*HEADER    NUCLEOCAPSID PROTEIN                    14-FEB-05   2BL6
*TITLE     SOLUTION STRUCTURE OF THE ZN COMPLEX OF EIAV NCP11(22-58)
*TITLE    2 PEPTIDE, INCLUDING TWO CCHC ZN-BINDING MOTIFS.
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: NUCLEOCAPSID PROTEIN P11;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: RESIDUES 381-417;
*COMPND   5 OTHER_DETAILS: FRAGMENT 22-58 OF NCP11 CORRESPONDS TO 381-
*COMPND   6  417 OF THE WHOLE EIAV GAG PROTEIN CONTAINS TWO ZN IONS IN
*COMPND   7  TWO CCHC ZN-BINDING DOMAINS
*SOURCE    MOL_ID: 1;
*SOURCE   2 SYNTHETIC: YES;
*SOURCE   3 ORGANISM_SCIENTIFIC: EQUINE INFECTIOUS ANEMIA VIRUS;
*SOURCE   4 ORGANISM_COMMON: EIAV;
*SOURCE   5 VARIANT: WYOMING ISOLATE
*KEYWDS    NUCLEOCAPSID PROTEIN, LENTIVIRUS, POLYPROTEIN, CORE
*KEYWDS   2 PROTEIN, RETROVIRUS ZINC FINGER-LIKE DOMAINS
*EXPDTA    NMR, 30 STRUCTURES
*AUTHOR    P.AMODEO,M.A.CASTIGLIONE-MORELLI,A.OSTUNI,A.BAVOSO




 2 THR  HA    2 THR  H     3.300
 2 THR  HA    2 THR  HB    3.300
 2 THR  HB    2 THR  H     2.800
 2 THR  HA    2 THR  QG2   3.400
 2 THR  QG2   2 THR  H     4.700
 2 THR  HA    3 CYS  H     2.500
 2 THR  HA    3 CYS  HA    4.700
 2 THR  HA    3 CYS  HB2   4.600
 2 THR  HA    3 CYS  HB3   5.200
 2 THR  HB    3 CYS  H     4.300
 2 THR  QG2   3 CYS  H     3.600
 2 THR  QG2   7 GLY  HA2   5.100
 2 THR  HA    8 LYS  H     5.100
 2 THR  QG2   8 LYS  H     4.500
 2 THR  HA    9 PRO  HA    2.400
 2 THR  QG2   9 PRO  HD3   5.000
 2 THR  H    20 LYS  H     5.200
 3 CYS  HA    3 CYS  H     3.100
 3 CYS  HA    3 CYS  HB2   2.900
 3 CYS  HA    3 CYS  HB3   3.300
 3 CYS  HB2   3 CYS  H     2.500
 3 CYS  HB3   3 CYS  H     2.900
 3 CYS  H     4 TYR  H     4.900
 3 CYS  HA    4 TYR  H     2.500
 3 CYS  HA    4 TYR  HD2   4.000
 3 CYS  HB2   4 TYR  H     4.400
 3 CYS  HB3   4 TYR  H     3.900
 3 CYS  HB3   4 TYR  HA    5.200
 3 CYS  HB3   4 TYR  HD2   5.200
 3 CYS  HB3   5 ASN  HB3   5.200
 3 CYS  HA    6 CYS  H     4.900
 3 CYS  HB2   6 CYS  HB2   3.000
 3 CYS  H     7 GLY  H     5.000
 3 CYS  HB3   7 GLY  H     2.800
 3 CYS  H     8 LYS  H     3.500
 3 CYS  HA    8 LYS  H     5.200
 3 CYS  HB2   8 LYS  H     3.500
 3 CYS  H    11 HIS  HE1   5.200
 3 CYS  HA   11 HIS  HD2   4.400
 3 CYS  HB2  11 HIS  HD2   3.700
 3 CYS  HB3  11 HIS  HD2   5.200
 3 CYS  HB3  11 HIS  HE1   5.100
 3 CYS  H    20 LYS  H     5.000
 4 TYR  HA    4 TYR  H     3.200
 4 TYR  HA    4 TYR  HB2   2.500
 4 TYR  HA    4 TYR  HB3   2.900
