.551
  345   2HE2  GLN  42          2HE2      GLN  42   9.079  -3.115  -5.366
  346   1HE2  GLN  42          1HE2      GLN  42   9.216  -2.883  -7.043
  347    H    HIS  43           H        HIS  43   3.950  -2.651  -5.842
  348    HA   HIS  43           HA       HIS  43   4.781  -1.630  -8.456
  349   1HB   HIS  43          1HB       HIS  43   1.929  -1.649  -7.521
  350   2HB   HIS  43          2HB       HIS  43   2.579  -2.027  -9.126
  351    HD1  HIS  43           HD1      HIS  43   3.457  -4.439  -9.515
  352    HD2  HIS  43           HD2      HIS  43   2.065  -3.736  -5.658
  353    HE1  HIS  43           HE1      HIS  43   3.297  -6.708  -8.399
  354    H    LEU  44           H        LEU  44   3.208  -0.395  -5.587
  355    HA   LEU  44           HA       LEU  44   2.707   2.193  -6.887
  356   1HB   LEU  44          1HB       LEU  44   2.232   1.305  -4.032
  357   2HB   LEU  44          2HB       LEU  44   1.691   2.818  -4.733
  358    HG   LEU  44           HG       LEU  44   0.438   0.139  -4.890
  359   1HD1  LEU  44          1HD1      LEU  44  -0.289   2.662  -4.326
  360   2HD1  LEU  44          2HD1      LEU  44  -0.795   2.598  -6.006
  361   3HD1  LEU  44          3HD1      LEU  44  -1.435   1.432  -4.848
  362   1HD2  LEU  44          1HD2      LEU  44   1.119   1.627  -7.430
  363   2HD2  LEU  44          2HD2      LEU  44   0.968  -0.110  -7.169
  364   3HD2  LEU  44          3HD2      LEU  44  -0.470   0.899  -7.262
  365    H    THR  45           H        THR  45   5.191   0.719  -4.948
  366    HA   THR  45           HA       THR  45   7.105   1.662  -3.943
  367    HB   THR  45           HB       THR  45   7.644   3.825  -5.588
  368    HG1  THR  45           HG1      THR  45   6.461   1.846  -7.200
  369   1HG2  THR  45          1HG2      THR  45   8.175   0.858  -5.845
  370   2HG2  THR  45          2HG2      THR  45   8.930   2.047  -6.909
  371   3HG2  THR  45          3HG2      THR  45   9.246   2.091  -5.173
  372    H    ALA  46           H        ALA  46   4.384   2.946  -3.215
  373    HA   ALA  46           HA       ALA  46   3.644   4.855  -2.076
  374   1HB   ALA  46          1HB       ALA  46   5.209   3.957  -0.385
  375   2HB   ALA  46          2HB       ALA  46   5.250   5.720  -0.399
  376   3HB   ALA  46          3HB       ALA  46   6.546   4.803  -1.166
  377    H    ARG  47           H        ARG  47   3.980   5.464  -4.566
  378    HA   ARG  47           HA       ARG  47   5.443   7.055  -5.982
  379   1HB   ARG  47          1HB       ARG  47   3.306   8.830  -5.532
  380   2HB   ARG  47          2HB       ARG  47   3.380   7.607  -6.766
  381   1HG   ARG  47          1HG       ARG  47   2.633   6.768  -3.984
  382   2HG   ARG  47          2HG       ARG  47   1.453   7.696  -4.877
  383   1HD   ARG  47          1HD       ARG  47   1.986   4.939  -5.094
  384   2HD   ARG  47          2HD       ARG  47   0.877   5.866  -6.085
  385    HE   ARG  47           HE       ARG  47   3.734   5.800  -6.863
  386   1HH1  ARG  47          1HH1      ARG  47   0.989   6.568  -8.295
  387   2HH1  ARG  47          2HH1      ARG  47   0.977   5.334  -9.509
  388   1HH2  ARG  47          1HH2      ARG  47   3.503   3.478  -8.027
  389   2HH2  ARG  47          2HH2      ARG  47   2.401   3.584  -9.359
  390    H    ASN  48           H        ASN  48   3.667   9.151  -3.746
  391    HA   ASN  48           HA       ASN  48   6.019  10.909  -3.540
  392   1HB   ASN  48          1HB       ASN  48   3.879  11.595  -1.677
  393   2HB   ASN  48          2HB       ASN  48   4.498  12.512  -3.054
  394   2HD2  ASN  48          2HD2      ASN  48   3.913  11.092  -5.241
  395   1HD2  ASN  48          1HD2      ASN  48   2.264  10.776  -5.343
  396    H    ARG  49           H        ARG  49   7.330   9.176  -2.496
  397    HA   ARG  49           HA       ARG  49   7.014   7.822  -0.159
  398   1HB   ARG  49          1HB       ARG  49   9.378   9.570  -0.850
  399   2HB   ARG  49          2HB       ARG  49   9.358   8.440   0.494
  400   1HG   ARG  49          1HG       ARG  49   9.028   6.557  -1.000
  401   2HG   ARG  49          2HG       ARG  49   8.784   7.633  -2.377
  402   1HD   ARG  49          1HD       ARG  49  11.014   7.590  -2.762
  403   2HD   ARG  49          2HD       ARG  49  11.274   8.340  -1.186
  404    HE   ARG  49           HE       ARG  49  10.873   5.419  -1.162
  405   1HH1  ARG  49          1HH1      ARG  49  13.056   4.440  -1.643
  406   2HH1  ARG  49          2HH1      ARG  49  14.372   5.175  -0.791
  407   1HH2  ARG  49          1HH2      ARG  49  12.548   7.969   0.154
  408   2HH2  ARG  49          2HH2      ARG  49  14.085   7.173   0.227
  409    HA   PRO  50           HA       PRO  50   6.296  10.765   2.994
  410   1HB   PRO  50          1HB       PRO  50   6.956   9.232   5.181
  411   2HB   PRO  50          2HB       PRO  50   5.443   9.035   4.279
  412   1HG   PRO  50          1HG       PRO  50   7.882   7.318   4.277
  413   2HG   PRO  50          2HG       PRO  50   6.211   6.885   3.886
  414   1HD   PRO  50          1HD       PRO  50   8.315   7.401   2.029
  415   2HD   PRO  50          2HD       PRO  50   6.592   7.187   1.651
  416    HA   PRO  51           HA       PRO  51  10.454  12.260   3.651
  417   1HB   PRO  51          1HB       PRO  51   9.735  14.693   4.711
  418   2HB   PRO  51          2HB       PRO  51   9.742  14.339   2.975
  419   1HG   PRO  51          1HG       PRO  51   7.425  14.580   4.843
  420   2HG   PRO  51          2HG       PRO  51   7.488  14.853   3.095
  421   1HD   PRO  51          1HD       PRO  51   6.486  12.543   4.396
  422   2HD   PRO  51          2HD       PRO  51   6.818  12.701   2.662
  423    H    LEU  52           H        LEU  52   8.451  10.996   5.867
  424    HA   LEU  52           HA       LEU  52   8.650  10.481   8.143
  425   1HB   LEU  52          1HB       LEU  52  11.470  11.556   7.910
  426   2HB   LEU  52          2HB       LEU  52  10.865  10.372   9.066
  427    HG   LEU  52           HG       LEU  52  11.904   8.981   7.520
  428   1HD1  LEU  52          1HD1      LEU  52   9.412   8.476   7.708
  429   2HD1  LEU  52          2HD1      LEU  52   9.209   9.300   6.163
  430   3HD1  LEU  52          3HD1      LEU  52  10.196   7.842   6.260
  431   1HD2  LEU  52          1HD2      LEU  52  12.131  11.155   5.973
  432   2HD2  LEU  52          2HD2      LEU  52  12.386   9.533   5.327
  433   3HD2  LEU  52          3HD2      LEU  52  10.841  10.347   5.084
  434    HA   PRO  53           HA       PRO  53   7.846  14.323  10.142
  435   1HB   PRO  53          1HB       PRO  53   7.575  13.352  12.699
  436   2HB   PRO  53          2HB       PRO  53   6.333  13.169  11.447
  437   1HG   PRO  53          1HG       PRO  53   8.240  11.136  12.530
  438   2HG   PRO  53          2HG       PRO  53   6.636  10.899  11.819
  439   1HD   PRO  53          1HD       PRO  53   9.114  10.460  10.515
  440   2HD   PRO  53          2HD       PRO  53   7.524  10.558   9.730
  441    H    ALA  54           H        ALA  54  10.737  12.805  10.254
  442    HA   ALA  54           HA       ALA  54  12.833  13.606  10.978
  443   1HB   ALA  54          1HB       ALA  54  12.041  15.841  12.579
  444   2HB   ALA  54          2HB       ALA  54  11.072  15.835  11.103
  445   3HB   ALA  54          3HB       ALA  54  12.837  15.851  11.005
  446    H    GLY  55           H        GLY  55  12.225  11.572  12.378
  447   1HA   GLY  55          1HA       GLY  55  11.346  11.584  14.997
  448   2HA   GLY  55          2HA       GLY  55  12.996  12.194  15.121
  449    H    THR  56           H        THR  56  14.081  10.615  12.960
  450    HA   THR  56           HA       THR  56  13.601   7.892  12.922
  451    HB   THR  56           HB       THR  56  15.423   9.023  11.652
  452    HG1  THR  56           HG1      THR  56  16.707   7.255  11.684
  453   1HG2  THR  56          1HG2      THR  56  16.281  10.394  13.535
  454   2HG2  THR  56          2HG2      THR  56  16.874   8.928  14.317
  455   3HG2  THR  56          3HG2      THR  56  17.568   9.452  12.782

  No H/Q in entry =         455
  Start of MODEL    7
    1    H2   PRO   1           H2       PRO   1  -3.697   7.718  -8.413
    2    H3   PRO   1           H3       PRO   1  -3.483   8.370  -9.968
    3    HA   PRO   1           HA       PRO   1  -3.684  10.410  -9.144
    4   1HB   PRO   1          1HB       PRO   1  -6.179  10.291  -7.735
    5   2HB   PRO   1          2HB       PRO   1  -5.866  10.973  -9.331
    6   1HG   PRO   1          1HG       PRO   1  -7.300   8.621  -8.715
    7   2HG   PRO   1          2HG       PRO   1  -6.896   9.251 -10.317
    8   1HD   PRO   1          1HD       PRO   1  -5.694   6.949  -8.916
    9   2HD   PRO   1          2HD       PRO   1  -5.401   7.470 -10.581
   10    H    GLU   2           H        GLU   2  -1.947   9.761  -7.578
   11    HA   GLU   2           HA       GLU   2  -1.051   9.816  -5.410
   12   1HB   GLU   2          1HB       GLU   2  -3.711  11.187  -5.067
   13   2HB   GLU   2          2HB       GLU   2  -2.712  10.836  -3.656
   14   1HG   GLU   2          1HG       GLU   2  -1.638  12.267  -6.096
   15   2HG   GLU   2          2HG       GLU   2  -2.350  13.125  -4.729
   16    H    PHE   3           H        PHE   3  -0.849   8.271  -3.836
   17    HA   PHE   3           HA       PHE   3  -3.194   6.680  -3.007
   18   1HB   PHE   3          1HB       PHE   3  -2.685   5.158  -4.656
   19   2HB   PHE   3          2HB       PHE   3  -1.036   5.760  -4.836
   20    HD1  PHE   3           HD1      PHE   3   0.511   5.321  -2.806
   21    HD2  PHE   3           HD2      PHE   3  -2.921   3.003  -3.847
   22    HE1  PHE   3           HE1      PHE   3   1.453   3.381  -1.635
   23    HE2  PHE   3           HE2      PHE   3  -1.998   1.081  -2.642
   24    HZ   PHE   3           HZ       PHE   3   0.182   1.231  -1.549
   25    H    LEU   4           H        LEU   4  -2.879   5.784  -0.971
   26    HA   LEU   4           HA       LEU   4  -1.259   7.045   0.871
   27   1HB   LEU   4          1HB       LEU   4  -1.177   4.594   2.031
   28   2HB   LEU   4          2HB       LEU   4  -2.610   5.605   2.035
   29    HG   LEU   4           HG       LEU   4  -3.765   4.251   0.625
   30   1HD1  LEU   4          1HD1      LEU   4  -2.173   2.976   2.484
   31   2HD1  LEU   4          2HD1      LEU   4  -3.569   2.274   1.669
   32   3HD1  LEU   4          3HD1      LEU   4  -1.945   2.019   1.018
   33   1HD2  LEU   4          1HD2      LEU   4  -1.214   4.092  -0.774
   34   2HD2  LEU   4          2HD2      LEU   4  -2.085   2.569  -0.724
   35   3HD2  LEU   4          3HD2      LEU   4  -2.853   3.994  -1.411
   36    H    GLU   5           H        GLU   5   0.835   7.513   0.115
   37    HA   GLU   5           HA       GLU   5   2.649   5.388  -0.758
   38   1HB   GLU   5          1HB       GLU   5   3.307   8.212   0.152
   39   2HB   GLU   5          2HB       GLU   5   4.315   7.154  -0.835
   40   1HG   GLU   5          1HG       GLU   5   3.203   7.728  -2.726
   41   2HG   GLU   5          2HG       GLU   5   1.651   7.513  -1.987
   42    H    ASP   6           H        ASP   6   1.296   5.978   2.150
   43    HA   ASP   6           HA       ASP   6   3.391   4.579   3.622
   44   1HB   ASP   6          1HB       ASP   6   2.972   7.488   3.874
   45   2HB   ASP   6          2HB       ASP   6   2.895   6.618   5.407
   46    HA   PRO   7           HA       PRO   7  -0.920   3.646   4.835
   47   1HB   PRO   7          1HB       PRO   7  -0.566   0.910   4.670
   48   2HB   PRO   7          2HB       PRO   7  -1.086   1.899   3.302
   49   1HG   PRO   7          1HG       PRO   7   1.557   0.651   3.817
   50   2HG   PRO   7          2HG       PRO   7   0.816   1.136   2.283
   51   1HD   PRO   7          1HD       PRO   7   2.841   2.554   3.696
   52   2HD   PRO   7          2HD       PRO   7   1.902   3.166   2.318
   53    H    SER   8           H        SER   8   0.448   4.502   6.877
   54    HA   SER   8           HA       SER   8   1.223   2.214   8.612
   55   1HB   SER   8          1HB       SER   8   2.714   4.286   8.256
   56   2HB   SER   8          2HB       SER   8   1.562   5.136   9.286
   57    HG   SER   8           HG       SER   8   3.391   3.146   9.906
   58    H    VAL   9           H        VAL   9  -1.564   3.976   8.029
   59    HA   VAL   9           HA       VAL   9  -2.397   3.592  10.873
   60    HB   VAL   9           HB       VAL   9  -3.520   5.600  10.948
   61   1HG1  VAL   9          1HG1      VAL   9  -4.906   5.033   8.883
   62   2HG1  VAL   9          2HG1      VAL   9  -4.545   6.739   9.120
   63   3HG1  VAL   9          3HG1      VAL   9  -3.637   5.808   7.933
   64   1HG2  VAL   9          1HG2      VAL   9  -1.398   6.086   8.839
   65   2HG2  VAL   9          2HG2      VAL   9  -2.142   7.334   9.840
   66   3HG2  VAL   9          3HG2      VAL   9  -1.146   6.083  10.585
   67    H    LEU  10           H        LEU  10  -3.589   3.610   7.502
   68    HA   LEU  10           HA       LEU  10  -6.169   2.611   7.928
   69   1HB   LEU  10          1HB       LEU  10  -5.440   1.135   5.681
   70   2HB   LEU  10          2HB       LEU  10  -6.021   2.798   5.646
   71    HG   LEU  10           HG       LEU  10  -3.814   3.705   5.600
   72   1HD1  LEU  10          1HD1      LEU  10  -4.539   1.636   3.714
   73   2HD1  LEU  10          2HD1      LEU  10  -3.862   3.233   3.407
   74   3HD1  LEU  10          3HD1      LEU  10  -2.812   1.870   3.788
   75   1HD2  LEU  10          1HD2      LEU  10  -3.038   1.522   7.108
   76   2HD2  LEU  10          2HD2      LEU  10  -2.269   1.214   5.555
   77   3HD2  LEU  10          3HD2      LEU  10  -1.961   2.720   6.414
   78    H    THR  11           H        THR  11  -3.956   0.106   6.731
   79    HA   THR  11           HA       THR  11  -3.596  -1.610   8.820
   80    HB   THR  11           HB       THR  11  -5.871  -1.506   9.482
   81    HG1  THR  11           HG1      THR  11  -6.741  -3.544   8.788
   82   1HG2  THR  11          1HG2      THR  11  -6.290  -1.247   6.557
   83   2HG2  THR  11          2HG2      THR  11  -7.598  -2.010   7.472
   84   3HG2  THR  11          3HG2      THR  11  -7.078  -0.364   7.873
   85    H    LYS  12           H        LYS  12  -4.137  -4.063   7.862
   86    HA   LYS  12           HA       LYS  12  -2.986  -3.977   5.152
   87   1HB   LYS  12          1HB       LYS  12  -3.012  -5.902   7.329
   88   2HB   LYS  12          2HB       LYS  12  -3.560  -6.666   5.838
   89   1HG   LYS  12          1HG       LYS  12  -1.355  -6.906   5.359
   90   2HG   LYS  12          2HG       LYS  12  -1.370  -5.186   4.988
   91   1HD   LYS  12          1HD       LYS  12   0.411  -5.583   6.580
   92   2HD   LYS  12          2HD       LYS  12  -0.886  -4.725   7.415
   93   1HE   LYS  12          1HE       LYS  12  -1.719  -7.189   7.951
   94   2HE   LYS  12          2HE       LYS  12  -0.020  -7.582   7.686
   95   1HZ   LYS  12          1HZ       LYS  12  -0.396  -5.245   9.305
   96   2HZ   LYS  12          2HZ       LYS  12  -1.083  -6.634   9.995
   97   3HZ   LYS  12          3HZ       LYS  12   0.565  -6.618   9.586
   98    H    ASP  13           H        ASP  13  -5.897  -3.338   6.054
   99    HA   ASP  13           HA       ASP  13  -7.298  -5.195   4.188
  100   1HB   ASP  13          1HB       ASP  13  -7.882  -4.431   6.853
  101   2HB   ASP  13          2HB       ASP  13  -9.085  -3.646   5.831
  102    H    LYS  14           H        LYS  14  -6.795  -1.744   4.986
  103    HA   LYS  14           HA       LYS  14  -8.752  -0.895   2.975
  104   1HB   LYS  14          1HB       LYS  14  -8.228   0.343   5.105
  105   2HB   LYS  14          2HB       LYS  14  -6.690   0.782   4.389
  106   1HG   LYS  14          1HG       LYS  14  -9.444   1.442   3.286
  107   2HG   LYS  14          2HG       LYS  14  -8.333   2.565   4.071
  108   1HD   LYS  14          1HD       LYS  14  -7.961   1.191   1.400
  109   2HD   LYS  14          2HD       LYS  14  -8.126   2.912   1.686
  110   1HE   LYS  14          1HE       LYS  14  -5.903   1.415   3.012
  111   2HE   LYS  14          2HE       LYS  14  -5.735   1.920   1.337
  112   1HZ   LYS  14          1HZ       LYS  14  -6.741   4.124   2.511
  113   2HZ   LYS  14          2HZ       LYS  14  -5.737   3.514   3.735
  114   3HZ   LYS  14          3HZ       LYS  14  -5.096   3.860   2.199
  115    H    LEU  15           H        LEU  15  -5.237  -0.578   3.400
  116    HA   LEU  15           HA       LEU  15  -4.454   0.591   1.049
  117   1HB   LEU  15          1HB       LEU  15  -2.684  -1.592   1.193
  118   2HB   LEU  15          2HB       LEU  15  -2.439   0.010   1.893
  119    HG   LEU  15           HG       LEU  15  -3.517  -0.703   3.970
  120   1HD1  LEU  15          1HD1      LEU  15  -4.573  -2.734   2.321
  121   2HD1  LEU  15          2HD1      LEU  15  -3.509  -3.534   3.478
  122   3HD1  LEU  15          3HD1      LEU  15  -4.840  -2.512   4.064
  123   1HD2  LEU  15          1HD2      LEU  15  -1.056  -1.098   3.472
  124   2HD2  LEU  15          2HD2      LEU  15  -1.748  -2.107   4.742
  125   3HD2  LEU  15          3HD2      LEU  15  -1.492  -2.772   3.127
  126    H    LYS  16           H        LYS  16  -5.974  -2.521   1.332
  127    HA   LYS  16           HA       LYS  16  -5.260  -3.377  -1.342
  128   1HB   LYS  16          1HB       LYS  16  -7.586  -4.529   0.116
  129   2HB   LYS  16          2HB       LYS  16  -6.316  -5.320  -0.765
  130   1HG   LYS  16          1HG       LYS  16  -4.762  -4.912   1.058
  131   2HG   LYS  16          2HG       LYS  16  -6.042  -4.127   1.958
  132   1HD   LYS  16          1HD       LYS  16  -6.241  -6.935   0.881
  133   2HD   LYS  16          2HD       LYS  16  -5.711  -6.598   2.522
  134   1HE   LYS  16          1HE       LYS  16  -8.013  -7.085   2.739
  135   2HE   LYS  16          2HE       LYS  16  -7.999  -5.329   2.729
  136   1HZ   LYS  16          1HZ       LYS  16  -8.096  -6.335   0.086
  137   2HZ   LYS  16          2HZ       LYS  16  -9.357  -6.996   1.008
  138   3HZ   LYS  16          3HZ       LYS  16  -9.191  -5.310   0.884
  139    H    SER  17           H        SER  17  -8.251  -2.363   0.311
  140    HA   SER  17           HA       SER  17 -10.043  -2.279  -1.786
  141   1HB   SER  17          1HB       SER  17  -9.660  -0.704   0.658
  142   2HB   SER  17          2HB       SER  17 -10.615   0.094  -0.579
  143    HG   SER  17           HG       SER  17 -12.113  -1.428  -0.451
  144    H    GLU  18           H        GLU  18  -7.242  -0.316  -1.284
  145    HA   GLU  18           HA       GLU  18  -7.953   1.590  -3.406
  146   1HB   GLU  18          1HB       GLU  18  -5.220   1.447  -2.196
  147   2HB   GLU  18          2HB       GLU  18  -6.156   2.855  -2.660
  148   1HG   GLU  18          1HG       GLU  18  -6.485   1.141  -0.185
  149   2HG   GLU  18          2HG       GLU  18  -6.208   2.876  -0.252
  150    H    LEU  19           H        LEU  19  -5.132  -0.576  -2.820
  151    HA   LEU  19           HA       LEU  19  -3.833  -0.629  -5.187
  152   1HB   LEU  19          1HB       LEU  19  -4.649  -2.926  -3.429
  153   2HB   LEU  19          2HB       LEU  19  -3.820  -3.254  -4.922
  154    HG   LEU  19           HG       LEU  19  -2.574  -1.079  -3.452
  155   1HD1  LEU  19          1HD1      LEU  19  -1.882  -3.674  -4.769
  156   2HD1  LEU  19          2HD1      LEU  19  -1.344  -2.046  -5.181
  157   3HD1  LEU  19          3HD1      LEU  19  -0.682  -2.864  -3.765
  158   1HD2  LEU  19          1HD2      LEU  19  -3.330  -3.552  -2.052
  159   2HD2  LEU  19          2HD2      LEU  19  -1.599  -3.229  -2.006
  160   3HD2  LEU  19          3HD2      LEU  19  -2.731  -2.032  -1.377
  161    H    VAL  20           H        VAL  20  -7.043  -2.052  -4.700
  162    HA   VAL  20           HA       VAL  20  -7.236  -3.201  -7.347
  163    HB   VAL  20           HB       VAL  20  -9.285  -2.441  -5.250
  164   1HG1  VAL  20          1HG1      VAL  20  -8.159  -5.043  -6.312
  165   2HG1  VAL  20          2HG1      VAL  20  -7.971  -4.381  -4.688
  166   3HG1  VAL  20          3HG1      VAL  20  -9.549  -4.953  -5.230
  167   1HG2  VAL  20          1HG2      VAL  20  -9.704  -3.682  -7.986
  168   2HG2  VAL  20          2HG2      VAL  20 -10.907  -3.722  -6.697
  169   3HG2  VAL  20          3HG2      VAL  20 -10.401  -2.178  -7.385
  170    H    ALA  21           H        ALA  21  -8.643  -0.258  -5.904
  171    HA   ALA  21           HA       ALA  21  -9.759   0.803  -8.291
  172   1HB   ALA  21          1HB       ALA  21  -9.753   2.952  -7.086
  173   2HB   ALA  21          2HB       ALA  21 -10.273   1.647  -6.019
  174   3HB   ALA  21          3HB       ALA  21  -8.630   2.285  -5.896
  175    H    ASN  22           H        ASN  22  -6.486   0.426  -7.399
  176    HA   ASN  22           HA       ASN  22  -5.635   2.641  -9.181
  177   1HB   ASN  22          1HB       ASN  22  -3.982   0.912  -7.310
  178   2HB   ASN  22          2HB       ASN  22  -3.441   2.395  -8.106
  179   2HD2  ASN  22          2HD2      ASN  22  -4.664   1.337  -5.131
  180   1HD2  ASN  22          1HD2      ASN  22  -5.482   2.746  -4.654
  181    H    ASN  23           H        ASN  23  -3.868  -0.420  -8.642
  182    HA   ASN  23           HA       ASN  23  -4.542  -1.527 -11.217
  183   1HB   ASN  23          1HB       ASN  23  -2.407  -1.076 -12.378
  184   2HB   ASN  23          2HB       ASN  23  -3.275   0.419 -12.025
  185   2HD2  ASN  23          2HD2      ASN  23  -1.381   1.769 -11.856
  186   1HD2  ASN  23          1HD2      ASN  23  -0.238   1.581 -10.612
  187    H    VAL  24           H        VAL  24  -4.453  -2.823  -8.853
  188    HA   VAL  24           HA       VAL  24  -2.149  -4.656  -9.230
  189    HB   VAL  24           HB       VAL  24  -2.945  -3.672  -6.484
  190   1HG1  VAL  24          1HG1      VAL  24  -1.160  -5.688  -7.553
  191   2HG1  VAL  24          2HG1      VAL  24  -0.250  -4.491  -6.631
  192   3HG1  VAL  24          3HG1      VAL  24  -1.583  -5.364  -5.872
  193   1HG2  VAL  24          1HG2      VAL  24  -1.105  -2.493  -8.516
  194   2HG2  VAL  24          2HG2      VAL  24  -2.057  -1.692  -7.267
  195   3HG2  VAL  24          3HG2      VAL  24  -0.555  -2.513  -6.844
  196    H    THR  25           H        THR  25  -2.743  -6.818  -8.829
  197    HA   THR  25           HA       THR  25  -5.589  -7.323  -8.480
  198    HB   THR  25           HB       THR  25  -4.244  -9.743  -8.248
  199    HG1  THR  25           HG1      THR  25  -2.388  -9.479  -9.154
  200   1HG2  THR  25          1HG2      THR  25  -5.506  -8.244 -10.532
  201   2HG2  THR  25          2HG2      THR  25  -4.855  -9.867 -10.761
  202   3HG2  THR  25          3HG2      THR  25  -6.162  -9.596  -9.609
  203    H    LEU  26           H        LEU  26  -6.379  -8.804  -6.787
  204    HA   LEU  26           HA       LEU  26  -4.871  -8.439  -4.232
  205   1HB   LEU  26          1HB       LEU  26  -7.853  -8.798  -4.592
  206   2HB   LEU  26          2HB       LEU  26  -7.044  -8.468  -3.083
  207    HG   LEU  26           HG       LEU  26  -8.103  -6.653  -4.923
  208   1HD1  LEU  26          1HD1      LEU  26  -5.122  -6.600  -4.845
  209   2HD1  LEU  26          2HD1      LEU  26  -6.204  -6.354  -6.213
  210   3HD1  LEU  26          3HD1      LEU  26  -6.029  -5.099  -4.990
  211   1HD2  LEU  26          1HD2      LEU  26  -7.396  -6.754  -2.232
  212   2HD2  LEU  26          2HD2      LEU  26  -6.479  -5.394  -2.896
  213   3HD2  LEU  26          3HD2      LEU  26  -8.237  -5.441  -3.052
  214    HA   PRO  27           HA       PRO  27  -5.074 -12.933  -4.602
  215   1HB   PRO  27          1HB       PRO  27  -2.637 -13.347  -3.369
  216   2HB   PRO  27          2HB       PRO  27  -2.793 -12.948  -5.089
  217   1HG   PRO  27          1HG       PRO  27  -1.750 -11.279  -2.896
  218   2HG   PRO  27          2HG       PRO  27  -1.626 -11.020  -4.642
  219   1HD   PRO  27          1HD       PRO  27  -3.472  -9.819  -2.744
  220   2HD   PRO  27          2HD       PRO  27  -3.242  -9.373  -4.436
  221    H    ALA  28           H        ALA  28  -3.949 -14.445  -2.457
  222    HA   ALA  28           HA       ALA  28  -4.725 -15.261  -0.369
  223   1HB   ALA  28          1HB       ALA  28  -3.189 -13.059   0.015
  224   2HB   ALA  28          2HB       ALA  28  -4.696 -12.499   0.738
  225   3HB   ALA  28          3HB       ALA  28  -3.917 -13.960   1.344
  226    H    GLY  29           H        GLY  29  -6.289 -14.166   1.611
  227   1HA   GLY  29          1HA       GLY  29  -8.783 -14.500   1.669
  228   2HA   GLY  29          2HA       GLY  29  -8.838 -13.567   0.168
  229    H    GLU  30           H        GLU  30  -7.048 -13.006   3.191
  230    HA   GLU  30           HA       GLU  30  -8.362 -10.322   3.347
  231   1HB   GLU  30          1HB       GLU  30  -8.591 -12.380   5.214
  232   2HB   GLU  30          2HB       GLU  30  -7.333 -11.344   5.888
  233   1HG   GLU  30          1HG       GLU  30  -8.774  -9.607   6.245
  234   2HG   GLU  30          2HG       GLU  30  -9.685  -9.929   4.771
  235    H    GLN  31           H        GLN  31  -5.488 -12.285   3.923
  236    HA   GLN  31           HA       GLN  31  -3.648 -10.331   3.047
  237   1HB   GLN  31          1HB       GLN  31  -4.291  -9.051   5.057
  238   2HB   GLN  31          2HB       GLN  31  -3.989 -10.453   6.069
  239   1HG   GLN  31          1HG       GLN  31  -1.619  -9.772   4.486
  240   2HG   GLN  31          2HG       GLN  31  -2.202  -8.437   5.467
  241   2HE2  GLN  31          2HE2      GLN  31  -1.351 -11.906   5.754
  242   1HE2  GLN  31          1HE2      GLN  31  -0.930 -11.822   7.393
  243    H    ARG  32           H        ARG  32  -2.105 -11.615   2.359
  244    HA   ARG  32           HA       ARG  32  -1.742 -14.312   3.204
  245   1HB   ARG  32          1HB       ARG  32  -0.644 -12.325   1.319
  246   2HB   ARG  32          2HB       ARG  32   0.514 -13.518   1.842
  247   1HG   ARG  32          1HG       ARG  32  -0.579 -15.242   0.757
  248   2HG   ARG  32          2HG       ARG  32  -2.166 -14.506   0.995
  249   1HD   ARG  32          1HD       ARG  32  -1.632 -14.358  -1.372
  250   2HD   ARG  32          2HD       ARG  32  -1.514 -12.727  -0.694
  251    HE   ARG  32           HE       ARG  32   0.997 -13.157  -0.594
  252   1HH1  ARG  32          1HH1      ARG  32   1.830 -12.678  -2.855
  253   2HH1  ARG  32          2HH1      ARG  32   1.790 -14.043  -3.922
  254   1HH2  ARG  32          1HH2      ARG  32  -0.320 -15.902  -1.891
  255   2HH2  ARG  32          2HH2      ARG  32   0.573 -15.868  -3.375
  256    H    LYS  33           H        LYS  33   0.127 -11.324   3.635
  257    HA   LYS  33           HA       LYS  33   0.867 -11.723   6.323
  258   1HB   LYS  33          1HB       LYS  33   2.109 -13.703   5.400
  259   2HB   LYS  33          2HB       LYS  33   3.040 -12.599   4.387
  260   1HG   LYS  33          1HG       LYS  33   2.950 -11.833   7.231
  261   2HG   LYS  33          2HG       LYS  33   3.762 -13.369   6.925
  262   1HD   LYS  33          1HD       LYS  33   4.762 -11.794   4.907
  263   2HD   LYS  33          2HD       LYS  33   4.593 -10.630   6.221
  264   1HE   LYS  33          1HE       LYS  33   6.372 -11.501   7.296
  265   2HE   LYS  33          2HE       LYS  33   5.679 -13.121   7.218
  266   1HZ   LYS  33          1HZ       LYS  33   6.453 -13.144   4.835
  267   2HZ   LYS  33          2HZ       LYS  33   7.364 -11.757   5.204
  268   3HZ   LYS  33          3HZ       LYS  33   7.671 -13.219   6.013
  269    H    ASP  34           H        ASP  34   0.344  -9.369   5.983
  270    HA   ASP  34           HA       ASP  34   0.984  -7.129   5.438
  271   1HB   ASP  34          1HB       ASP  34   3.257  -8.494   6.546
  272   2HB   ASP  34          2HB       ASP  34   3.834  -7.537   5.178
  273    H    VAL  35           H        VAL  35   0.416  -9.128   3.375
  274    HA   VAL  35           HA       VAL  35   2.344  -8.647   1.240
  275    HB   VAL  35           HB       VAL  35  -0.294 -10.154   1.323
  276   1HG1  VAL  35          1HG1      VAL  35   2.476 -10.707   1.932
  277   2HG1  VAL  35          2HG1      VAL  35   1.066 -11.735   2.149
  278   3HG1  VAL  35          3HG1      VAL  35   1.932 -11.735   0.611
  279   1HG2  VAL  35          1HG2      VAL  35   0.988  -8.993  -0.937
  280   2HG2  VAL  35          2HG2      VAL  35   1.320 -10.728  -0.972
  281   3HG2  VAL  35          3HG2      VAL  35  -0.343 -10.151  -0.902
  282    H    TYR  36           H        TYR  36  -0.663  -7.227   2.322
  283    HA   TYR  36           HA       TYR  36  -1.155  -5.897  -0.227
  284   1HB   TYR  36          1HB       TYR  36  -2.276  -5.662   2.565
  285   2HB   TYR  36          2HB       TYR  36  -2.781  -4.632   1.245
  286    HD1  TYR  36           HD1      TYR  36  -3.396  -5.893  -0.989
  287    HD2  TYR  36           HD2      TYR  36  -3.345  -7.638   2.914
  288    HE1  TYR  36           HE1      TYR  36  -4.922  -7.672  -1.765
  289    HE2  TYR  36           HE2      TYR  36  -4.850  -9.417   2.163
  290    HH   TYR  36           HH       TYR  36  -6.117  -9.471  -1.185
  291    H    VAL  37           H        VAL  37   0.296  -5.269   2.882
  292    HA   VAL  37           HA       VAL  37   0.759  -2.458   2.438
  293    HB   VAL  37           HB       VAL  37   1.951  -4.513   4.349
  294   1HG1  VAL  37          1HG1      VAL  37  -0.543  -3.684   4.409
  295   2HG1  VAL  37          2HG1      VAL  37   0.392  -3.716   5.908
  296   3HG1  VAL  37          3HG1      VAL  37   0.157  -2.194   5.051
  297   1HG2  VAL  37          1HG2      VAL  37   3.004  -1.969   3.642
  298   2HG2  VAL  37          2HG2      VAL  37   2.222  -1.760   5.209
  299   3HG2  VAL  37          3HG2      VAL  37   3.480  -2.980   5.006
  300    H    GLN  38           H        GLN  38   2.874  -5.352   2.335
  301    HA   GLN  38           HA       GLN  38   5.132  -3.992   1.226
  302   1HB   GLN  38          1HB       GLN  38   4.885  -6.409   2.275
  303   2HB   GLN  38          2HB       GLN  38   4.497  -6.887   0.629
  304   1HG   GLN  38          1HG       GLN  38   6.696  -5.642  -0.006
  305   2HG   GLN  38          2HG       GLN  38   7.070  -5.768   1.715
  306   2HE2  GLN  38          2HE2      GLN  38   5.880  -7.887  -0.963
  307   1HE2  GLN  38          1HE2      GLN  38   6.767  -9.250  -0.467
  308    H    LEU  39           H        LEU  39   2.555  -5.955  -0.243
  309    HA   LEU  39           HA       LEU  39   3.182  -5.858  -2.963
  310   1HB   LEU  39          1HB       LEU  39   0.570  -5.758  -1.504
  311   2HB   LEU  39          2HB       LEU  39   0.522  -5.266  -3.180
  312    HG   LEU  39           HG       LEU  39   1.885  -7.825  -2.425
  313   1HD1  LEU  39          1HD1      LEU  39  -0.509  -7.777  -1.575
  314   2HD1  LEU  39          2HD1      LEU  39  -1.020  -7.487  -3.235
  315   3HD1  LEU  39          3HD1      LEU  39  -0.206  -8.994  -2.817
  316   1HD2  LEU  39          1HD2      LEU  39   0.817  -6.439  -4.871
  317   2HD2  LEU  39          2HD2      LEU  39   2.372  -7.248  -4.640
  318   3HD2  LEU  39          3HD2      LEU  39   0.904  -8.204  -4.850
  319    H    TYR  40           H        TYR  40   1.377  -3.390  -1.187
  320    HA   TYR  40           HA       TYR  40   1.114  -1.431  -3.103
  321   1HB   TYR  40          1HB       TYR  40   0.139  -0.578  -1.280
  322   2HB   TYR  40          2HB       TYR  40   0.988  -1.713  -0.259
  323    HD1  TYR  40           HD1      TYR  40   2.016  -0.729   1.521
  324    HD2  TYR  40           HD2      TYR  40   2.077   1.309  -2.251
  325    HE1  TYR  40           HE1      TYR  40   3.366   1.089   2.520
  326    HE2  TYR  40           HE2      TYR  40   3.421   3.134  -1.244
  327    HH   TYR  40           HH       TYR  40   5.111   3.190   0.929
  328    H    LEU  41           H        LEU  41   3.936  -1.741  -0.874
  329    HA   LEU  41           HA       LEU  41   5.319   0.446  -2.106
  330   1HB   LEU  41          1HB       LEU  41   6.615  -1.904  -0.700
  331   2HB   LEU  41          2HB       LEU  41   7.258  -0.271  -0.867
  332    HG   LEU  41           HG       LEU  41   4.583  -0.594   0.435
  333   1HD1  LEU  41          1HD1      LEU  41   6.958  -1.943   1.343
  334   2HD1  LEU  41          2HD1      LEU  41   6.547  -0.660   2.481
  335   3HD1  LEU  41          3HD1      LEU  41   5.362  -1.906   2.091
  336   1HD2  LEU  41          1HD2      LEU  41   5.610   1.643   0.000
  337   2HD2  LEU  41          2HD2      LEU  41   5.360   1.343   1.724
  338   3HD2  LEU  41          3HD2      LEU  41   6.975   1.182   1.020
  339    H    GLN  42           H        GLN  42   4.989  -2.898  -3.028
  340    HA   GLN  42           HA       GLN  42   7.324  -3.045  -4.705
  341   1HB   GLN  42          1HB       GLN  42   5.714  -4.920  -3.753
  342   2HB   GLN  42          2HB       GLN  42   4.871  -4.672  -5.275
  343   1HG   GLN  42          1HG       GLN  42   7.165  -4.954  -6.410
  344   2HG   GLN  42          2HG       GLN  42   7.724  -5.584  -4.856
  345   2HE2  GLN  42          2HE2      GLN  42   5.416  -6.176  -7.514
  346   1HE2  GLN  42          1HE2      GLN  42   5.148  -7.808  -7.136
  347    H    HIS  43           H        HIS  43   3.870  -2.778  -5.649
  348    HA   HIS  43           HA       HIS  43   4.673  -1.965  -8.368
  349   1HB   HIS  43          1HB       HIS  43   1.840  -1.923  -7.401
  350   2HB   HIS  43          2HB       HIS  43   2.473  -2.416  -8.981
  351    HD1  HIS  43           HD1      HIS  43   3.241  -4.875  -9.226
  352    HD2  HIS  43           HD2      HIS  43   2.034  -3.870  -5.373
  353    HE1  HIS  43           HE1      HIS  43   3.081  -7.055  -7.943
  354    H    LEU  44           H        LEU  44   3.110  -0.610  -5.527
  355    HA   LEU  44           HA       LEU  44   2.701   1.957  -6.926
  356   1HB   LEU  44          1HB       LEU  44   2.051   1.162  -4.082
  357   2HB   LEU  44          2HB       LEU  44   1.552   2.643  -4.875
  358    HG   LEU  44           HG       LEU  44   0.282  -0.020  -4.945
  359   1HD1  LEU  44          1HD1      LEU  44  -0.411   2.648  -4.811
  360   2HD1  LEU  44          2HD1      LEU  44  -0.885   2.235  -6.449
  361   3HD1  LEU  44          3HD1      LEU  44  -1.543   1.320  -5.099
  362   1HD2  LEU  44          1HD2      LEU  44   1.330   1.050  -7.528
  363   2HD2  LEU  44          2HD2      LEU  44   0.743  -0.560  -7.126
  364   3HD2  LEU  44          3HD2      LEU  44  -0.394   0.729  -7.484
  365    H    THR  45           H        THR  45   5.109   0.467  -4.997
  366    HA   THR  45           HA       THR  45   6.960   1.385  -3.837
  367    HB   THR  45           HB       THR  45   7.588   3.475  -5.587
  368    HG1  THR  45           HG1      THR  45   6.050   3.045  -7.031
  369   1HG2  THR  45          1HG2      THR  45   8.214   0.511  -5.560
  370   2HG2  THR  45          2HG2      THR  45   9.044   1.656  -6.619
  371   3HG2  THR  45          3HG2      THR  45   9.183   1.812  -4.866
  372    H    ALA  46           H        ALA  46   4.316   2.797  -3.181
  373    HA   ALA  46           HA       ALA  46   3.645   4.806  -2.151
  374   1HB   ALA  46          1HB       ALA  46   4.832   4.580  -0.228
  375   2HB   ALA  46          2HB       ALA  46   5.972   5.724  -0.927
  376   3HB   ALA  46          3HB       ALA  46   6.259   3.989  -1.075
  377    H    ARG  47           H        ARG  47   3.917   5.279  -4.608
  378    HA   ARG  47           HA       ARG  47   5.309   6.660  -6.228
  379   1HB   ARG  47          1HB       ARG  47   3.368   8.619  -5.631
  380   2HB   ARG  47          2HB       ARG  47   3.265   7.397  -6.861
  381   1HG   ARG  47          1HG       ARG  47   2.657   6.595  -4.009
  382   2HG   ARG  47          2HG       ARG  47   1.468   7.574  -4.851
  383   1HD   ARG  47          1HD       ARG  47   2.637   4.974  -5.930
  384   2HD   ARG  47          2HD       ARG  47   1.100   5.087  -5.084
  385    HE   ARG  47           HE       ARG  47   0.586   6.823  -7.030
  386   1HH1  ARG  47          1HH1      ARG  47   1.745   3.613  -7.009
  387   2HH1  ARG  47          2HH1      ARG  47   1.687   3.421  -8.730
  388   1HH2  ARG  47          1HH2      ARG  47   0.794   6.717  -9.332
  389   2HH2  ARG  47          2HH2      ARG  47   1.148   5.179 -10.045
  390    H    ASN  48           H        ASN  48   3.963   9.166  -4.034
  391    HA   ASN  48           HA       ASN  48   6.678  10.403  -4.102
  392   1HB   ASN  48          1HB       ASN  48   4.892  12.299  -3.085
  393   2HB   ASN  48          2HB       ASN  48   5.511  12.230  -4.733
  394   2HD2  ASN  48          2HD2      ASN  48   4.232  10.416  -6.101
  395   1HD2  ASN  48          1HD2      ASN  48   2.563  10.522  -5.935
  396    H    ARG  49           H        ARG  49   5.090   8.501  -1.965
  397    HA   ARG  49           HA       ARG  49   5.245   8.270   0.382
  398   1HB   ARG  49          1HB       ARG  49   7.661   9.763  -0.469
  399   2HB   ARG  49          2HB       ARG  49   7.267   9.797   1.248
  400   1HG   ARG  49          1HG       ARG  49   7.445   7.445   1.443
  401   2HG   ARG  49          2HG       ARG  49   7.231   7.203  -0.294
  402   1HD   ARG  49          1HD       ARG  49   9.578   6.826   0.292
  403   2HD   ARG  49          2HD       ARG  49   9.454   8.302  -0.668
  404    HE   ARG  49           HE       ARG  49   9.273   9.058   2.054
  405   1HH1  ARG  49          1HH1      ARG  49  11.176   8.547   3.462
  406   2HH1  ARG  49          2HH1      ARG  49  12.718   8.715   2.692
  407   1HH2  ARG  49          1HH2      ARG  49  11.400   8.871  -0.510
  408   2HH2  ARG  49          2HH2      ARG  49  12.845   8.898   0.444
  409    HA   PRO  50           HA       PRO  50   3.459  11.820   2.182
  410   1HB   PRO  50          1HB       PRO  50   4.048  11.475   4.839
  411   2HB   PRO  50          2HB       PRO  50   2.837  10.515   3.978
  412   1HG   PRO  50          1HG       PRO  50   5.582   9.747   4.855
  413   2HG   PRO  50          2HG       PRO  50   4.172   8.718   4.569
  414   1HD   PRO  50          1HD       PRO  50   6.376   9.093   2.811
  415   2HD   PRO  50          2HD       PRO  50   4.849   8.275   2.419
  416    HA   PRO  51           HA       PRO  51   6.911  14.673   2.451
  417   1HB   PRO  51          1HB       PRO  51   5.373  16.952   2.328
  418   2HB   PRO  51          2HB       PRO  51   5.817  15.992   0.908
  419   1HG   PRO  51          1HG       PRO  51   3.196  16.153   2.338
  420   2HG   PRO  51          2HG       PRO  51   3.523  15.785   0.637
  421   1HD   PRO  51          1HD       PRO  51   2.904  13.896   2.651
  422   2HD   PRO  51          2HD       PRO  51   3.581  13.527   1.049
  423    H    LEU  52           H        LEU  52   7.472  14.241   4.690
  424    HA   LEU  52           HA       LEU  52   5.976  15.895   6.685
  425   1HB   LEU  52          1HB       LEU  52   7.348  13.234   6.856
  426   2HB   LEU  52          2HB       LEU  52   7.307  14.255   8.293
  427    HG   LEU  52           HG       LEU  52   5.371  12.794   8.339
  428   1HD1  LEU  52          1HD1      LEU  52   5.352  12.357   5.867
  429   2HD1  LEU  52          2HD1      LEU  52   3.753  12.731   6.514
  430   3HD1  LEU  52          3HD1      LEU  52   4.654  13.961   5.630
  431   1HD2  LEU  52          1HD2      LEU  52   5.193  15.339   8.875
  432   2HD2  LEU  52          2HD2      LEU  52   4.285  15.437   7.366
  433   3HD2  LEU  52          3HD2      LEU  52   3.696  14.424   8.684
  434    HA   PRO  53           HA       PRO  53  10.111  17.834   6.361
  435   1HB   PRO  53          1HB       PRO  53   9.135  20.404   6.427
  436   2HB   PRO  53          2HB       PRO  53   9.329  19.470   4.933
  437   1HG   PRO  53          1HG       PRO  53   6.832  20.132   6.437
  438   2HG   PRO  53          2HG       PRO  53   7.043  19.797   4.712
  439   1HD   PRO  53          1HD       PRO  53   6.043  17.985   6.653
  440   2HD   PRO  53          2HD       PRO  53   6.566  17.569   5.008
  441    H    ALA  54           H        ALA  54  10.486  20.168   7.837
  442    HA   ALA  54           HA       ALA  54   9.278  20.404  10.341
  443   1HB   ALA  54          1HB       ALA  54  10.626  17.890  10.025
  444   2HB   ALA  54          2HB       ALA  54  11.469  18.839  11.255
  445   3HB   ALA  54          3HB       ALA  54   9.746  18.493  11.433
  446    H    GLY  55           H        GLY  55  11.095  21.057  12.096
  447   1HA   GLY  55          1HA       GLY  55  12.339  23.385  11.368
  448   2HA   GLY  55          2HA       GLY  55  13.528  22.168  10.902
  449    H    THR  56           H        THR  56  12.475  20.449  13.207
  450    HA   THR  56           HA       THR  56  13.552  22.012  15.503
  451    HB   THR  56           HB       THR  56  12.458  20.447  16.930
  452    HG1  THR  56           HG1      THR  56  11.354  18.647  15.532
  453   1HG2  THR  56          1HG2      THR  56  10.924  22.000  15.754
  454   2HG2  THR  56          2HG2      THR  56  10.712  20.806  14.474
  455   3HG2  THR  56          3HG2      THR  56  10.138  20.461  16.105

  No H/Q in entry =         455
  Start of MODEL    8
    1    H2   PRO   1           H2       PRO   1  -2.551  12.087 -10.524
    2    H3   PRO   1           H3       PRO   1  -1.363  11.083  -9.838
    3    HA   PRO   1           HA       PRO   1  -3.841  11.820  -8.754
    4   1HB   PRO   1          1HB       PRO   1  -3.947   8.975  -8.433
    5   2HB   PRO   1          2HB       PRO   1  -5.154  10.034  -9.151
    6   1HG   PRO   1          1HG       PRO   1  -3.430   8.180 -10.461
    7   2HG   PRO   1          2HG       PRO   1  -4.672   9.221 -11.166
    8   1HD   PRO   1          1HD       PRO   1  -1.794   9.492 -11.288
    9   2HD   PRO   1          2HD       PRO   1  -2.985  10.548 -12.050
   10    H    GLU   2           H        GLU   2  -3.832   9.765  -6.732
   11    HA   GLU   2           HA       GLU   2  -1.062   9.624  -5.726
   12   1HB   GLU   2          1HB       GLU   2  -1.843  10.682  -3.521
   13   2HB   GLU   2          2HB       GLU   2  -1.593  11.787  -4.874
   14   1HG   GLU   2          1HG       GLU   2  -3.760  12.404  -4.846
   15   2HG   GLU   2          2HG       GLU   2  -4.288  10.722  -4.918
   16    H    PHE   3           H        PHE   3  -0.914   8.237  -3.827
   17    HA   PHE   3           HA       PHE   3  -3.332   6.670  -3.129
   18   1HB   PHE   3          1HB       PHE   3  -2.645   5.143  -4.759
   19   2HB   PHE   3          2HB       PHE   3  -0.993   5.763  -4.743
   20    HD1  PHE   3           HD1      PHE   3  -3.138   3.124  -3.546
   21    HD2  PHE   3           HD2      PHE   3   0.499   5.261  -2.888
   22    HE1  PHE   3           HE1      PHE   3  -2.291   1.253  -2.209
   23    HE2  PHE   3           HE2      PHE   3   1.367   3.395  -1.604
   24    HZ   PHE   3           HZ       PHE   3  -0.024   1.338  -1.275
   25    H    LEU   4           H        LEU   4  -2.376   4.906  -1.376
   26    HA   LEU   4           HA       LEU   4  -1.395   6.517   0.792
   27   1HB   LEU   4          1HB       LEU   4  -1.132   3.515   0.716
   28   2HB   LEU   4          2HB       LEU   4  -1.363   4.552   2.110
   29    HG   LEU   4           HG       LEU   4  -3.478   4.745   0.059
   30   1HD1  LEU   4          1HD1      LEU   4  -2.552   2.179   1.216
   31   2HD1  LEU   4          2HD1      LEU   4  -4.290   2.466   1.272
   32   3HD1  LEU   4          3HD1      LEU   4  -3.449   2.477  -0.276
   33   1HD2  LEU   4          1HD2      LEU   4  -3.085   5.252   2.802
   34   2HD2  LEU   4          2HD2      LEU   4  -4.564   5.489   1.873
   35   3HD2  LEU   4          3HD2      LEU   4  -4.280   3.966   2.709
   36    H    GLU   5           H        GLU   5   0.560   7.473  -0.064
   37    HA   GLU   5           HA       GLU   5   2.760   5.853  -0.952
   38   1HB   GLU   5          1HB       GLU   5   2.738   8.641   0.246
   39   2HB   GLU   5          2HB       GLU   5   4.120   7.899  -0.560
   40   1HG   GLU   5          1HG       GLU   5   2.983   7.857  -2.680
   41   2HG   GLU   5          2HG       GLU   5   1.432   8.201  -1.942
   42    H    ASP   6           H        ASP   6   1.267   6.304   2.019
   43    HA   ASP   6           HA       ASP   6   3.284   4.686   3.394
   44   1HB   ASP   6          1HB       ASP   6   2.975   7.571   3.859
   45   2HB   ASP   6          2HB       ASP   6   2.697   6.619   5.319
   46    HA   PRO   7           HA       PRO   7  -1.136   3.774   4.265
   47   1HB   PRO   7          1HB       PRO   7  -0.858   1.057   3.943
   48   2HB   PRO   7          2HB       PRO   7  -1.239   2.166   2.619
   49   1HG   PRO   7          1HG       PRO   7   1.320   0.796   3.244
   50   2HG   PRO   7          2HG       PRO   7   0.701   1.385   1.695
   51   1HD   PRO   7          1HD       PRO   7   2.677   2.656   3.287
   52   2HD   PRO   7          2HD       PRO   7   1.816   3.389   1.917
   53    H    SER   8           H        SER   8   0.924   4.206   6.313
   54    HA   SER   8           HA       SER   8   0.947   1.835   8.025
   55   1HB   SER   8          1HB       SER   8   2.858   3.041   8.464
   56   2HB   SER   8          2HB       SER   8   2.083   4.589   8.124
   57    HG   SER   8           HG       SER   8   1.973   4.742  10.207
   58    H    VAL   9           H        VAL   9  -1.359   4.148   7.313
   59    HA   VAL   9           HA       VAL   9  -2.503   4.101  10.061
   60    HB   VAL   9           HB       VAL   9  -3.905   5.934   9.374
   61   1HG1  VAL   9          1HG1      VAL   9  -4.300   4.940   7.065
   62   2HG1  VAL   9          2HG1      VAL   9  -4.086   6.690   7.107
   63   3HG1  VAL   9          3HG1      VAL   9  -2.759   5.651   6.589
   64   1HG2  VAL   9          1HG2      VAL   9  -1.050   6.164   8.392
   65   2HG2  VAL   9          2HG2      VAL   9  -2.142   7.546   8.489
   66   3HG2  VAL   9          3HG2      VAL   9  -1.698   6.669   9.953
   67    H    LEU  10           H        LEU  10  -2.728   2.448   7.138
   68    HA   LEU  10           HA       LEU  10  -5.552   1.638   7.742
   69   1HB   LEU  10          1HB       LEU  10  -5.193   0.648   5.258
   70   2HB   LEU  10          2HB       LEU  10  -5.770   2.308   5.504
   71    HG   LEU  10           HG       LEU  10  -2.822   1.678   5.387
   72   1HD1  LEU  10          1HD1      LEU  10  -4.651   2.225   3.072
   73   2HD1  LEU  10          2HD1      LEU  10  -2.914   2.315   2.977
   74   3HD1  LEU  10          3HD1      LEU  10  -3.699   0.781   3.320
   75   1HD2  LEU  10          1HD2      LEU  10  -4.571   4.071   5.361
   76   2HD2  LEU  10          2HD2      LEU  10  -2.948   3.876   6.018
   77   3HD2  LEU  10          3HD2      LEU  10  -3.175   4.125   4.291
   78    H    THR  11           H        THR  11  -5.858  -0.269   8.329
   79    HA   THR  11           HA       THR  11  -4.063  -2.244   9.100
   80    HB   THR  11           HB       THR  11  -6.377  -2.482   9.645
   81    HG1  THR  11           HG1      THR  11  -6.569  -4.525   9.170
   82   1HG2  THR  11          1HG2      THR  11  -6.721  -2.074   6.668
   83   2HG2  THR  11          2HG2      THR  11  -8.047  -2.687   7.672
   84   3HG2  THR  11          3HG2      THR  11  -7.370  -1.078   7.980
   85    H    LYS  12           H        LYS  12  -4.179  -4.524   7.859
   86    HA   LYS  12           HA       LYS  12  -2.975  -4.054   5.227
   87   1HB   LYS  12          1HB       LYS  12  -3.028  -6.198   7.157
   88   2HB   LYS  12          2HB       LYS  12  -3.462  -6.819   5.570
   89   1HG   LYS  12          1HG       LYS  12  -1.110  -6.985   5.541
   90   2HG   LYS  12          2HG       LYS  12  -1.400  -5.439   4.730
   91   1HD   LYS  12          1HD       LYS  12   0.370  -5.185   6.408
   92   2HD   LYS  12          2HD       LYS  12  -1.045  -4.238   6.858
   93   1HE   LYS  12          1HE       LYS  12  -1.614  -6.589   8.108
   94   2HE   LYS  12          2HE       LYS  12   0.145  -6.609   8.178
   95   1HZ   LYS  12          1HZ       LYS  12  -0.082  -4.223   8.989
   96   2HZ   LYS  12          2HZ       LYS  12  -1.717  -4.592   9.268
   97   3HZ   LYS  12          3HZ       LYS  12  -0.499  -5.457  10.075
   98    H    ASP  13           H        ASP  13  -6.063  -4.056   6.313
   99    HA   ASP  13           HA       ASP  13  -7.251  -5.603   4.099
  100   1HB   ASP  13          1HB       ASP  13  -7.951  -5.403   6.721
  101   2HB   ASP  13          2HB       ASP  13  -9.037  -4.217   5.991
  102    H    LYS  14           H        LYS  14  -6.647  -2.249   4.904
  103    HA   LYS  14           HA       LYS  14  -8.781  -1.360   3.057
  104   1HB   LYS  14          1HB       LYS  14  -8.170  -0.211   5.235
  105   2HB   LYS  14          2HB       LYS  14  -6.716   0.321   4.415
  106   1HG   LYS  14          1HG       LYS  14  -9.572   0.990   3.700
  107   2HG   LYS  14          2HG       LYS  14  -8.299   2.084   4.236
  108   1HD   LYS  14          1HD       LYS  14  -8.328   0.573   1.613
  109   2HD   LYS  14          2HD       LYS  14  -8.608   2.294   1.801
  110   1HE   LYS  14          1HE       LYS  14  -6.086   1.154   2.949
  111   2HE   LYS  14          2HE       LYS  14  -6.202   1.418   1.195
  112   1HZ   LYS  14          1HZ       LYS  14  -7.312   3.669   2.229
  113   2HZ   LYS  14          2HZ       LYS  14  -6.034   3.367   3.303
  114   3HZ   LYS  14          3HZ       LYS  14  -5.729   3.540   1.640
  115    H    LEU  15           H        LEU  15  -5.295  -0.838   3.450
  116    HA   LEU  15           HA       LEU  15  -4.578   0.374   1.117
  117   1HB   LEU  15          1HB       LEU  15  -2.712  -1.739   1.223
  118   2HB   LEU  15          2HB       LEU  15  -2.532  -0.114   1.921
  119    HG   LEU  15           HG       LEU  15  -3.562  -0.895   4.010
  120   1HD1  LEU  15          1HD1      LEU  15  -4.535  -2.979   2.353
  121   2HD1  LEU  15          2HD1      LEU  15  -3.436  -3.725   3.515
  122   3HD1  LEU  15          3HD1      LEU  15  -4.826  -2.760   4.092
  123   1HD2  LEU  15          1HD2      LEU  15  -1.064  -1.301   3.309
  124   2HD2  LEU  15          2HD2      LEU  15  -1.685  -2.077   4.767
  125   3HD2  LEU  15          3HD2      LEU  15  -1.547  -2.999   3.267
  126    H    LYS  16           H        LYS  16  -5.890  -2.861   1.352
  127    HA   LYS  16           HA       LYS  16  -5.132  -3.542  -1.351
  128   1HB   LYS  16          1HB       LYS  16  -7.304  -4.918   0.219
  129   2HB   LYS  16          2HB       LYS  16  -6.135  -5.581  -0.883
  130   1HG   LYS  16          1HG       LYS  16  -4.347  -5.133   0.743
  131   2HG   LYS  16          2HG       LYS  16  -5.577  -4.600   1.876
  132   1HD   LYS  16          1HD       LYS  16  -5.781  -7.259   0.512
  133   2HD   LYS  16          2HD       LYS  16  -4.867  -7.078   2.008
  134   1HE   LYS  16          1HE       LYS  16  -6.752  -7.069   3.207
  135   2HE   LYS  16          2HE       LYS  16  -7.431  -5.777   2.220
  136   1HZ   LYS  16          1HZ       LYS  16  -7.339  -8.513   1.155
  137   2HZ   LYS  16          2HZ       LYS  16  -8.557  -8.095   2.263
  138   3HZ   LYS  16          3HZ       LYS  16  -8.421  -7.254   0.796
  139    H    SER  17           H        SER  17  -8.181  -2.801   0.342
  140    HA   SER  17           HA       SER  17  -9.965  -2.772  -1.787
  141   1HB   SER  17          1HB       SER  17  -9.770  -1.394   0.767
  142   2HB   SER  17          2HB       SER  17 -10.615  -0.436  -0.440
  143    HG   SER  17           HG       SER  17 -11.185  -3.164   0.008
  144    H    GLU  18           H        GLU  18  -7.336  -0.634  -1.092
  145    HA   GLU  18           HA       GLU  18  -8.081   1.358  -3.107
  146   1HB   GLU  18          1HB       GLU  18  -5.671   0.930  -1.348
  147   2HB   GLU  18          2HB       GLU  18  -5.774   2.280  -2.465
  148   1HG   GLU  18          1HG       GLU  18  -7.876   1.656  -0.342
  149   2HG   GLU  18          2HG       GLU  18  -6.549   2.761  -0.043
  150    H    LEU  19           H        LEU  19  -5.208  -0.769  -2.679
  151    HA   LEU  19           HA       LEU  19  -3.920  -0.574  -5.049
  152   1HB   LEU  19          1HB       LEU  19  -4.574  -2.975  -3.394
  153   2HB   LEU  19          2HB       LEU  19  -3.753  -3.195  -4.914
  154    HG   LEU  19           HG       LEU  19  -2.622  -0.990  -3.360
  155   1HD1  LEU  19          1HD1      LEU  19  -1.901  -2.553  -5.405
  156   2HD1  LEU  19          2HD1      LEU  19  -0.710  -1.827  -4.324
  157   3HD1  LEU  19          3HD1      LEU  19  -1.208  -3.509  -4.095
  158   1HD2  LEU  19          1HD2      LEU  19  -3.173  -3.608  -2.103
  159   2HD2  LEU  19          2HD2      LEU  19  -1.480  -3.128  -2.034
  160   3HD2  LEU  19          3HD2      LEU  19  -2.719  -2.081  -1.341
  161    H    VAL  20           H        VAL  20  -7.046  -2.184  -4.631
  162    HA   VAL  20           HA       VAL  20  -7.230  -3.314  -7.247
  163    HB   VAL  20           HB       VAL  20  -9.303  -2.373  -5.254
  164   1HG1  VAL  20          1HG1      VAL  20  -7.908  -4.459  -4.877
  165   2HG1  VAL  20          2HG1      VAL  20  -9.650  -4.726  -4.907
  166   3HG1  VAL  20          3HG1      VAL  20  -8.671  -5.139  -6.314
  167   1HG2  VAL  20          1HG2      VAL  20  -9.625  -3.153  -8.104
  168   2HG2  VAL  20          2HG2      VAL  20 -10.732  -3.915  -6.962
  169   3HG2  VAL  20          3HG2      VAL  20 -10.665  -2.157  -7.086
  170    H    ALA  21           H        ALA  21  -8.574  -0.237  -6.007
  171    HA   ALA  21           HA       ALA  21  -9.465   0.780  -8.502
  172   1HB   ALA  21          1HB       ALA  21  -9.221   3.031  -7.358
  173   2HB   ALA  21          2HB       ALA  21 -10.166   1.844  -6.458
  174   3HB   ALA  21          3HB       ALA  21  -8.495   2.176  -5.993
  175    H    ASN  22           H        ASN  22  -6.339   1.208  -6.861
  176    HA   ASN  22           HA       ASN  22  -5.257   2.854  -8.951
  177   1HB   ASN  22          1HB       ASN  22  -3.417   1.482  -6.985
  178   2HB   ASN  22          2HB       ASN  22  -3.487   3.137  -7.517
  179   2HD2  ASN  22          2HD2      ASN  22  -4.597   1.074  -4.981
  180   1HD2  ASN  22          1HD2      ASN  22  -5.589   2.205  -4.207
  181    H    ASN  23           H        ASN  23  -6.166   0.098  -9.738
  182    HA   ASN  23           HA       ASN  23  -5.494  -1.464 -11.332
  183   1HB   ASN  23          1HB       ASN  23  -4.525   0.519 -12.438
  184   2HB   ASN  23          2HB       ASN  23  -3.034   0.287 -11.525
  185   2HD2  ASN  23          2HD2      ASN  23  -1.531  -0.556 -12.993
  186   1HD2  ASN  23          1HD2      ASN  23  -1.835  -1.851 -14.051
  187    H    VAL  24           H        VAL  24  -5.265  -2.845  -9.271
  188    HA   VAL  24           HA       VAL  24  -2.711  -4.243  -9.455
  189    HB   VAL  24           HB       VAL  24  -3.561  -3.148  -6.768
  190   1HG1  VAL  24          1HG1      VAL  24  -1.527  -5.039  -7.773
  191   2HG1  VAL  24          2HG1      VAL  24  -0.884  -3.817  -6.678
  192   3HG1  VAL  24          3HG1      VAL  24  -2.192  -4.875  -6.149
  193   1HG2  VAL  24          1HG2      VAL  24  -1.406  -2.183  -8.673
  194   2HG2  VAL  24          2HG2      VAL  24  -2.833  -1.282  -8.162
  195   3HG2  VAL  24          3HG2      VAL  24  -1.563  -1.657  -6.998
  196    H    THR  25           H        THR  25  -3.327  -6.383  -9.437
  197    HA   THR  25           HA       THR  25  -6.000  -7.127  -8.666
  198    HB   THR  25           HB       THR  25  -4.490  -9.452  -8.728
  199    HG1  THR  25           HG1      THR  25  -2.688  -8.390  -9.459
  200   1HG2  THR  25          1HG2      THR  25  -5.975  -7.981 -10.912
  201   2HG2  THR  25          2HG2      THR  25  -5.466  -9.666 -11.027
  202   3HG2  THR  25          3HG2      THR  25  -6.640  -9.180  -9.803
  203    H    LEU  26           H        LEU  26  -6.524  -8.675  -6.997
  204    HA   LEU  26           HA       LEU  26  -4.758  -8.424  -4.595
  205   1HB   LEU  26          1HB       LEU  26  -7.752  -8.851  -4.699
  206   2HB   LEU  26          2HB       LEU  26  -6.805  -8.633  -3.249
  207    HG   LEU  26           HG       LEU  26  -8.075  -6.688  -4.778
  208   1HD1  LEU  26          1HD1      LEU  26  -5.107  -6.563  -5.073
  209   2HD1  LEU  26          2HD1      LEU  26  -6.353  -6.274  -6.284
  210   3HD1  LEU  26          3HD1      LEU  26  -6.065  -5.087  -5.012
  211   1HD2  LEU  26          1HD2      LEU  26  -7.063  -6.994  -2.226
  212   2HD2  LEU  26          2HD2      LEU  26  -6.183  -5.607  -2.882
  213   3HD2  LEU  26          3HD2      LEU  26  -7.946  -5.595  -2.837
  214    HA   PRO  27           HA       PRO  27  -4.625 -12.855  -5.278
  215   1HB   PRO  27          1HB       PRO  27  -2.637 -13.308  -3.425
  216   2HB   PRO  27          2HB       PRO  27  -2.336 -12.756  -5.081
  217   1HG   PRO  27          1HG       PRO  27  -2.204 -11.234  -2.520
  218   2HG   PRO  27          2HG       PRO  27  -1.369 -10.925  -4.050
  219   1HD   PRO  27          1HD       PRO  27  -3.667  -9.573  -3.082
  220   2HD   PRO  27          2HD       PRO  27  -3.003  -9.457  -4.721
  221    H    ALA  28           H        ALA  28  -3.589 -12.725  -1.934
  222    HA   ALA  28           HA       ALA  28  -5.574 -14.562  -1.048
  223   1HB   ALA  28          1HB       ALA  28  -3.395 -13.060   0.125
  224   2HB   ALA  28          2HB       ALA  28  -4.799 -13.041   1.196
  225   3HB   ALA  28          3HB       ALA  28  -4.113 -14.578   0.666
  226    H    GLY  29           H        GLY  29  -6.924 -13.716   1.084
  227   1HA   GLY  29          1HA       GLY  29  -9.249 -12.783   0.975
  228   2HA   GLY  29          2HA       GLY  29  -8.567 -11.448   0.041
  229    H    GLU  30           H        GLU  30  -7.832 -13.037   3.175
  230    HA   GLU  30           HA       GLU  30  -8.387 -10.637   4.686
  231   1HB   GLU  30          1HB       GLU  30  -7.709 -13.367   5.243
  232   2HB   GLU  30          2HB       GLU  30  -6.603 -12.324   6.137
  233   1HG   GLU  30          1HG       GLU  30  -8.914 -11.010   6.598
  234   2HG   GLU  30          2HG       GLU  30  -9.549 -12.644   6.407
  235    H    GLN  31           H        GLN  31  -5.247 -12.305   4.743
  236    HA   GLN  31           HA       GLN  31  -3.710 -10.287   3.506
  237   1HB   GLN  31          1HB       GLN  31  -4.427  -8.819   5.329
  238   2HB   GLN  31          2HB       GLN  31  -3.884  -9.999   6.515
  239   1HG   GLN  31          1HG       GLN  31  -1.589  -9.731   5.209
  240   2HG   GLN  31          2HG       GLN  31  -2.268  -8.170   4.794
  241   2HE2  GLN  31          2HE2      GLN  31  -3.887  -8.398   7.486
  242   1HE2  GLN  31          1HE2      GLN  31  -2.754  -7.977   8.674
  243    H    ARG  32           H        ARG  32  -2.710 -12.224   2.817
  244    HA   ARG  32           HA       ARG  32  -1.743 -14.413   3.929
  245   1HB   ARG  32          1HB       ARG  32  -1.148 -12.794   1.756
  246   2HB   ARG  32          2HB       ARG  32   0.394 -12.953   2.569
  247   1HG   ARG  32          1HG       ARG  32  -0.108 -15.479   2.627
  248   2HG   ARG  32          2HG       ARG  32  -1.397 -15.098   1.480
  249   1HD   ARG  32          1HD       ARG  32   1.427 -14.150   0.992
  250   2HD   ARG  32          2HD       ARG  32   0.936 -15.778   0.521
  251    HE   ARG  32           HE       ARG  32   0.055 -13.278  -0.738
  252   1HH1  ARG  32          1HH1      ARG  32  -0.790 -16.528   0.018
  253   2HH1  ARG  32          2HH1      ARG  32  -1.630 -16.799  -1.472
  254   1HH2  ARG  32          1HH2      ARG  32  -0.906 -13.662  -2.759
  255   2HH2  ARG  32          2HH2      ARG  32  -1.696 -15.176  -3.043
  256    H    LYS  33           H        LYS  33   0.255 -11.449   4.079
  257    HA   LYS  33           HA       LYS  33   0.801 -11.543   6.857
  258   1HB   LYS  33          1HB       LYS  33   2.163 -13.570   5.400
  259   2HB   LYS  33          2HB       LYS  33   3.362 -12.340   5.802
  260   1HG   LYS  33          1HG       LYS  33   1.416 -13.392   7.860
  261   2HG   LYS  33          2HG       LYS  33   2.958 -14.189   7.551
  262   1HD   LYS  33          1HD       LYS  33   4.192 -12.446   8.428
  263   2HD   LYS  33          2HD       LYS  33   2.994 -11.233   7.975
  264   1HE   LYS  33          1HE       LYS  33   2.005 -13.193   9.933
  265   2HE   LYS  33          2HE       LYS  33   3.353 -12.221  10.525
  266   1HZ   LYS  33          1HZ       LYS  33   2.041 -10.266   9.564
  267   2HZ   LYS  33          2HZ       LYS  33   0.712 -11.325   9.556
  268   3HZ   LYS  33          3HZ       LYS  33   1.495 -10.950  11.017
  269    H    ASP  34           H        ASP  34   0.359  -9.295   5.998
  270    HA   ASP  34           HA       ASP  34   1.250  -7.124   5.595
  271   1HB   ASP  34          1HB       ASP  34   3.434  -8.628   6.578
  272   2HB   ASP  34          2HB       ASP  34   4.025  -7.869   5.097
  273    H    VAL  35           H        VAL  35   0.952  -9.577   3.527
  274    HA   VAL  35           HA       VAL  35   2.510  -9.032   1.264
  275    HB   VAL  35           HB       VAL  35   1.215 -11.005   1.177
  276   1HG1  VAL  35          1HG1      VAL  35  -0.689  -9.336   2.552
  277   2HG1  VAL  35          2HG1      VAL  35  -1.460 -10.269   1.271
  278   3HG1  VAL  35          3HG1      VAL  35  -0.546 -11.094   2.529
  279   1HG2  VAL  35          1HG2      VAL  35   0.861  -9.132  -0.836
  280   2HG2  VAL  35          2HG2      VAL  35   0.300 -10.810  -0.911
  281   3HG2  VAL  35          3HG2      VAL  35  -0.797  -9.536  -0.380
  282    H    TYR  36           H        TYR  36  -0.489  -7.447   2.343
  283    HA   TYR  36           HA       TYR  36  -0.742  -6.031  -0.167
  284   1HB   TYR  36          1HB       TYR  36  -2.148  -5.866   2.475
  285   2HB   TYR  36          2HB       TYR  36  -2.585  -4.924   1.066
  286    HD1  TYR  36           HD1      TYR  36  -3.430  -6.029  -0.954
  287    HD2  TYR  36           HD2      TYR  36  -2.410  -8.254   2.559
  288    HE1  TYR  36           HE1      TYR  36  -4.652  -7.981  -1.854
  289    HE2  TYR  36           HE2      TYR  36  -3.627 -10.211   1.673
  290    HH   TYR  36           HH       TYR  36  -4.269 -10.853  -1.163
  291    H    VAL  37           H        VAL  37   0.696  -5.443   2.934
  292    HA   VAL  37           HA       VAL  37   0.907  -2.569   2.480
  293    HB   VAL  37           HB       VAL  37   2.024  -4.508   4.534
  294   1HG1  VAL  37          1HG1      VAL  37  -0.409  -3.693   4.557
  295   2HG1  VAL  37          2HG1      VAL  37   0.525  -3.367   6.026
  296   3HG1  VAL  37          3HG1      VAL  37   0.241  -2.076   4.864
  297   1HG2  VAL  37          1HG2      VAL  37   3.737  -2.769   4.095
  298   2HG2  VAL  37          2HG2      VAL  37   2.523  -1.513   4.336
  299   3HG2  VAL  37          3HG2      VAL  37   3.001  -2.547   5.683
  300    H    GLN  38           H        GLN  38   2.779  -5.472   1.945
  301    HA   GLN  38           HA       GLN  38   5.231  -4.095   1.144
  302   1HB   GLN  38          1HB       GLN  38   5.402  -6.342   2.120
  303   2HB   GLN  38          2HB       GLN  38   4.279  -6.979   0.926
  304   1HG   GLN  38          1HG       GLN  38   6.234  -7.560  -0.123
  305   2HG   GLN  38          2HG       GLN  38   6.077  -5.921  -0.747
  306   2HE2  GLN  38          2HE2      GLN  38   7.117  -7.129   2.488
  307   1HE2  GLN  38          1HE2      GLN  38   8.618  -6.330   2.471
  308    H    LEU  39           H        LEU  39   2.584  -5.887  -0.286
  309    HA   LEU  39           HA       LEU  39   3.201  -5.750  -3.041
  310   1HB   LEU  39          1HB       LEU  39   0.682  -5.965  -1.482
  311   2HB   LEU  39          2HB       LEU  39   0.467  -5.355  -3.114
  312    HG   LEU  39           HG       LEU  39   2.079  -7.837  -2.563
  313   1HD1  LEU  39          1HD1      LEU  39  -0.449  -7.810  -1.802
  314   2HD1  LEU  39          2HD1      LEU  39  -0.769  -7.851  -3.533
  315   3HD1  LEU  39          3HD1      LEU  39   0.148  -9.154  -2.779
  316   1HD2  LEU  39          1HD2      LEU  39   0.904  -6.369  -4.910
  317   2HD2  LEU  39          2HD2      LEU  39   2.518  -7.071  -4.729
  318   3HD2  LEU  39          3HD2      LEU  39   1.129  -8.119  -5.012
  319    H    TYR  40           H        TYR  40   1.395  -3.411  -1.050
  320    HA   TYR  40           HA       TYR  40   0.983  -1.428  -2.961
  321   1HB   TYR  40          1HB       TYR  40   0.015  -0.561  -1.117
  322   2HB   TYR  40          2HB       TYR  40   0.843  -1.743  -0.118
  323    HD1  TYR  40           HD1      TYR  40   1.759   1.389  -1.997
  324    HD2  TYR  40           HD2      TYR  40   2.145  -0.920   1.594
  325    HE1  TYR  40           HE1      TYR  40   3.173   3.164  -1.009
  326    HE2  TYR  40           HE2      TYR  40   3.575   0.853   2.579
  327    HH   TYR  40           HH       TYR  40   3.659   3.712   1.876
  328    H    LEU  41           H        LEU  41   3.748  -1.547  -0.620
  329    HA   LEU  41           HA       LEU  41   5.117   0.596  -1.893
  330   1HB   LEU  41          1HB       LEU  41   5.516  -0.870   0.381
  331   2HB   LEU  41          2HB       LEU  41   6.807  -1.494  -0.641
  332    HG   LEU  41           HG       LEU  41   7.340   1.012  -1.126
  333   1HD1  LEU  41          1HD1      LEU  41   8.171  -0.835   0.859
  334   2HD1  LEU  41          2HD1      LEU  41   9.085   0.521   0.200
  335   3HD1  LEU  41          3HD1      LEU  41   8.088   0.745   1.637
  336   1HD2  LEU  41          1HD2      LEU  41   5.486   1.182   1.270
  337   2HD2  LEU  41          2HD2      LEU  41   6.765   2.370   1.020
  338   3HD2  LEU  41          3HD2      LEU  41   5.498   2.179  -0.188
  339    H    GLN  42           H        GLN  42   4.671  -2.643  -2.947
  340    HA   GLN  42           HA       GLN  42   7.138  -2.810  -4.490
  341   1HB   GLN  42          1HB       GLN  42   5.432  -4.681  -3.583
  342   2HB   GLN  42          2HB       GLN  42   4.856  -4.543  -5.241
  343   1HG   GLN  42          1HG       GLN  42   6.583  -6.226  -5.220
  344   2HG   GLN  42          2HG       GLN  42   7.257  -4.792  -5.996
  345   2HE2  GLN  42          2HE2      GLN  42   8.960  -3.651  -4.888
  346   1HE2  GLN  42          1HE2      GLN  42   9.672  -4.235  -3.461
  347    H    HIS  43           H        HIS  43   3.722  -2.767  -5.626
  348    HA   HIS  43           HA       HIS  43   4.580  -1.865  -8.285
  349   1HB   HIS  43          1HB       HIS  43   1.735  -1.791  -7.311
  350   2HB   HIS  43          2HB       HIS  43   2.348  -2.177  -8.931
  351    HD1  HIS  43           HD1      HIS  43   3.120  -4.605  -9.361
  352    HD2  HIS  43           HD2      HIS  43   1.899  -3.891  -5.448
  353    HE1  HIS  43           HE1      HIS  43   2.947  -6.875  -8.250
  354    H    LEU  44           H        LEU  44   3.042  -0.540  -5.442
  355    HA   LEU  44           HA       LEU  44   2.655   2.060  -6.766
  356   1HB   LEU  44          1HB       LEU  44   2.122   1.258  -3.899
  357   2HB   LEU  44          2HB       LEU  44   1.584   2.727  -4.689
  358    HG   LEU  44           HG       LEU  44   0.350   0.023  -4.726
  359   1HD1  LEU  44          1HD1      LEU  44  -0.376   2.557  -4.240
  360   2HD1  LEU  44          2HD1      LEU  44  -0.916   2.434  -5.903
  361   3HD1  LEU  44          3HD1      LEU  44  -1.526   1.303  -4.695
  362   1HD2  LEU  44          1HD2      LEU  44   1.160   1.306  -7.307
  363   2HD2  LEU  44          2HD2      LEU  44   0.662  -0.352  -6.989
  364   3HD2  LEU  44          3HD2      LEU  44  -0.545   0.918  -7.157
  365    H    THR  45           H        THR  45   5.031   0.495  -4.730
  366    HA   THR  45           HA       THR  45   6.948   1.390  -3.677
  367    HB   THR  45           HB       THR  45   7.654   3.426  -5.424
  368    HG1  THR  45           HG1      THR  45   6.632   3.103  -7.220
  369   1HG2  THR  45          1HG2      THR  45   8.069   0.428  -5.477
  370   2HG2  THR  45          2HG2      THR  45   8.930   1.525  -6.559
  371   3HG2  THR  45          3HG2      THR  45   9.156   1.651  -4.813
  372    H    ALA  46           H        ALA  46   4.290   2.879  -3.102
  373    HA   ALA  46           HA       ALA  46   3.652   4.894  -2.101
  374   1HB   ALA  46          1HB       ALA  46   5.084   4.050  -0.289
  375   2HB   ALA  46          2HB       ALA  46   5.326   5.789  -0.464
  376   3HB   ALA  46          3HB       ALA  46   6.520   4.662  -1.106
  377    H    ARG  47           H        ARG  47   4.057   5.322  -4.587
  378    HA   ARG  47           HA       ARG  47   5.621   6.605  -6.139
  379   1HB   ARG  47          1HB       ARG  47   3.700   8.662  -5.735
  380   2HB   ARG  47          2HB       ARG  47   3.674   7.414  -6.953
  381   1HG   ARG  47          1HG       ARG  47   2.804   6.777  -4.139
  382   2HG   ARG  47          2HG       ARG  47   1.710   7.667  -5.174
  383   1HD   ARG  47          1HD       ARG  47   2.245   4.859  -5.138
  384   2HD   ARG  47          2HD       ARG  47   1.097   5.708  -6.158
  385    HE   ARG  47           HE       ARG  47   3.940   5.584  -6.996
  386   1HH1  ARG  47          1HH1      ARG  47   0.833   6.049  -8.054
  387   2HH1  ARG  47          2HH1      ARG  47   0.910   4.941  -9.382
  388   1HH2  ARG  47          1HH2      ARG  47   3.963   3.600  -8.432
  389   2HH2  ARG  47          2HH2      ARG  47   2.682   3.554  -9.596
  390    H    ASN  48           H        ASN  48   4.267   9.191  -4.061
  391    HA   ASN  48           HA       ASN  48   6.966  10.416  -4.086
  392   1HB   ASN  48          1HB       ASN  48   5.030  11.926  -2.520
  393   2HB   ASN  48          2HB       ASN  48   5.866  12.382  -4.008
  394   2HD2  ASN  48          2HD2      ASN  48   4.974  10.662  -5.883
  395   1HD2  ASN  48          1HD2      ASN  48   3.303  10.775  -6.035
  396    H    ARG  49           H        ARG  49   7.427   8.337  -2.678
  397    HA   ARG  49           HA       ARG  49   6.783   7.823  -0.091
  398   1HB   ARG  49          1HB       ARG  49   9.564   8.126  -1.214
  399   2HB   ARG  49          2HB       ARG  49   9.275   7.624   0.445
  400   1HG   ARG  49          1HG       ARG  49   8.213   5.624  -0.211
  401   2HG   ARG  49          2HG       ARG  49   7.866   6.230  -1.831
  402   1HD   ARG  49          1HD       ARG  49   9.726   4.560  -1.806
  403   2HD   ARG  49          2HD       ARG  49  10.242   6.134  -2.411
  404    HE   ARG  49           HE       ARG  49  10.663   5.727   0.468
  405   1HH1  ARG  49          1HH1      ARG  49  11.955   4.363  -2.309
  406   2HH1  ARG  49          2HH1      ARG  49  13.581   4.892  -2.028
  407   1HH2  ARG  49          1HH2      ARG  49  12.739   6.916   0.660
  408   2HH2  ARG  49          2HH2      ARG  49  14.025   6.337  -0.346
  409    HA   PRO  50           HA       PRO  50   7.613  11.408   2.267
  410   1HB   PRO  50          1HB       PRO  50   7.815  10.268   4.760
  411   2HB   PRO  50          2HB       PRO  50   6.273  10.515   3.925
  412   1HG   PRO  50          1HG       PRO  50   7.806   7.992   4.349
  413   2HG   PRO  50          2HG       PRO  50   6.074   8.213   4.065
  414   1HD   PRO  50          1HD       PRO  50   8.020   7.388   2.150
  415   2HD   PRO  50          2HD       PRO  50   6.329   7.829   1.826
  416    HA   PRO  51           HA       PRO  51  12.080  11.103   2.498
  417   1HB   PRO  51          1HB       PRO  51  12.517  13.816   2.565
  418   2HB   PRO  51          2HB       PRO  51  12.227  12.904   1.076
  419   1HG   PRO  51          1HG       PRO  51  10.386  14.722   2.566
  420   2HG   PRO  51          2HG       PRO  51  10.401  14.310   0.844
  421   1HD   PRO  51          1HD       PRO  51   8.658  13.240   2.806
  422   2HD   PRO  51          2HD       PRO  51   8.877  12.620   1.159
  423    H    LEU  52           H        LEU  52  11.997  10.226   4.694
  424    HA   LEU  52           HA       LEU  52  11.453  11.825   7.003
  425   1HB   LEU  52          1HB       LEU  52  13.071   9.290   6.644
  426   2HB   LEU  52          2HB       LEU  52  12.723  10.003   8.219
  427    HG   LEU  52           HG       LEU  52  10.233   9.966   7.017
  428   1HD1  LEU  52          1HD1      LEU  52  11.206   8.600   5.155
  429   2HD1  LEU  52          2HD1      LEU  52  11.667   7.374   6.336
  430   3HD1  LEU  52          3HD1      LEU  52   9.962   7.729   6.054
  431   1HD2  LEU  52          1HD2      LEU  52  11.536   7.843   8.760
  432   2HD2  LEU  52          2HD2      LEU  52  10.759   9.317   9.339
  433   3HD2  LEU  52          3HD2      LEU  52   9.797   8.061   8.556
  434    HA   PRO  53           HA       PRO  53  15.233  14.119   7.212
  435   1HB   PRO  53          1HB       PRO  53  14.912  15.040   9.784
  436   2HB   PRO  53          2HB       PRO  53  14.041  15.706   8.392
  437   1HG   PRO  53          1HG       PRO  53  13.048  13.904  10.562
  438   2HG   PRO  53          2HG       PRO  53  12.153  15.074   9.581
  439   1HD   PRO  53          1HD       PRO  53  12.185  12.266   9.203
  440   2HD   PRO  53          2HD       PRO  53  11.577  13.469   8.047
  441    H    ALA  54           H        ALA  54  16.659  14.455   9.658
  442    HA   ALA  54           HA       ALA  54  17.207  11.936  10.932
  443   1HB   ALA  54          1HB       ALA  54  18.220  12.223   8.316
  444   2HB   ALA  54          2HB       ALA  54  18.638  10.967   9.489
  445   3HB   ALA  54          3HB       ALA  54  19.602  12.444   9.396
  446    H    GLY  55           H        GLY  55  18.395  15.118   9.936
  447   1HA   GLY  55          1HA       GLY  55  20.221  15.232  12.260
  448   2HA   GLY  55          2HA       GLY  55  18.845  16.337  12.293
  449    H    THR  56           H        THR  56  20.827  15.308   9.508
  450    HA   THR  56           HA       THR  56  20.951  17.782   8.231
  451    HB   THR  56           HB       THR  56  21.986  18.861  10.068
  452    HG1  THR  56           HG1      THR  56  23.126  19.211   8.150
  453   1HG2  THR  56          1HG2      THR  56  23.641  16.335  10.292
  454   2HG2  THR  56          2HG2      THR  56  24.027  17.814  11.173
  455   3HG2  THR  56          3HG2      THR  56  22.501  16.981  11.473

  No H/Q in entry =         455
  Start of MODEL    9
    1    H2   PRO   1           H2       PRO   1  -5.546   8.327  -7.908
    2    H3   PRO   1           H3       PRO   1  -4.902   7.913  -9.426
    3    HA   PRO   1           HA       PRO   1  -3.110   9.139  -9.016
    4   1HB   PRO   1          1HB       PRO   1  -4.213  11.682  -8.283
    5   2HB   PRO   1          2HB       PRO   1  -3.515  11.203  -9.836
    6   1HG   PRO   1          1HG       PRO   1  -6.264  11.675  -9.217
    7   2HG   PRO   1          2HG       PRO   1  -5.569  11.163 -10.763
    8   1HD   PRO   1          1HD       PRO   1  -7.089   9.599  -8.825
    9   2HD   PRO   1          2HD       PRO   1  -6.505   9.071 -10.409
   10    H    GLU   2           H        GLU   2  -1.764   9.636  -7.261
   11    HA   GLU   2           HA       GLU   2  -1.129   9.854  -5.011
   12   1HB   GLU   2          1HB       GLU   2  -3.143  11.663  -5.327
   13   2HB   GLU   2          2HB       GLU   2  -3.836  10.622  -4.082
   14   1HG   GLU   2          1HG       GLU   2  -1.893  10.937  -2.661
   15   2HG   GLU   2          2HG       GLU   2  -1.056  11.824  -3.934
   16    H    PHE   3           H        PHE   3  -0.836   8.032  -3.845
   17    HA   PHE   3           HA       PHE   3  -3.231   6.482  -2.991
   18   1HB   PHE   3          1HB       PHE   3  -2.621   4.980  -4.652
   19   2HB   PHE   3          2HB       PHE   3  -0.971   5.600  -4.717
   20    HD1  PHE   3           HD1      PHE   3  -3.001   2.893  -3.588
   21    HD2  PHE   3           HD2      PHE   3   0.563   5.114  -2.819
   22    HE1  PHE   3           HE1      PHE   3  -2.098   0.989  -2.335
   23    HE2  PHE   3           HE2      PHE   3   1.467   3.216  -1.577
   24    HZ   PHE   3           HZ       PHE   3   0.143   1.101  -1.361
   25    H    LEU   4           H        LEU   4  -2.711   5.066  -1.153
   26    HA   LEU   4           HA       LEU   4  -1.484   6.398   0.985
   27   1HB   LEU   4          1HB       LEU   4  -1.207   3.949   1.920
   28   2HB   LEU   4          2HB       LEU   4  -2.822   4.577   1.622
   29    HG   LEU   4           HG       LEU   4  -1.755   3.462  -0.803
   30   1HD1  LEU   4          1HD1      LEU   4  -1.670   1.798   1.691
   31   2HD1  LEU   4          2HD1      LEU   4  -1.725   1.092   0.075
   32   3HD1  LEU   4          3HD1      LEU   4  -0.352   2.087   0.565
   33   1HD2  LEU   4          1HD2      LEU   4  -4.076   3.048   1.049
   34   2HD2  LEU   4          2HD2      LEU   4  -4.085   3.586  -0.630
   35   3HD2  LEU   4          3HD2      LEU   4  -3.794   1.888  -0.250
   36    H    GLU   5           H        GLU   5   0.577   7.239   0.215
   37    HA   GLU   5           HA       GLU   5   2.709   5.457  -0.647
   38   1HB   GLU   5          1HB       GLU   5   2.909   8.238   0.564
   39   2HB   GLU   5          2HB       GLU   5   4.163   7.402  -0.348
   40   1HG   GLU   5          1HG       GLU   5   3.244   8.688  -2.036
   41   2HG   GLU   5          2HG       GLU   5   2.234   7.251  -2.186
   42    H    ASP   6           H        ASP   6   1.183   5.912   2.290
   43    HA   ASP   6           HA       ASP   6   3.246   4.396   3.714
   44   1HB   ASP   6          1HB       ASP   6   2.822   7.291   4.124
   45   2HB   ASP   6          2HB       ASP   6   2.704   6.337   5.604
   46    HA   PRO   7           HA       PRO   7  -1.080   3.336   4.707
   47   1HB   PRO   7          1HB       PRO   7  -0.605   0.628   4.742
   48   2HB   PRO   7          2HB       PRO   7  -1.029   1.538   3.291
   49   1HG   PRO   7          1HG       PRO   7   1.608   0.439   4.107
   50   2HG   PRO   7          2HG       PRO   7   0.968   0.783   2.495
   51   1HD   PRO   7          1HD       PRO   7   2.816   2.392   3.925
   52   2HD   PRO   7          2HD       PRO   7   1.919   2.881   2.470
   53    H    SER   8           H        SER   8   1.051   4.064   6.703
   54    HA   SER   8           HA       SER   8   0.904   1.924   8.711
   55   1HB   SER   8          1HB       SER   8   2.955   3.271   8.548
   56   2HB   SER   8          2HB       SER   8   2.031   4.740   8.865
   57    HG   SER   8           HG       SER   8   2.650   4.232  10.839
   58    H    VAL   9           H        VAL   9  -1.378   3.878   7.612
   59    HA   VAL   9           HA       VAL   9  -2.490   4.433  10.328
   60    HB   VAL   9           HB       VAL   9  -3.789   6.283   9.169
   61   1HG1  VAL   9          1HG1      VAL   9  -3.451   5.416   6.870
   62   2HG1  VAL   9          2HG1      VAL   9  -2.882   7.077   7.028
   63   3HG1  VAL   9          3HG1      VAL   9  -1.725   5.747   7.013
   64   1HG2  VAL   9          1HG2      VAL   9  -0.999   6.165   9.968
   65   2HG2  VAL   9          2HG2      VAL   9  -1.251   7.408   8.742
   66   3HG2  VAL   9          3HG2      VAL   9  -2.180   7.447  10.241
   67    H    LEU  10           H        LEU  10  -2.971   2.885   7.272
   68    HA   LEU  10           HA       LEU  10  -5.877   2.595   7.766
   69   1HB   LEU  10          1HB       LEU  10  -5.423   0.984   5.581
   70   2HB   LEU  10          2HB       LEU  10  -5.829   2.696   5.469
   71    HG   LEU  10           HG       LEU  10  -2.958   1.796   5.749
   72   1HD1  LEU  10          1HD1      LEU  10  -4.416   0.968   3.637
   73   2HD1  LEU  10          2HD1      LEU  10  -3.943   2.565   3.061
   74   3HD1  LEU  10          3HD1      LEU  10  -2.723   1.388   3.519
   75   1HD2  LEU  10          1HD2      LEU  10  -4.397   4.299   5.510
   76   2HD2  LEU  10          2HD2      LEU  10  -2.687   4.037   5.851
   77   3HD2  LEU  10          3HD2      LEU  10  -3.250   4.117   4.182
   78    H    THR  11           H        THR  11  -3.757  -0.001   6.619
   79    HA   THR  11           HA       THR  11  -3.379  -1.679   8.721
   80    HB   THR  11           HB       THR  11  -5.623  -1.429   9.499
   81    HG1  THR  11           HG1      THR  11  -6.420  -3.483   9.281
   82   1HG2  THR  11          1HG2      THR  11  -6.186  -1.425   6.577
   83   2HG2  THR  11          2HG2      THR  11  -7.458  -2.055   7.633
   84   3HG2  THR  11          3HG2      THR  11  -6.880  -0.394   7.840
   85    H    LYS  12           H        LYS  12  -3.971  -4.117   7.980
   86    HA   LYS  12           HA       LYS  12  -3.086  -4.311   5.188
   87   1HB   LYS  12          1HB       LYS  12  -3.330  -6.140   7.509
   88   2HB   LYS  12          2HB       LYS  12  -3.610  -6.884   5.941
   89   1HG   LYS  12          1HG       LYS  12  -1.343  -7.114   5.973
   90   2HG   LYS  12          2HG       LYS  12  -1.356  -5.449   5.370
   91   1HD   LYS  12          1HD       LYS  12  -0.582  -4.636   7.377
   92   2HD   LYS  12          2HD       LYS  12  -1.659  -5.667   8.305
   93   1HE   LYS  12          1HE       LYS  12  -0.162  -7.587   8.014
   94   2HE   LYS  12          2HE       LYS  12   0.921  -6.609   7.015
   95   1HZ   LYS  12          1HZ       LYS  12   0.206  -5.806   9.766
   96   2HZ   LYS  12          2HZ       LYS  12   1.498  -6.859   9.457
   97   3HZ   LYS  12          3HZ       LYS  12   1.516  -5.285   8.818
   98    H    ASP  13           H        ASP  13  -5.671  -3.152   5.503
   99    HA   ASP  13           HA       ASP  13  -7.361  -5.173   4.129
  100   1HB   ASP  13          1HB       ASP  13  -7.807  -4.375   6.760
  101   2HB   ASP  13          2HB       ASP  13  -8.867  -3.318   5.828
  102    H    LYS  14           H        LYS  14  -7.046  -1.716   5.027
  103    HA   LYS  14           HA       LYS  14  -8.708  -0.756   2.880
  104   1HB   LYS  14          1HB       LYS  14  -8.012   0.366   5.063
  105   2HB   LYS  14          2HB       LYS  14  -6.520   0.761   4.229
  106   1HG   LYS  14          1HG       LYS  14  -9.311   1.459   3.287
  107   2HG   LYS  14          2HG       LYS  14  -8.158   2.578   4.032
  108   1HD   LYS  14          1HD       LYS  14  -7.862   1.149   1.380
  109   2HD   LYS  14          2HD       LYS  14  -8.041   2.843   1.661
  110   1HE   LYS  14          1HE       LYS  14  -5.760   1.349   2.838
  111   2HE   LYS  14          2HE       LYS  14  -5.654   2.067   1.243
  112   1HZ   LYS  14          1HZ       LYS  14  -6.749   4.002   2.872
  113   2HZ   LYS  14          2HZ       LYS  14  -5.476   3.330   3.772
  114   3HZ   LYS  14          3HZ       LYS  14  -5.180   3.978   2.231
  115    H    LEU  15           H        LEU  15  -5.181  -0.695   3.353
  116    HA   LEU  15           HA       LEU  15  -4.316   0.352   0.977
  117   1HB   LEU  15          1HB       LEU  15  -2.646  -1.880   1.177
  118   2HB   LEU  15          2HB       LEU  15  -2.366  -0.300   1.902
  119    HG   LEU  15           HG       LEU  15  -3.497  -0.984   3.940
  120   1HD1  LEU  15          1HD1      LEU  15  -4.502  -3.037   2.210
  121   2HD1  LEU  15          2HD1      LEU  15  -3.670  -3.770   3.576
  122   3HD1  LEU  15          3HD1      LEU  15  -4.999  -2.627   3.866
  123   1HD2  LEU  15          1HD2      LEU  15  -1.071  -1.482   3.612
  124   2HD2  LEU  15          2HD2      LEU  15  -1.866  -2.619   4.700
  125   3HD2  LEU  15          3HD2      LEU  15  -1.521  -3.089   3.036
  126    H    LYS  16           H        LYS  16  -5.958  -2.731   1.338
  127    HA   LYS  16           HA       LYS  16  -5.263  -3.572  -1.361
  128   1HB   LYS  16          1HB       LYS  16  -7.421  -4.729   0.421
  129   2HB   LYS  16          2HB       LYS  16  -6.539  -5.495  -0.856
  130   1HG   LYS  16          1HG       LYS  16  -4.446  -5.231   0.499
  131   2HG   LYS  16          2HG       LYS  16  -5.485  -4.746   1.831
  132   1HD   LYS  16          1HD       LYS  16  -6.135  -7.232   0.304
  133   2HD   LYS  16          2HD       LYS  16  -4.860  -7.301   1.514
  134   1HE   LYS  16          1HE       LYS  16  -6.996  -7.968   2.495
  135   2HE   LYS  16          2HE       LYS  16  -6.463  -6.456   3.211
  136   1HZ   LYS  16          1HZ       LYS  16  -8.181  -6.391   0.831
  137   2HZ   LYS  16          2HZ       LYS  16  -8.884  -6.724   2.342
  138   3HZ   LYS  16          3HZ       LYS  16  -8.053  -5.269   2.097
  139    H    SER  17           H        SER  17  -8.205  -2.493   0.362
  140    HA   SER  17           HA       SER  17 -10.034  -2.524  -1.730
  141   1HB   SER  17          1HB       SER  17  -9.628  -0.700   0.590
  142   2HB   SER  17          2HB       SER  17 -10.863  -0.316  -0.595
  143    HG   SER  17           HG       SER  17 -11.527  -1.668   1.228
  144    H    GLU  18           H        GLU  18  -7.226  -0.577  -1.338
  145    HA   GLU  18           HA       GLU  18  -8.036   1.309  -3.462
  146   1HB   GLU  18          1HB       GLU  18  -5.299   1.320  -2.301
  147   2HB   GLU  18          2HB       GLU  18  -6.328   2.669  -2.725
  148   1HG   GLU  18          1HG       GLU  18  -6.478   0.914  -0.271
  149   2HG   GLU  18          2HG       GLU  18  -6.279   2.655  -0.324
  150    H    LEU  19           H        LEU  19  -5.140  -0.744  -2.819
  151    HA   LEU  19           HA       LEU  19  -3.806  -0.775  -5.166
  152   1HB   LEU  19          1HB       LEU  19  -4.595  -3.095  -3.424
  153   2HB   LEU  19          2HB       LEU  19  -3.749  -3.404  -4.913
  154    HG   LEU  19           HG       LEU  19  -2.550  -1.213  -3.389
  155   1HD1  LEU  19          1HD1      LEU  19  -1.810  -3.738  -4.817
  156   2HD1  LEU  19          2HD1      LEU  19  -1.283  -2.084  -5.140
  157   3HD1  LEU  19          3HD1      LEU  19  -0.622  -2.971  -3.764
  158   1HD2  LEU  19          1HD2      LEU  19  -3.293  -3.718  -2.059
  159   2HD2  LEU  19          2HD2      LEU  19  -1.549  -3.455  -2.047
  160   3HD2  LEU  19          3HD2      LEU  19  -2.630  -2.245  -1.352
  161    H    VAL  20           H        VAL  20  -6.989  -2.242  -4.712
  162    HA   VAL  20           HA       VAL  20  -7.164  -3.381  -7.368
  163    HB   VAL  20           HB       VAL  20  -9.188  -2.687  -5.224
  164   1HG1  VAL  20          1HG1      VAL  20  -7.895  -5.164  -6.327
  165   2HG1  VAL  20          2HG1      VAL  20  -8.091  -4.663  -4.647
  166   3HG1  VAL  20          3HG1      VAL  20  -9.476  -5.273  -5.553
  167   1HG2  VAL  20          1HG2      VAL  20  -9.642  -3.103  -8.081
  168   2HG2  VAL  20          2HG2      VAL  20 -10.470  -4.313  -7.099
  169   3HG2  VAL  20          3HG2      VAL  20 -10.779  -2.598  -6.831
  170    H    ALA  21           H        ALA  21  -8.659  -0.505  -5.887
  171    HA   ALA  21           HA       ALA  21  -9.759   0.605  -8.255
  172   1HB   ALA  21          1HB       ALA  21  -9.823   2.709  -6.982
  173   2HB   ALA  21          2HB       ALA  21 -10.307   1.359  -5.955
  174   3HB   ALA  21          3HB       ALA  21  -8.683   2.042  -5.810
  175    H    ASN  22           H        ASN  22  -6.480   0.302  -7.331
  176    HA   ASN  22           HA       ASN  22  -5.683   2.606  -9.020
  177   1HB   ASN  22          1HB       ASN  22  -4.003   0.851  -7.197
  178   2HB   ASN  22          2HB       ASN  22  -3.489   2.372  -7.936
  179   2HD2  ASN  22          2HD2      ASN  22  -4.658   1.218  -4.991
  180   1HD2  ASN  22          1HD2      ASN  22  -5.542   2.577  -4.492
  181    H    ASN  23           H        ASN  23  -3.815  -0.408  -8.592
  182    HA   ASN  23           HA       ASN  23  -4.426  -1.398 -11.242
  183   1HB   ASN  23          1HB       ASN  23  -2.953   0.750 -11.551
  184   2HB   ASN  23          2HB       ASN  23  -1.633  -0.307 -11.047
  185   2HD2  ASN  23          2HD2      ASN  23  -0.575  -0.921 -12.952
  186   1HD2  ASN  23          1HD2      ASN  23  -1.354  -1.504 -14.346
  187    H    VAL  24           H        VAL  24  -4.382  -2.735  -8.857
  188    HA   VAL  24           HA       VAL  24  -2.122  -4.613  -9.277
  189    HB   VAL  24           HB       VAL  24  -2.908  -3.713  -6.506
  190   1HG1  VAL  24          1HG1      VAL  24  -1.104  -5.661  -7.662
  191   2HG1  VAL  24          2HG1      VAL  24  -0.202  -4.488  -6.700
  192   3HG1  VAL  24          3HG1      VAL  24  -1.518  -5.405  -5.966
  193   1HG2  VAL  24          1HG2      VAL  24  -1.137  -2.403  -8.506
  194   2HG2  VAL  24          2HG2      VAL  24  -2.041  -1.693  -7.169
  195   3HG2  VAL  24          3HG2      VAL  24  -0.515  -2.522  -6.862
  196    H    THR  25           H        THR  25  -2.787  -6.759  -8.986
  197    HA   THR  25           HA       THR  25  -5.643  -7.193  -8.576
  198    HB   THR  25           HB       THR  25  -4.332  -9.660  -8.547
  199    HG1  THR  25           HG1      THR  25  -3.054  -9.299 -10.532
  200   1HG2  THR  25          1HG2      THR  25  -5.743  -8.021 -10.637
  201   2HG2  THR  25          2HG2      THR  25  -5.116  -9.625 -11.019
  202   3HG2  THR  25          3HG2      THR  25  -6.334  -9.432  -9.759
  203    H    LEU  26           H        LEU  26  -6.395  -8.813  -6.964
  204    HA   LEU  26           HA       LEU  26  -4.819  -8.585  -4.432
  205   1HB   LEU  26          1HB       LEU  26  -7.798  -9.008  -4.761
  206   2HB   LEU  26          2HB       LEU  26  -6.966  -8.780  -3.243
  207    HG   LEU  26           HG       LEU  26  -8.113  -6.853  -4.871
  208   1HD1  LEU  26          1HD1      LEU  26  -5.132  -6.714  -4.954
  209   2HD1  LEU  26          2HD1      LEU  26  -6.285  -6.476  -6.266
  210   3HD1  LEU  26          3HD1      LEU  26  -6.108  -5.248  -5.013
  211   1HD2  LEU  26          1HD2      LEU  26  -7.119  -7.103  -2.253
  212   2HD2  LEU  26          2HD2      LEU  26  -8.193  -5.861  -2.887
  213   3HD2  LEU  26          3HD2      LEU  26  -6.445  -5.614  -2.929
  214    HA   PRO  27           HA       PRO  27  -4.639 -13.021  -5.192
  215   1HB   PRO  27          1HB       PRO  27  -2.636 -13.475  -3.352
  216   2HB   PRO  27          2HB       PRO  27  -2.337 -12.883  -4.995
  217   1HG   PRO  27          1HG       PRO  27  -2.274 -11.379  -2.422
  218   2HG   PRO  27          2HG       PRO  27  -1.369 -11.092  -3.915
  219   1HD   PRO  27          1HD       PRO  27  -3.648  -9.678  -3.083
  220   2HD   PRO  27          2HD       PRO  27  -2.983  -9.666  -4.722
  221    H    ALA  28           H        ALA  28  -3.894 -12.286  -1.765
  222    HA   ALA  28           HA       ALA  28  -5.806 -14.358  -0.935
  223   1HB   ALA  28          1HB       ALA  28  -3.482 -13.077   0.191
  224   2HB   ALA  28          2HB       ALA  28  -4.827 -12.970   1.327
  225   3HB   ALA  28          3HB       ALA  28  -4.305 -14.543   0.726
  226    H    GLY  29           H        GLY  29  -6.985 -13.574   1.293
  227   1HA   GLY  29          1HA       GLY  29  -9.214 -12.528   1.537
  228   2HA   GLY  29          2HA       GLY  29  -8.658 -11.253   0.446
  229    H    GLU  30           H        GLU  30  -8.486 -12.479   3.749
  230    HA   GLU  30           HA       GLU  30  -8.300 -10.014   5.027
  231   1HB   GLU  30          1HB       GLU  30  -8.325 -12.533   5.945
  232   2HB   GLU  30          2HB       GLU  30  -6.602 -12.209   6.135
  233   1HG   GLU  30          1HG       GLU  30  -7.795  -9.896   7.103
  234   2HG   GLU  30          2HG       GLU  30  -8.869 -11.174   7.672
  235    H    GLN  31           H        GLN  31  -5.426 -12.091   4.681
  236    HA   GLN  31           HA       GLN  31  -3.813 -10.318   3.243
  237   1HB   GLN  31          1HB       GLN  31  -4.111  -8.969   5.464
  238   2HB   GLN  31          2HB       GLN  31  -3.063 -10.186   6.176
  239   1HG   GLN  31          1HG       GLN  31  -1.426  -8.767   5.526
  240   2HG   GLN  31          2HG       GLN  31  -1.557  -9.541   3.990
  241   2HE2  GLN  31          2HE2      GLN  31  -4.414  -8.026   3.979
  242   1HE2  GLN  31          1HE2      GLN  31  -3.980  -6.502   3.396
  243    H    ARG  32           H        ARG  32  -2.370 -11.695   2.434
  244    HA   ARG  32           HA       ARG  32  -1.966 -14.326   3.341
  245   1HB   ARG  32          1HB       ARG  32  -0.897 -12.413   1.367
  246   2HB   ARG  32          2HB       ARG  32   0.253 -13.621   1.867
  247   1HG   ARG  32          1HG       ARG  32  -0.929 -15.352   0.887
  248   2HG   ARG  32          2HG       ARG  32  -2.484 -14.564   1.150
  249   1HD   ARG  32          1HD       ARG  32  -2.050 -14.491  -1.227
  250   2HD   ARG  32          2HD       ARG  32  -1.808 -12.849  -0.614
  251    HE   ARG  32           HE       ARG  32   0.713 -13.687  -0.493
  252   1HH1  ARG  32          1HH1      ARG  32  -0.099 -16.138  -2.121
  253   2HH1  ARG  32          2HH1      ARG  32   0.320 -15.628  -3.723
  254   1HH2  ARG  32          1HH2      ARG  32   0.570 -12.275  -2.874
  255   2HH2  ARG  32          2HH2      ARG  32   0.699 -13.441  -4.148
  256    H    LYS  33           H        LYS  33   0.040 -11.410   3.630
  257    HA   LYS  33           HA       LYS  33   0.897 -11.794   6.282
  258   1HB   LYS  33          1HB       LYS  33   1.990 -13.845   5.123
  259   2HB   LYS  33          2HB       LYS  33   3.066 -12.671   4.365
  260   1HG   LYS  33          1HG       LYS  33   4.090 -13.521   6.420
  261   2HG   LYS  33          2HG       LYS  33   3.677 -11.819   6.624
  262   1HD   LYS  33          1HD       LYS  33   1.434 -13.500   7.355
  263   2HD   LYS  33          2HD       LYS  33   2.873 -13.964   8.264
  264   1HE   LYS  33          1HE       LYS  33   2.968 -11.195   8.319
  265   2HE   LYS  33          2HE       LYS  33   1.244 -11.535   8.464
  266   1HZ   LYS  33          1HZ       LYS  33   2.707 -13.332  10.069
  267   2HZ   LYS  33          2HZ       LYS  33   3.183 -11.743  10.436
  268   3HZ   LYS  33          3HZ       LYS  33   1.547 -12.188  10.542
  269    H    ASP  34           H        ASP  34   0.453  -9.445   5.902
  270    HA   ASP  34           HA       ASP  34   1.123  -7.247   5.273
  271   1HB   ASP  34          1HB       ASP  34   3.314  -8.580   6.478
  272   2HB   ASP  34          2HB       ASP  34   3.977  -7.853   5.012
  273    H    VAL  35           H        VAL  35   0.594  -9.373   3.239
  274    HA   VAL  35           HA       VAL  35   2.513  -8.965   1.104
  275    HB   VAL  35           HB       VAL  35  -0.249 -10.240   1.049
  276   1HG1  VAL  35          1HG1      VAL  35   2.400 -11.055   1.947
  277   2HG1  VAL  35          2HG1      VAL  35   0.851 -11.863   2.148
  278   3HG1  VAL  35          3HG1      VAL  35   1.793 -12.114   0.677
  279   1HG2  VAL  35          1HG2      VAL  35   0.738  -9.261  -1.140
  280   2HG2  VAL  35          2HG2      VAL  35   1.962 -10.529  -0.986
  281   3HG2  VAL  35          3HG2      VAL  35   0.260 -10.963  -1.136
  282    H    TYR  36           H        TYR  36  -0.427  -7.343   2.079
  283    HA   TYR  36           HA       TYR  36  -0.682  -6.022  -0.525
  284   1HB   TYR  36          1HB       TYR  36  -2.165  -5.727   2.066
  285   2HB   TYR  36          2HB       TYR  36  -2.593  -4.974   0.542
  286    HD1  TYR  36           HD1      TYR  36  -3.655  -6.230  -1.190
  287    HD2  TYR  36           HD2      TYR  36  -2.035  -8.127   2.249
  288    HE1  TYR  36           HE1      TYR  36  -4.849  -8.318  -1.791
  289    HE2  TYR  36           HE2      TYR  36  -3.183 -10.215   1.704
  290    HH   TYR  36           HH       TYR  36  -4.710 -11.180   0.339
  291    H    VAL  37           H        VAL  37   0.436  -5.513   2.719
  292    HA   VAL  37           HA       VAL  37   0.733  -2.667   2.469
  293    HB   VAL  37           HB       VAL  37   2.075  -4.685   4.314
  294   1HG1  VAL  37          1HG1      VAL  37  -0.570  -4.157   4.208
  295   2HG1  VAL  37          2HG1      VAL  37   0.275  -4.423   5.738
  296   3HG1  VAL  37          3HG1      VAL  37  -0.058  -2.780   5.191
  297   1HG2  VAL  37          1HG2      VAL  37   2.734  -1.978   3.846
  298   2HG2  VAL  37          2HG2      VAL  37   1.800  -1.982   5.343
  299   3HG2  VAL  37          3HG2      VAL  37   3.254  -2.972   5.207
  300    H    GLN  38           H        GLN  38   2.807  -5.519   2.016
  301    HA   GLN  38           HA       GLN  38   5.129  -4.011   1.120
  302   1HB   GLN  38          1HB       GLN  38   5.530  -6.185   2.074
  303   2HB   GLN  38          2HB       GLN  38   4.332  -6.938   1.025
  304   1HG   GLN  38          1HG       GLN  38   6.120  -7.468  -0.269
  305   2HG   GLN  38          2HG       GLN  38   6.015  -5.795  -0.805
  306   2HE2  GLN  38          2HE2      GLN  38   7.253  -7.361   2.206
  307   1HE2  GLN  38          1HE2      GLN  38   8.761  -6.574   2.169
  308    H    LEU  39           H        LEU  39   2.744  -6.143  -0.445
  309    HA   LEU  39           HA       LEU  39   3.318  -5.922  -3.151
  310   1HB   LEU  39          1HB       LEU  39   0.795  -6.107  -1.642
  311   2HB   LEU  39          2HB       LEU  39   0.563  -5.430  -3.224
  312    HG   LEU  39           HG       LEU  39   2.110  -7.980  -2.792
  313   1HD1  LEU  39          1HD1      LEU  39  -0.417  -7.906  -2.047
  314   2HD1  LEU  39          2HD1      LEU  39  -0.731  -7.845  -3.782
  315   3HD1  LEU  39          3HD1      LEU  39   0.135  -9.217  -3.092
  316   1HD2  LEU  39          1HD2      LEU  39   1.017  -6.378  -5.090
  317   2HD2  LEU  39          2HD2      LEU  39   2.595  -7.156  -4.926
  318   3HD2  LEU  39          3HD2      LEU  39   1.164  -8.131  -5.257
  319    H    TYR  40           H        TYR  40   1.570  -3.551  -1.211
  320    HA   TYR  40           HA       TYR  40   1.172  -1.555  -3.113
  321   1HB   TYR  40          1HB       TYR  40   0.163  -0.780  -1.259
  322   2HB   TYR  40          2HB       TYR  40   1.058  -1.904  -0.261
  323    HD1  TYR  40           HD1      TYR  40   1.997  -0.859   1.550
  324    HD2  TYR  40           HD2      TYR  40   2.098   1.134  -2.236
  325    HE1  TYR  40           HE1      TYR  40   3.327   0.975   2.549
  326    HE2  TYR  40           HE2      TYR  40   3.407   2.979  -1.235
  327    HH   TYR  40           HH       TYR  40   3.852   3.271   2.165
  328    H    LEU  41           H        LEU  41   3.933  -1.704  -0.765
  329    HA   LEU  41           HA       LEU  41   5.288   0.473  -1.980
  330   1HB   LEU  41          1HB       LEU  41   6.614  -1.881  -0.607
  331   2HB   LEU  41          2HB       LEU  41   7.259  -0.250  -0.773
  332    HG   LEU  41           HG       LEU  41   4.587  -0.566   0.537
  333   1HD1  LEU  41          1HD1      LEU  41   6.998  -1.888   1.447
  334   2HD1  LEU  41          2HD1      LEU  41   6.498  -0.656   2.605
  335   3HD1  LEU  41          3HD1      LEU  41   5.378  -1.937   2.141
  336   1HD2  LEU  41          1HD2      LEU  41   5.656   1.668   0.105
  337   2HD2  LEU  41          2HD2      LEU  41   5.345   1.364   1.819
  338   3HD2  LEU  41          3HD2      LEU  41   6.983   1.190   1.171
  339    H    GLN  42           H        GLN  42   4.933  -2.789  -3.111
  340    HA   GLN  42           HA       GLN  42   7.335  -2.800  -4.741
  341   1HB   GLN  42          1HB       GLN  42   5.662  -4.742  -3.877
  342   2HB   GLN  42          2HB       GLN  42   5.114  -4.572  -5.541
  343   1HG   GLN  42          1HG       GLN  42   7.905  -5.207  -4.561
  344   2HG   GLN  42          2HG       GLN  42   6.870  -6.193  -5.594
  345   2HE2  GLN  42          2HE2      GLN  42   8.949  -3.317  -5.539
  346   1HE2  GLN  42          1HE2      GLN  42   9.031  -3.130  -7.224
  347    H    HIS  43           H        HIS  43   3.898  -2.828  -5.815
  348    HA   HIS  43           HA       HIS  43   4.685  -1.827  -8.458
  349   1HB   HIS  43          1HB       HIS  43   1.854  -1.867  -7.456
  350   2HB   HIS  43          2HB       HIS  43   2.467  -2.233  -9.080
  351    HD1  HIS  43           HD1      HIS  43   3.380  -4.635  -9.491
  352    HD2  HIS  43           HD2      HIS  43   2.029  -3.957  -5.614
  353    HE1  HIS  43           HE1      HIS  43   3.266  -6.908  -8.376
  354    H    LEU  44           H        LEU  44   3.181  -0.603  -5.555
  355    HA   LEU  44           HA       LEU  44   2.656   1.998  -6.840
  356   1HB   LEU  44          1HB       LEU  44   2.147   1.061  -4.015
  357   2HB   LEU  44          2HB       LEU  44   1.583   2.568  -4.710
  358    HG   LEU  44           HG       LEU  44   0.363  -0.117  -4.853
  359   1HD1  LEU  44          1HD1      LEU  44  -0.367   2.512  -4.547
  360   2HD1  LEU  44          2HD1      LEU  44  -0.934   2.169  -6.170
  361   3HD1  LEU  44          3HD1      LEU  44  -1.483   1.176  -4.825
  362   1HD2  LEU  44          1HD2      LEU  44   1.262   1.118  -7.422
  363   2HD2  LEU  44          2HD2      LEU  44   0.754  -0.531  -7.082
  364   3HD2  LEU  44          3HD2      LEU  44  -0.445   0.732  -7.317
  365    H    THR  45           H        THR  45   5.166   0.512  -4.976
  366    HA   THR  45           HA       THR  45   7.032   1.467  -3.879
  367    HB   THR  45           HB       THR  45   7.539   3.634  -5.563
  368    HG1  THR  45           HG1      THR  45   7.069   2.257  -7.582
  369   1HG2  THR  45          1HG2      THR  45   8.235   0.691  -5.688
  370   2HG2  THR  45          2HG2      THR  45   8.990   1.893  -6.735
  371   3HG2  THR  45          3HG2      THR  45   9.201   1.990  -4.986
  372    H    ALA  46           H        ALA  46   4.338   2.752  -3.130
  373    HA   ALA  46           HA       ALA  46   3.607   4.691  -2.024
  374   1HB   ALA  46          1HB       ALA  46   6.516   4.793  -1.154
  375   2HB   ALA  46          2HB       ALA  46   5.136   5.515  -0.324
  376   3HB   ALA  46          3HB       ALA  46   5.303   3.760  -0.401
  377    H    ARG  47           H        ARG  47   3.850   5.271  -4.483
  378    HA   ARG  47           HA       ARG  47   5.258   6.797  -6.001
  379   1HB   ARG  47          1HB       ARG  47   3.155   8.592  -5.572
  380   2HB   ARG  47          2HB       ARG  47   3.156   7.267  -6.702
  381   1HG   ARG  47          1HG       ARG  47   2.560   6.548  -3.873
  382   2HG   ARG  47          2HG       ARG  47   1.366   7.582  -4.650
  383   1HD   ARG  47          1HD       ARG  47   2.447   5.088  -5.971
  384   2HD   ARG  47          2HD       ARG  47   1.053   5.076  -4.912
  385    HE   ARG  47           HE       ARG  47   0.200   6.927  -6.602
  386   1HH1  ARG  47          1HH1      ARG  47   2.694   5.800  -8.216
  387   2HH1  ARG  47          2HH1      ARG  47   1.845   4.869  -9.404
  388   1HH2  ARG  47          1HH2      ARG  47  -1.185   4.993  -7.721
  389   2HH2  ARG  47          2HH2      ARG  47  -0.352   4.413  -9.124
  390    H    ASN  48           H        ASN  48   3.590   9.005  -3.798
  391    HA   ASN  48           HA       ASN  48   5.835  10.862  -3.917
  392   1HB   ASN  48          1HB       ASN  48   3.851  11.486  -1.843
  393   2HB   ASN  48          2HB       ASN  48   4.321  12.409  -3.273
  394   2HD2  ASN  48          2HD2      ASN  48   3.674  10.889  -5.384
  395   1HD2  ASN  48          1HD2      ASN  48   2.038  10.497  -5.370
  396    H    ARG  49           H        ARG  49   4.988   8.340  -1.702
  397    HA   ARG  49           HA       ARG  49   5.826   7.761   0.364
  398   1HB   ARG  49          1HB       ARG  49   8.032   8.639  -1.360
  399   2HB   ARG  49          2HB       ARG  49   8.410   8.641   0.354
  400   1HG   ARG  49          1HG       ARG  49   6.998   6.240  -0.104
  401   2HG   ARG  49          2HG       ARG  49   8.063   6.406  -1.463
  402   1HD   ARG  49          1HD       ARG  49   8.767   5.947   1.377
  403   2HD   ARG  49          2HD       ARG  49   9.558   5.371  -0.085
  404    HE   ARG  49           HE       ARG  49  10.112   8.051  -0.152
  405   1HH1  ARG  49          1HH1      ARG  49   9.667   6.786   2.873
  406   2HH1  ARG  49          2HH1      ARG  49  11.300   6.985   3.414
  407   1HH2  ARG  49          1HH2      ARG  49  12.523   7.806   0.275
  408   2HH2  ARG  49          2HH2      ARG  49  12.917   7.562   1.944
  409    HA   PRO  50           HA       PRO  50   6.180  11.041   3.152
  410   1HB   PRO  50          1HB       PRO  50   7.614   9.841   5.173
  411   2HB   PRO  50          2HB       PRO  50   5.932   9.438   4.792
  412   1HG   PRO  50          1HG       PRO  50   8.361   7.822   4.355
  413   2HG   PRO  50          2HG       PRO  50   6.667   7.317   4.272
  414   1HD   PRO  50          1HD       PRO  50   8.482   8.008   2.097
  415   2HD   PRO  50          2HD       PRO  50   6.860   7.298   1.963
  416    HA   PRO  51           HA       PRO  51  10.124  13.012   2.395
  417   1HB   PRO  51          1HB       PRO  51   9.479  15.414   3.570
  418   2HB   PRO  51          2HB       PRO  51   8.949  14.944   1.947
  419   1HG   PRO  51          1HG       PRO  51   7.382  15.032   4.492
  420   2HG   PRO  51          2HG       PRO  51   6.822  15.229   2.825
  421   1HD   PRO  51          1HD       PRO  51   6.562  12.887   4.394
  422   2HD   PRO  51          2HD       PRO  51   6.340  12.994   2.632
  423    H    LEU  52           H        LEU  52   9.124  11.698   5.210
  424    HA   LEU  52           HA       LEU  52   9.994  11.581   7.399
  425   1HB   LEU  52          1HB       LEU  52  12.324  11.818   5.532
  426   2HB   LEU  52          2HB       LEU  52  12.631  11.883   7.268
  427    HG   LEU  52           HG       LEU  52  12.738   9.558   6.279
  428   1HD1  LEU  52          1HD1      LEU  52  10.873   9.899   4.654
  429   2HD1  LEU  52          2HD1      LEU  52  10.614   8.482   5.673
  430   3HD1  LEU  52          3HD1      LEU  52   9.741   9.979   6.004
  431   1HD2  LEU  52          1HD2      LEU  52  12.254   9.985   8.689
  432   2HD2  LEU  52          2HD2      LEU  52  10.531  10.035   8.313
  433   3HD2  LEU  52          3HD2      LEU  52  11.437   8.537   8.098
  434    HA   PRO  53           HA       PRO  53  10.198  16.147   7.907
  435   1HB   PRO  53          1HB       PRO  53   8.056  16.272   9.626
  436   2HB   PRO  53          2HB       PRO  53   7.904  16.377   7.862
  437   1HG   PRO  53          1HG       PRO  53   7.248  14.098   9.682
  438   2HG   PRO  53          2HG       PRO  53   6.562  14.501   8.101
  439   1HD   PRO  53          1HD       PRO  53   8.510  12.502   8.618
  440   2HD   PRO  53          2HD       PRO  53   8.054  13.127   7.019
  441    H    ALA  54           H        ALA  54  10.956  13.484   9.650
  442    HA   ALA  54           HA       ALA  54  12.253  13.271  11.605
  443   1HB   ALA  54          1HB       ALA  54  12.491  16.005  10.788
  444   2HB   ALA  54          2HB       ALA  54  12.339  15.962  12.548
  445   3HB   ALA  54          3HB       ALA  54  13.624  15.051  11.752
  446    H    GLY  55           H        GLY  55   9.171  13.677  11.473
  447   1HA   GLY  55          1HA       GLY  55   7.951  14.904  13.550
  448   2HA   GLY  55          2HA       GLY  55   8.814  13.623  14.403
  449    H    THR  56           H        THR  56   8.549  11.633  12.321
  450    HA   THR  56           HA       THR  56   6.985  10.112  11.424
  451    HB   THR  56           HB       THR  56   5.745   9.084  13.099
  452    HG1  THR  56           HG1      THR  56   4.419  10.157  14.352
  453   1HG2  THR  56          1HG2      THR  56   8.095   9.420  13.860
  454   2HG2  THR  56          2HG2      THR  56   7.587  10.891  14.690
  455   3HG2  THR  56          3HG2      THR  56   6.960   9.326  15.206

  No H/Q in entry =         455
  Start of MODEL   10
    1    H2   PRO   1           H2       PRO   1  -2.629  11.343  -8.762
    2    H3   PRO   1           H3       PRO   1  -3.756  11.155 -10.021
    3    HA   PRO   1           HA       PRO   1  -4.667   9.440  -8.969
    4   1HB   PRO   1          1HB       PRO   1  -2.424   7.733  -8.444
    5   2HB   PRO   1          2HB       PRO   1  -3.636   7.577  -9.721
    6   1HG   PRO   1          1HG       PRO   1  -0.898   8.347  -9.985
    7   2HG   PRO   1          2HG       PRO   1  -2.123   8.228 -11.259
    8   1HD   PRO   1          1HD       PRO   1  -0.981  10.614 -10.027
    9   2HD   PRO   1          2HD       PRO   1  -2.122  10.544 -11.376
   10    H    GLU   2           H        GLU   2  -1.427   9.795  -7.468
   11    HA   GLU   2           HA       GLU   2  -0.828   9.994  -5.207
   12   1HB   GLU   2          1HB       GLU   2  -3.645  11.010  -4.778
   13   2HB   GLU   2          2HB       GLU   2  -2.199  11.407  -3.850
   14   1HG   GLU   2          1HG       GLU   2  -1.434  12.896  -5.423
   15   2HG   GLU   2          2HG       GLU   2  -2.108  11.978  -6.771
   16    H    PHE   3           H        PHE   3  -0.605   8.088  -4.145
   17    HA   PHE   3           HA       PHE   3  -3.087   6.727  -3.196
   18   1HB   PHE   3          1HB       PHE   3  -2.508   5.153  -4.796
   19   2HB   PHE   3          2HB       PHE   3  -0.831   5.686  -4.835
   20    HD1  PHE   3           HD1      PHE   3  -3.027   3.130  -3.689
   21    HD2  PHE   3           HD2      PHE   3   0.641   5.164  -2.863
   22    HE1  PHE   3           HE1      PHE   3  -2.275   1.208  -2.437
   23    HE2  PHE   3           HE2      PHE   3   1.414   3.206  -1.567
   24    HZ   PHE   3           HZ       PHE   3  -0.054   1.186  -1.375
   25    H    LEU   4           H        LEU   4  -2.676   5.386  -1.303
   26    HA   LEU   4           HA       LEU   4  -1.403   6.734   0.801
   27   1HB   LEU   4          1HB       LEU   4  -1.330   4.304   1.829
   28   2HB   LEU   4          2HB       LEU   4  -2.881   5.047   1.487
   29    HG   LEU   4           HG       LEU   4  -1.685   3.646  -0.804
   30   1HD1  LEU   4          1HD1      LEU   4  -0.972   2.214   1.108
   31   2HD1  LEU   4          2HD1      LEU   4  -2.661   2.106   1.606
   32   3HD1  LEU   4          3HD1      LEU   4  -2.150   1.420   0.060
   33   1HD2  LEU   4          1HD2      LEU   4  -4.180   4.527   0.115
   34   2HD2  LEU   4          2HD2      LEU   4  -3.868   3.609  -1.358
   35   3HD2  LEU   4          3HD2      LEU   4  -4.278   2.767   0.138
   36    H    GLU   5           H        GLU   5   0.713   7.404   0.001
   37    HA   GLU   5           HA       GLU   5   2.701   5.514  -0.855
   38   1HB   GLU   5          1HB       GLU   5   3.058   8.250   0.408
   39   2HB   GLU   5          2HB       GLU   5   4.315   7.343  -0.434
   40   1HG   GLU   5          1HG       GLU   5   3.558   8.685  -2.164
   41   2HG   GLU   5          2HG       GLU   5   2.489   7.297  -2.387
   42    H    ASP   6           H        ASP   6   1.280   6.067   2.140
   43    HA   ASP   6           HA       ASP   6   3.187   4.269   3.455
   44   1HB   ASP   6          1HB       ASP   6   2.591   6.968   4.697
   45   2HB   ASP   6          2HB       ASP   6   3.726   5.749   5.276
   46    HA   PRO   7           HA       PRO   7  -1.200   3.709   4.591
   47   1HB   PRO   7          1HB       PRO   7  -1.108   0.965   4.399
   48   2HB   PRO   7          2HB       PRO   7  -1.465   2.028   3.032
   49   1HG   PRO   7          1HG       PRO   7   1.031   0.523   3.656
   50   2HG   PRO   7          2HG       PRO   7   0.410   1.061   2.088
   51   1HD   PRO   7          1HD       PRO   7   2.500   2.293   3.570
   52   2HD   PRO   7          2HD       PRO   7   1.658   3.004   2.178
   53    H    SER   8           H        SER   8   1.038   4.064   6.501
   54    HA   SER   8           HA       SER   8   0.851   1.786   8.352
   55   1HB   SER   8          1HB       SER   8   2.419   3.076   9.736
   56   2HB   SER   8          2HB       SER   8   2.992   3.010   8.069
   57    HG   SER   8           HG       SER   8   2.358   5.147   9.555
   58    H    VAL   9           H        VAL   9  -1.373   3.918   7.618
   59    HA   VAL   9           HA       VAL   9  -2.162   4.367  10.464
   60    HB   VAL   9           HB       VAL   9  -3.103   6.481   9.907
   61   1HG1  VAL   9          1HG1      VAL   9  -2.557   5.760   7.014
   62   2HG1  VAL   9          2HG1      VAL   9  -4.144   5.798   7.782
   63   3HG1  VAL   9          3HG1      VAL   9  -3.228   7.291   7.577
   64   1HG2  VAL   9          1HG2      VAL   9  -0.399   5.941   9.565
   65   2HG2  VAL   9          2HG2      VAL   9  -0.814   6.873   8.126
   66   3HG2  VAL   9          3HG2      VAL   9  -1.114   7.545   9.729
   67    H    LEU  10           H        LEU  10  -2.926   2.789   7.592
   68    HA   LEU  10           HA       LEU  10  -5.832   2.766   8.252
   69   1HB   LEU  10          1HB       LEU  10  -5.637   1.318   5.902
   70   2HB   LEU  10          2HB       LEU  10  -6.001   3.042   5.981
   71    HG   LEU  10           HG       LEU  10  -3.187   1.933   5.740
   72   1HD1  LEU  10          1HD1      LEU  10  -5.253   2.786   3.764
   73   2HD1  LEU  10          2HD1      LEU  10  -3.563   3.141   3.409
   74   3HD1  LEU  10          3HD1      LEU  10  -4.091   1.473   3.642
   75   1HD2  LEU  10          1HD2      LEU  10  -4.233   4.509   6.438
   76   2HD2  LEU  10          2HD2      LEU  10  -2.547   4.059   6.179
   77   3HD2  LEU  10          3HD2      LEU  10  -3.527   4.625   4.827
   78    H    THR  11           H        THR  11  -3.824   0.214   6.783
   79    HA   THR  11           HA       THR  11  -3.535  -1.616   8.818
   80    HB   THR  11           HB       THR  11  -5.803  -1.435   9.481
   81    HG1  THR  11           HG1      THR  11  -6.027  -3.497   9.415
   82   1HG2  THR  11          1HG2      THR  11  -6.212  -1.091   6.558
   83   2HG2  THR  11          2HG2      THR  11  -7.558  -1.784   7.475
   84   3HG2  THR  11          3HG2      THR  11  -6.933  -0.178   7.896
   85    H    LYS  12           H        LYS  12  -4.193  -4.011   7.827
   86    HA   LYS  12           HA       LYS  12  -3.014  -3.982   5.135
   87   1HB   LYS  12          1HB       LYS  12  -3.370  -5.985   7.264
   88   2HB   LYS  12          2HB       LYS  12  -3.710  -6.627   5.657
   89   1HG   LYS  12          1HG       LYS  12  -1.421  -6.966   5.701
   90   2HG   LYS  12          2HG       LYS  12  -1.428  -5.320   5.084
   91   1HD   LYS  12          1HD       LYS  12   0.148  -5.573   6.980
   92   2HD   LYS  12          2HD       LYS  12  -1.155  -4.451   7.375
   93   1HE   LYS  12          1HE       LYS  12  -1.669  -5.722   9.161
   94   2HE   LYS  12          2HE       LYS  12  -2.067  -7.052   8.073
   95   1HZ   LYS  12          1HZ       LYS  12   0.392  -7.520   8.026
   96   2HZ   LYS  12          2HZ       LYS  12   0.541  -6.448   9.336
   97   3HZ   LYS  12          3HZ       LYS  12  -0.397  -7.852   9.494
   98    H    ASP  13           H        ASP  13  -5.926  -3.210   6.112
   99    HA   ASP  13           HA       ASP  13  -7.469  -4.894   4.219
  100   1HB   ASP  13          1HB       ASP  13  -8.111  -3.406   6.700
  101   2HB   ASP  13          2HB       ASP  13  -9.359  -3.372   5.451
  102    H    LYS  14           H        LYS  14  -7.102  -1.414   5.093
  103    HA   LYS  14           HA       LYS  14  -8.600  -0.383   2.897
  104   1HB   LYS  14          1HB       LYS  14  -7.707   0.762   5.008
  105   2HB   LYS  14          2HB       LYS  14  -6.226   0.985   4.091
  106   1HG   LYS  14          1HG       LYS  14  -8.998   1.966   3.374
  107   2HG   LYS  14          2HG       LYS  14  -7.604   2.949   3.807
  108   1HD   LYS  14          1HD       LYS  14  -7.899   1.240   1.318
  109   2HD   LYS  14          2HD       LYS  14  -7.888   2.971   1.402
  110   1HE   LYS  14          1HE       LYS  14  -5.561   1.530   2.507
  111   2HE   LYS  14          2HE       LYS  14  -5.678   1.687   0.767
  112   1HZ   LYS  14          1HZ       LYS  14  -5.954   3.998   2.611
  113   2HZ   LYS  14          2HZ       LYS  14  -4.481   3.551   1.905
  114   3HZ   LYS  14          3HZ       LYS  14  -5.777   4.035   0.926
  115    H    LEU  15           H        LEU  15  -5.084  -0.415   3.296
  116    HA   LEU  15           HA       LEU  15  -4.215   0.435   0.871
  117   1HB   LEU  15          1HB       LEU  15  -2.596  -1.822   1.197
  118   2HB   LEU  15          2HB       LEU  15  -2.274  -0.202   1.814
  119    HG   LEU  15           HG       LEU  15  -3.421  -0.730   3.897
  120   1HD1  LEU  15          1HD1      LEU  15  -4.638  -2.722   2.362
  121   2HD1  LEU  15          2HD1      LEU  15  -3.591  -3.594   3.473
  122   3HD1  LEU  15          3HD1      LEU  15  -4.829  -2.479   4.105
  123   1HD2  LEU  15          1HD2      LEU  15  -0.998  -1.305   3.522
  124   2HD2  LEU  15          2HD2      LEU  15  -1.790  -2.284   4.757
  125   3HD2  LEU  15          3HD2      LEU  15  -1.515  -2.950   3.145
  126    H    LYS  16           H        LYS  16  -5.963  -2.561   1.347
  127    HA   LYS  16           HA       LYS  16  -5.242  -3.520  -1.296
  128   1HB   LYS  16          1HB       LYS  16  -7.486  -4.647   0.351
  129   2HB   LYS  16          2HB       LYS  16  -6.346  -5.447  -0.688
  130   1HG   LYS  16          1HG       LYS  16  -4.551  -5.044   0.902
  131   2HG   LYS  16          2HG       LYS  16  -5.700  -4.260   1.974
  132   1HD   LYS  16          1HD       LYS  16  -6.054  -7.060   0.931
  133   2HD   LYS  16          2HD       LYS  16  -5.317  -6.702   2.490
  134   1HE   LYS  16          1HE       LYS  16  -7.337  -6.474   3.420
  135   2HE   LYS  16          2HE       LYS  16  -7.774  -5.241   2.239
  136   1HZ   LYS  16          1HZ       LYS  16  -7.847  -7.645   0.892
  137   2HZ   LYS  16          2HZ       LYS  16  -8.602  -7.949   2.383
  138   3HZ   LYS  16          3HZ       LYS  16  -9.176  -6.707   1.381
  139    H    SER  17           H        SER  17  -8.229  -2.497   0.370
  140    HA   SER  17           HA       SER  17 -10.041  -2.461  -1.722
  141   1HB   SER  17          1HB       SER  17  -9.649  -0.886   0.713
  142   2HB   SER  17          2HB       SER  17 -10.551  -0.036  -0.535
  143    HG   SER  17           HG       SER  17 -11.771  -2.108  -0.678
  144    H    GLU  18           H        GLU  18  -7.287  -0.429  -1.190
  145    HA   GLU  18           HA       GLU  18  -7.940   1.444  -3.354
  146   1HB   GLU  18          1HB       GLU  18  -5.530   1.014  -1.615
  147   2HB   GLU  18          2HB       GLU  18  -5.604   2.289  -2.825
  148   1HG   GLU  18          1HG       GLU  18  -7.712   1.962  -0.664
  149   2HG   GLU  18          2HG       GLU  18  -6.272   2.900  -0.382
  150    H    LEU  19           H        LEU  19  -5.241  -0.859  -2.714
  151    HA   LEU  19           HA       LEU  19  -3.880  -0.792  -5.024
  152   1HB   LEU  19          1HB       LEU  19  -4.613  -3.082  -3.308
  153   2HB   LEU  19          2HB       LEU  19  -3.844  -3.419  -4.826
  154    HG   LEU  19           HG       LEU  19  -2.602  -1.153  -3.424
  155   1HD1  LEU  19          1HD1      LEU  19  -2.019  -3.441  -5.123
  156   2HD1  LEU  19          2HD1      LEU  19  -1.081  -1.963  -4.896
  157   3HD1  LEU  19          3HD1      LEU  19  -0.857  -3.337  -3.807
  158   1HD2  LEU  19          1HD2      LEU  19  -3.293  -3.561  -1.932
  159   2HD2  LEU  19          2HD2      LEU  19  -1.544  -3.419  -2.082
  160   3HD2  LEU  19          3HD2      LEU  19  -2.474  -2.109  -1.357
  161    H    VAL  20           H        VAL  20  -7.120  -2.022  -4.686
  162    HA   VAL  20           HA       VAL  20  -7.264  -3.204  -7.337
  163    HB   VAL  20           HB       VAL  20  -9.300  -2.398  -5.245
  164   1HG1  VAL  20          1HG1      VAL  20  -8.203  -4.947  -6.405
  165   2HG1  VAL  20          2HG1      VAL  20  -8.367  -4.475  -4.714
  166   3HG1  VAL  20          3HG1      VAL  20  -9.793  -4.937  -5.644
  167   1HG2  VAL  20          1HG2      VAL  20  -9.868  -3.494  -8.023
  168   2HG2  VAL  20          2HG2      VAL  20 -11.058  -3.304  -6.736
  169   3HG2  VAL  20          3HG2      VAL  20 -10.294  -1.882  -7.447
  170    H    ALA  21           H        ALA  21  -8.455  -0.194  -5.877
  171    HA   ALA  21           HA       ALA  21  -9.498   1.030  -8.200
  172   1HB   ALA  21          1HB       ALA  21  -9.231   3.148  -6.919
  173   2HB   ALA  21          2HB       ALA  21  -9.965   1.861  -5.961
  174   3HB   ALA  21          3HB       ALA  21  -8.263   2.272  -5.730
  175    H    ASN  22           H        ASN  22  -6.096   0.823  -7.165
  176    HA   ASN  22           HA       ASN  22  -5.298   2.971  -8.980
  177   1HB   ASN  22          1HB       ASN  22  -3.043   1.479  -8.398
  178   2HB   ASN  22          2HB       ASN  22  -3.495   2.898  -7.483
  179   2HD2  ASN  22          2HD2      ASN  22  -4.522   2.453  -5.339
  180   1HD2  ASN  22          1HD2      ASN  22  -4.525   0.909  -4.663
  181    H    ASN  23           H        ASN  23  -4.130  -0.384  -8.802
  182    HA   ASN  23           HA       ASN  23  -5.022  -1.308 -11.309
  183   1HB   ASN  23          1HB       ASN  23  -3.701   0.566 -12.253
  184   2HB   ASN  23          2HB       ASN  23  -2.263  -0.044 -11.436
  185   2HD2  ASN  23          2HD2      ASN  23  -1.089  -0.617 -13.364
  186   1HD2  ASN  23          1HD2      ASN  23  -1.606  -1.849 -14.414
  187    H    VAL  24           H        VAL  24  -4.768  -2.543  -8.945
  188    HA   VAL  24           HA       VAL  24  -2.578  -4.503  -9.423
  189    HB   VAL  24           HB       VAL  24  -3.266  -3.549  -6.640
  190   1HG1  VAL  24          1HG1      VAL  24  -1.433  -5.445  -7.877
  191   2HG1  VAL  24          2HG1      VAL  24  -0.564  -4.265  -6.895
  192   3HG1  VAL  24          3HG1      VAL  24  -1.843  -5.241  -6.174
  193   1HG2  VAL  24          1HG2      VAL  24  -1.191  -2.414  -8.544
  194   2HG2  VAL  24          2HG2      VAL  24  -2.564  -1.554  -7.847
  195   3HG2  VAL  24          3HG2      VAL  24  -1.238  -2.084  -6.813
  196    H    THR  25           H        THR  25  -3.279  -6.621  -9.099
  197    HA   THR  25           HA       THR  25  -6.108  -7.031  -8.535
  198    HB   THR  25           HB       THR  25  -4.749  -9.490  -8.401
  199    HG1  THR  25           HG1      THR  25  -3.015  -9.177  -9.509
  200   1HG2  THR  25          1HG2      THR  25  -6.343  -8.027 -10.489
  201   2HG2  THR  25          2HG2      THR  25  -5.695  -9.634 -10.816
  202   3HG2  THR  25          3HG2      THR  25  -6.830  -9.395  -9.487
  203    H    LEU  26           H        LEU  26  -6.750  -8.618  -6.779
  204    HA   LEU  26           HA       LEU  26  -5.103  -8.082  -4.349
  205   1HB   LEU  26          1HB       LEU  26  -8.049  -8.707  -4.618
  206   2HB   LEU  26          2HB       LEU  26  -7.223  -8.453  -3.096
  207    HG   LEU  26           HG       LEU  26  -8.467  -6.551  -4.632
  208   1HD1  LEU  26          1HD1      LEU  26  -5.489  -6.287  -4.937
  209   2HD1  LEU  26          2HD1      LEU  26  -6.714  -6.261  -6.204
  210   3HD1  LEU  26          3HD1      LEU  26  -6.583  -4.916  -5.076
  211   1HD2  LEU  26          1HD2      LEU  26  -7.482  -6.786  -2.106
  212   2HD2  LEU  26          2HD2      LEU  26  -6.460  -5.509  -2.777
  213   3HD2  LEU  26          3HD2      LEU  26  -8.213  -5.321  -2.759
  214    HA   PRO  27           HA       PRO  27  -4.679 -12.582  -4.799
  215   1HB   PRO  27          1HB       PRO  27  -2.133 -12.619  -3.736
  216   2HB   PRO  27          2HB       PRO  27  -2.460 -12.305  -5.448
  217   1HG   PRO  27          1HG       PRO  27  -1.685 -10.382  -3.306
  218   2HG   PRO  27          2HG       PRO  27  -1.375 -10.311  -5.048
  219   1HD   PRO  27          1HD       PRO  27  -3.375  -8.884  -3.673
  220   2HD   PRO  27          2HD       PRO  27  -3.297  -9.109  -5.427
  221    H    ALA  28           H        ALA  28  -4.234 -14.200  -2.969
  222    HA   ALA  28           HA       ALA  28  -4.433 -14.877  -0.704
  223   1HB   ALA  28          1HB       ALA  28  -3.269 -12.265  -0.580
  224   2HB   ALA  28          2HB       ALA  28  -4.527 -12.354   0.651
  225   3HB   ALA  28          3HB       ALA  28  -3.216 -13.530   0.643
  226    H    GLY  29           H        GLY  29  -5.941 -14.000   1.331
  227   1HA   GLY  29          1HA       GLY  29  -8.406 -14.388   1.542
  228   2HA   GLY  29          2HA       GLY  29  -8.589 -13.432   0.065
  229    H    GLU  30           H        GLU  30  -6.983 -13.041   3.236
  230    HA   GLU  30           HA       GLU  30  -8.175 -10.298   3.363
  231   1HB   GLU  30          1HB       GLU  30  -8.292 -12.474   5.231
  232   2HB   GLU  30          2HB       GLU  30  -7.342 -11.173   5.949
  233   1HG   GLU  30          1HG       GLU  30  -9.139  -9.782   6.103
  234   2HG   GLU  30          2HG       GLU  30  -9.780 -10.282   4.538
  235    H    GLN  31           H        GLN  31  -5.374 -12.337   4.057
  236    HA   GLN  31           HA       GLN  31  -3.462 -10.403   3.282
  237   1HB   GLN  31          1HB       GLN  31  -4.274  -9.219   5.353
  238   2HB   GLN  31          2HB       GLN  31  -3.799 -10.622   6.301
  239   1HG   GLN  31          1HG       GLN  31  -1.507  -9.842   4.760
  240   2HG   GLN  31          2HG       GLN  31  -2.226  -8.415   5.487
  241   2HE2  GLN  31          2HE2      GLN  31  -2.382 -11.695   6.882
  242   1HE2  GLN  31          1HE2      GLN  31  -1.494 -11.314   8.276
  243    H    ARG  32           H        ARG  32  -2.026 -11.804   2.565
  244    HA   ARG  32           HA       ARG  32  -1.702 -14.471   3.503
  245   1HB   ARG  32          1HB       ARG  32  -0.607 -12.586   1.517
  246   2HB   ARG  32          2HB       ARG  32   0.547 -13.769   2.066
  247   1HG   ARG  32          1HG       ARG  32  -0.560 -15.511   1.049
  248   2HG   ARG  32          2HG       ARG  32  -2.146 -14.805   1.360
  249   1HD   ARG  32          1HD       ARG  32  -1.808 -14.685  -1.023
  250   2HD   ARG  32          2HD       ARG  32  -1.579 -13.040  -0.413
  251    HE   ARG  32           HE       ARG  32   0.675 -13.188  -1.088
  252   1HH1  ARG  32          1HH1      ARG  32   2.180 -15.038   0.124
  253   2HH1  ARG  32          2HH1      ARG  32   2.267 -16.437  -0.895
  254   1HH2  ARG  32          1HH2      ARG  32  -0.484 -15.543  -2.807
  255   2HH2  ARG  32          2HH2      ARG  32   0.759 -16.722  -2.554
  256    H    LYS  33           H        LYS  33   0.229 -11.515   3.798
  257    HA   LYS  33           HA       LYS  33   1.020 -11.868   6.485
  258   1HB   LYS  33          1HB       LYS  33   2.233 -13.857   5.321
  259   2HB   LYS  33          2HB       LYS  33   3.280 -12.622   4.625
  260   1HG   LYS  33          1HG       LYS  33   4.337 -13.367   6.653
  261   2HG   LYS  33          2HG       LYS  33   3.666 -11.771   6.984
  262   1HD   LYS  33          1HD       LYS  33   1.634 -13.718   7.506
  263   2HD   LYS  33          2HD       LYS  33   3.108 -14.226   8.331
  264   1HE   LYS  33          1HE       LYS  33   3.162 -12.348   9.684
  265   2HE   LYS  33          2HE       LYS  33   2.326 -11.343   8.499
  266   1HZ   LYS  33          1HZ       LYS  33   0.540 -13.319   9.148
  267   2HZ   LYS  33          2HZ       LYS  33   1.246 -12.893  10.631
  268   3HZ   LYS  33          3HZ       LYS  33   0.497 -11.703   9.674
  269    H    ASP  34           H        ASP  34   0.461  -9.548   6.090
  270    HA   ASP  34           HA       ASP  34   1.045  -7.312   5.501
  271   1HB   ASP  34          1HB       ASP  34   3.386  -8.626   6.567
  272   2HB   ASP  34          2HB       ASP  34   3.893  -7.617   5.209
  273    H    VAL  35           H        VAL  35   0.485  -9.350   3.484
  274    HA   VAL  35           HA       VAL  35   2.377  -8.925   1.315
  275    HB   VAL  35           HB       VAL  35  -0.264 -10.409   1.509
  276   1HG1  VAL  35          1HG1      VAL  35   2.546 -10.961   1.929
  277   2HG1  VAL  35          2HG1      VAL  35   1.149 -11.978   2.263
  278   3HG1  VAL  35          3HG1      VAL  35   1.900 -11.999   0.663
  279   1HG2  VAL  35          1HG2      VAL  35   1.004  -9.298  -0.840
  280   2HG2  VAL  35          2HG2      VAL  35   1.080 -11.066  -0.875
  281   3HG2  VAL  35          3HG2      VAL  35  -0.474 -10.253  -0.698
  282    H    TYR  36           H        TYR  36  -0.620  -7.449   2.376
  283    HA   TYR  36           HA       TYR  36  -1.060  -6.145  -0.201
  284   1HB   TYR  36          1HB       TYR  36  -2.266  -5.897   2.549
  285   2HB   TYR  36          2HB       TYR  36  -2.738  -4.891   1.201
  286    HD1  TYR  36           HD1      TYR  36  -3.502  -6.086  -0.969
  287    HD2  TYR  36           HD2      TYR  36  -3.138  -7.975   2.844
  288    HE1  TYR  36           HE1      TYR  36  -5.047  -7.881  -1.716
  289    HE2  TYR  36           HE2      TYR  36  -4.652  -9.764   2.134
  290    HH   TYR  36           HH       TYR  36  -6.549  -9.986   0.349
  291    H    VAL  37           H        VAL  37   0.401  -5.548   2.901
  292    HA   VAL  37           HA       VAL  37   0.778  -2.699   2.461
  293    HB   VAL  37           HB       VAL  37   1.935  -4.696   4.457
  294   1HG1  VAL  37          1HG1      VAL  37  -0.576  -3.886   4.405
  295   2HG1  VAL  37          2HG1      VAL  37   0.305  -3.926   5.936
  296   3HG1  VAL  37          3HG1      VAL  37   0.097  -2.400   5.081
  297   1HG2  VAL  37          1HG2      VAL  37   2.325  -1.699   4.186
  298   2HG2  VAL  37          2HG2      VAL  37   2.618  -2.566   5.694
  299   3HG2  VAL  37          3HG2      VAL  37   3.571  -2.945   4.259
  300    H    GLN  38           H        GLN  38   2.733  -5.658   2.147
  301    HA   GLN  38           HA       GLN  38   5.122  -4.244   1.270
  302   1HB   GLN  38          1HB       GLN  38   5.400  -6.441   2.256
  303   2HB   GLN  38          2HB       GLN  38   4.226  -7.147   1.151
  304   1HG   GLN  38          1HG       GLN  38   6.097  -7.738  -0.015
  305   2HG   GLN  38          2HG       GLN  38   5.966  -6.092  -0.627
  306   2HE2  GLN  38          2HE2      GLN  38   7.088  -7.339   2.563
  307   1HE2  GLN  38          1HE2      GLN  38   8.609  -6.581   2.493
  308    H    LEU  39           H        LEU  39   2.542  -6.140  -0.195
  309    HA   LEU  39           HA       LEU  39   3.164  -6.021  -2.929
  310   1HB   LEU  39          1HB       LEU  39   0.585  -6.026  -1.425
  311   2HB   LEU  39          2HB       LEU  39   0.477  -5.502  -3.088
  312    HG   LEU  39           HG       LEU  39   1.942  -8.026  -2.408
  313   1HD1  LEU  39          1HD1      LEU  39  -0.456  -8.045  -1.536
  314   2HD1  LEU  39          2HD1      LEU  39  -0.975  -7.791  -3.201
  315   3HD1  LEU  39          3HD1      LEU  39  -0.102  -9.261  -2.766
  316   1HD2  LEU  39          1HD2      LEU  39   0.821  -6.600  -4.803
  317   2HD2  LEU  39          2HD2      LEU  39   2.386  -7.403  -4.614
  318   3HD2  LEU  39          3HD2      LEU  39   0.925  -8.365  -4.836
  319    H    TYR  40           H        TYR  40   1.231  -3.622  -1.166
  320    HA   TYR  40           HA       TYR  40   0.995  -1.648  -3.069
  321   1HB   TYR  40          1HB       TYR  40  -0.063  -0.767  -1.289
  322   2HB   TYR  40          2HB       TYR  40   0.649  -1.991  -0.274
  323    HD1  TYR  40           HD1      TYR  40   1.832   1.177  -1.947
  324    HD2  TYR  40           HD2      TYR  40   1.738  -1.265   1.579
  325    HE1  TYR  40           HE1      TYR  40   3.188   2.869  -0.736
  326    HE2  TYR  40           HE2      TYR  40   3.101   0.417   2.782
  327    HH   TYR  40           HH       TYR  40   4.518   3.150   1.144
  328    H    LEU  41           H        LEU  41   3.652  -1.781  -0.630
  329    HA   LEU  41           HA       LEU  41   5.070   0.416  -1.722
  330   1HB   LEU  41          1HB       LEU  41   5.376  -1.218   0.456
  331   2HB   LEU  41          2HB       LEU  41   6.726  -1.737  -0.549
  332    HG   LEU  41           HG       LEU  41   7.245   0.796  -0.805
  333   1HD1  LEU  41          1HD1      LEU  41   7.689  -1.003   1.522
  334   2HD1  LEU  41          2HD1      LEU  41   8.861  -0.250   0.440
  335   3HD1  LEU  41          3HD1      LEU  41   8.125   0.693   1.737
  336   1HD2  LEU  41          1HD2      LEU  41   5.262   0.780   1.495
  337   2HD2  LEU  41          2HD2      LEU  41   6.493   2.033   1.334
  338   3HD2  LEU  41          3HD2      LEU  41   5.280   1.827   0.073
  339    H    GLN  42           H        GLN  42   4.850  -2.869  -2.845
  340    HA   GLN  42           HA       GLN  42   7.308  -2.838  -4.375
  341   1HB   GLN  42          1HB       GLN  42   5.671  -4.813  -3.532
  342   2HB   GLN  42          2HB       GLN  42   5.123  -4.672  -5.195
  343   1HG   GLN  42          1HG       GLN  42   7.554  -4.848  -5.911
  344   2HG   GLN  42          2HG       GLN  42   7.939  -5.259  -4.236
  345   2HE2  GLN  42          2HE2      GLN  42   5.799  -6.304  -6.941
  346   1HE2  GLN  42          1HE2      GLN  42   5.793  -7.942  -6.497
  347    H    HIS  43           H        HIS  43   3.913  -2.940  -5.553
  348    HA   HIS  43           HA       HIS  43   4.723  -2.087  -8.223
  349   1HB   HIS  43          1HB       HIS  43   1.894  -1.919  -7.229
  350   2HB   HIS  43          2HB       HIS  43   2.490  -2.416  -8.825
  351    HD1  HIS  43           HD1      HIS  43   3.218  -4.888  -9.109
  352    HD2  HIS  43           HD2      HIS  43   2.005  -3.912  -5.254
  353    HE1  HIS  43           HE1      HIS  43   2.974  -7.085  -7.868
  354    H    LEU  44           H        LEU  44   3.097  -0.652  -5.464
  355    HA   LEU  44           HA       LEU  44   2.752   1.897  -6.864
  356   1HB   LEU  44          1HB       LEU  44   2.241   1.127  -3.987
  357   2HB   LEU  44          2HB       LEU  44   1.761   2.634  -4.741
  358    HG   LEU  44           HG       LEU  44   0.391   0.006  -4.800
  359   1HD1  LEU  44          1HD1      LEU  44  -0.204   2.540  -4.302
  360   2HD1  LEU  44          2HD1      LEU  44  -0.637   2.536  -6.004
  361   3HD1  LEU  44          3HD1      LEU  44  -1.403   1.408  -4.895
  362   1HD2  LEU  44          1HD2      LEU  44   1.240   1.250  -7.405
  363   2HD2  LEU  44          2HD2      LEU  44   0.762  -0.413  -7.058
  364   3HD2  LEU  44          3HD2      LEU  44  -0.462   0.849  -7.231
  365    H    THR  45           H        THR  45   5.186   0.441  -4.835
  366    HA   THR  45           HA       THR  45   7.113   1.404  -3.867
  367    HB   THR  45           HB       THR  45   7.645   3.502  -5.613
  368    HG1  THR  45           HG1      THR  45   7.079   2.308  -7.629
  369   1HG2  THR  45          1HG2      THR  45   8.233   0.537  -5.677
  370   2HG2  THR  45          2HG2      THR  45   8.973   1.663  -6.817
  371   3HG2  THR  45          3HG2      THR  45   9.278   1.832  -5.086
  372    H    ALA  46           H        ALA  46   4.412   2.695  -3.186
  373    HA   ALA  46           HA       ALA  46   3.655   4.635  -2.116
  374   1HB   ALA  46          1HB       ALA  46   5.002   4.220  -0.267
  375   2HB   ALA  46          2HB       ALA  46   5.668   5.768  -0.786
  376   3HB   ALA  46          3HB       ALA  46   6.492   4.263  -1.205
  377    H    ARG  47           H        ARG  47   3.902   5.100  -4.643
  378    HA   ARG  47           HA       ARG  47   5.261   6.628  -6.208
  379   1HB   ARG  47          1HB       ARG  47   3.129   8.391  -5.877
  380   2HB   ARG  47          2HB       ARG  47   3.124   6.988  -6.908
  381   1HG   ARG  47          1HG       ARG  47   2.592   6.438  -4.045
  382   2HG   ARG  47          2HG       ARG  47   1.389   7.457  -4.817
  383   1HD   ARG  47          1HD       ARG  47   2.377   4.882  -6.060
  384   2HD   ARG  47          2HD       ARG  47   1.023   4.949  -4.954
  385    HE   ARG  47           HE       ARG  47   0.169   6.752  -6.715
  386   1HH1  ARG  47          1HH1      ARG  47  -1.106   4.287  -7.273
  387   2HH1  ARG  47          2HH1      ARG  47  -0.489   3.791  -8.815
  388   1HH2  ARG  47          1HH2      ARG  47   2.254   5.909  -8.696
  389   2HH2  ARG  47          2HH2      ARG  47   1.412   4.708  -9.620
  390    H    ASN  48           H        ASN  48   3.541   8.850  -4.037
  391    HA   ASN  48           HA       ASN  48   5.918  10.602  -4.034
  392   1HB   ASN  48          1HB       ASN  48   3.787  11.471  -2.229
  393   2HB   ASN  48          2HB       ASN  48   4.429  12.265  -3.670
  394   2HD2  ASN  48          2HD2      ASN  48   3.854  10.624  -5.719
  395   1HD2  ASN  48          1HD2      ASN  48   2.198  10.346  -5.820
  396    H    ARG  49           H        ARG  49   7.399   9.329  -2.801
  397    HA   ARG  49           HA       ARG  49   6.681   8.482  -0.151
  398   1HB   ARG  49          1HB       ARG  49   9.543   8.579  -0.663
  399   2HB   ARG  49          2HB       ARG  49   8.548   7.233  -0.133
  400   1HG   ARG  49          1HG       ARG  49   7.673   7.515  -2.700
  401   2HG   ARG  49          2HG       ARG  49   9.359   7.998  -2.869
  402   1HD   ARG  49          1HD       ARG  49   8.398   5.443  -1.544
  403   2HD   ARG  49          2HD       ARG  49   9.056   5.550  -3.176
  404    HE   ARG  49           HE       ARG  49  11.148   6.521  -1.928
  405   1HH1  ARG  49          1HH1      ARG  49  10.556   6.179   0.817
  406   2HH1  ARG  49          2HH1      ARG  49  10.991   4.543   1.182
  407   1HH2  ARG  49          1HH2      ARG  49  11.015   3.532  -2.135
  408   2HH2  ARG  49          2HH2      ARG  49  11.251   3.044  -0.490
  409    HA   PRO  50           HA       PRO  50   9.512  12.102   1.118
  410   1HB   PRO  50          1HB       PRO  50  10.186  13.848  -0.896
  411   2HB   PRO  50          2HB       PRO  50  11.143  12.418  -0.478
  412   1HG   PRO  50          1HG       PRO  50   9.346  12.868  -2.818
  413   2HG   PRO  50          2HG       PRO  50  10.727  11.770  -2.663
  414   1HD   PRO  50          1HD       PRO  50   7.964  11.058  -2.461
  415   2HD   PRO  50          2HD       PRO  50   9.331  10.018  -2.083
  416    HA   PRO  51           HA       PRO  51   5.853  14.688   1.183
  417   1HB   PRO  51          1HB       PRO  51   6.414  15.887   3.594
  418   2HB   PRO  51          2HB       PRO  51   5.687  14.279   3.441
  419   1HG   PRO  51          1HG       PRO  51   8.484  15.024   4.172
  420   2HG   PRO  51          2HG       PRO  51   7.563  13.574   4.599
  421   1HD   PRO  51          1HD       PRO  51   9.539  13.769   2.574
  422   2HD   PRO  51          2HD       PRO  51   8.417  12.416   2.812
  423    H    LEU  52           H        LEU  52   8.906  15.513   0.398
  424    HA   LEU  52           HA       LEU  52   9.928  17.493  -0.343
  425   1HB   LEU  52          1HB       LEU  52   6.990  18.162  -0.516
  426   2HB   LEU  52          2HB       LEU  52   8.225  19.337  -0.967
  427    HG   LEU  52           HG       LEU  52   7.329  17.892  -2.871
  428   1HD1  LEU  52          1HD1      LEU  52   7.249  15.778  -1.540
  429   2HD1  LEU  52          2HD1      LEU  52   8.200  15.599  -3.016
  430   3HD1  LEU  52          3HD1      LEU  52   9.011  15.788  -1.461
  431   1HD2  LEU  52          1HD2      LEU  52   9.519  19.115  -2.920
  432   2HD2  LEU  52          2HD2      LEU  52  10.301  17.669  -2.282
  433   3HD2  LEU  52          3HD2      LEU  52   9.543  17.631  -3.874
  434    HA   PRO  53           HA       PRO  53   9.876  19.361   3.803
  435   1HB   PRO  53          1HB       PRO  53  12.616  19.515   3.968
  436   2HB   PRO  53          2HB       PRO  53  11.685  18.078   4.429
  437   1HG   PRO  53          1HG       PRO  53  13.354  18.547   1.995
  438   2HG   PRO  53          2HG       PRO  53  12.957  17.024   2.803
  439   1HD   PRO  53          1HD       PRO  53  11.751  18.020   0.438
  440   2HD   PRO  53          2HD       PRO  53  11.148  16.676   1.429
  441    H    ALA  54           H        ALA  54  10.456  20.462   0.753
  442    HA   ALA  54           HA       ALA  54  10.572  22.678  -0.046
  443   1HB   ALA  54          1HB       ALA  54  10.923  24.133   2.393
  444   2HB   ALA  54          2HB       ALA  54   9.721  22.867   2.670
  445   3HB   ALA  54          3HB       ALA  54   9.485  24.044   1.373
  446    H    GLY  55           H        GLY  55  12.954  20.982   0.619
  447   1HA   GLY  55          1HA       GLY  55  15.106  22.202   1.808
  448   2HA   GLY  55          2HA       GLY  55  14.962  23.084   0.287
  449    H    THR  56           H        THR  56  13.878  20.552  -1.002
  450    HA   THR  56           HA       THR  56  16.309  19.600  -2.121
  451    HB   THR  56           HB       THR  56  16.521  18.660   0.236
  452    HG1  THR  56           HG1      THR  56  17.721  17.381  -0.891
  453   1HG2  THR  56          1HG2      THR  56  14.000  18.122   0.288
  454   2HG2  THR  56          2HG2      THR  56  14.410  16.704  -0.678
  455   3HG2  THR  56          3HG2      THR  56  15.094  16.900   0.937

  No H/Q in entry =         455