 4 TYR  HA    4 TYR  HD2   4.600
 4 TYR  HB2   4 TYR  H     3.900
 4 TYR  HB3   4 TYR  H     2.700
 4 TYR  HB3   4 TYR  HD2   3.100
 4 TYR  HD2   4 TYR  H     2.600
 4 TYR  HE1   4 TYR  HD2   5.200
 4 TYR  HB3   4 TYR  QE    5.200
 4 TYR  H     5 ASN  H     2.800
 4 TYR  H     5 ASN  HB2   5.200
 4 TYR  H     5 ASN  HB3   5.000
 4 TYR  HA    5 ASN  H     3.700
 4 TYR  HB2   5 ASN  H     4.700
 4 TYR  HB3   5 ASN  H     4.400
 4 TYR  HD2   5 ASN  HA    5.200
 4 TYR  HD2   5 ASN  HB2   4.100
 4 TYR  HD2   5 ASN  HB3   4.100
 4 TYR  QD    5 ASN  HB2   3.900
 4 TYR  QD    5 ASN  HB3   3.800
 4 TYR  H    16 CYS  HB2   4.700
 4 TYR  HD2  16 CYS  HB3   3.600
 4 TYR  HD2  17 ARG  H     4.800
 4 TYR  HE1  17 ARG  QD    5.100
 4 TYR  H    18 ALA  H     4.700
 4 TYR  HB3  18 ALA  HA    5.200
 4 TYR  H    20 LYS  H     4.100
 4 TYR  HB2  20 LYS  H     5.300
 4 TYR  HB2  20 LYS  HA    3.500
 4 TYR  HB3  20 LYS  HA    3.500
 4 TYR  HA   20 LYS  QB    4.300
 4 TYR  HA   20 LYS  QD    5.200
 4 TYR  HA   20 LYS  QG    4.900
 4 TYR  HE1  23 PHE  HA    4.500
 4 TYR  HE1  23 PHE  HB2   3.200
 4 TYR  HE1  23 PHE  HB3   4.000
 5 ASN  HA    5 ASN  H     3.300
 5 ASN  HA    5 ASN  HB2   2.700
 5 ASN  HA    5 ASN  HB3   3.300
 5 ASN  HB2   5 ASN  H     3.400
 5 ASN  HB3   5 ASN  H     3.000
 5 ASN  H     6 CYS  H     2.400
 6 CYS  HA    6 CYS  H     3.100
 6 CYS  HA    6 CYS  HB2   3.300
 6 CYS  HA    6 CYS  HB3   2.700
 6 CYS  HB2   6 CYS  H     2.800
 6 CYS  HB3   6 CYS  H     3.900
 6 CYS  H     7 GLY  H     3.000
 6 CYS  HA    7 GLY  HA3   5.000
 6 CYS  HB2   7 GLY  H     3.500
 6 CYS  HB3   7 GLY  H     4.500
 6 CYS  H     8 LYS  H     4.700
 6 CYS  HB2  11 HIS  HD2   5.200
 6 CYS  HB3  11 HIS  HE1   3.600
 7 GLY  H     7 GLY  HA3   3.100
 7 GLY  HA2   7 GLY  H     2.600
 7 GLY  HA2   7 GLY  HA3   2.000
 7 GLY  H     8 LYS  H     2.900
 7 GLY  HA2   8 LYS  H     3.100
 7 GLY  HA3   8 LYS  H     3.700
 8 LYS  HA    8 LYS  H     3.300
 8 LYS  HA    8 LYS  HB2   3.300
 8 LYS  HA    8 LYS  HB3   3.300
 8 LYS  HA    8 LYS  HG3   4.100
 8 LYS  HB2   8 LYS  H     3.300
 8 LYS  HB2   8 LYS  HG3   3.300
 8 LYS  HB3   8 LYS  H     4.000
 8 LYS  HB3   8 LYS  HG3   3.300
 8 LYS  HG3   8 LYS  H     5.000
 8 LYS  HA    8 LYS  QD    4.700
 8 LYS  HA    8 LYS  QZ    5.100
 8 LYS  HB2   8 LYS  QD    4.200
 8 LYS  HB2   8 LYS  QE    4.900
 8 LYS  HB3   8 LYS  QD    4.200
 8 LYS  HB3   8 LYS  QE    4.800
 8 LYS  HG3   8 LYS  QD    2.900
 8 LYS  HG3   8 LYS  QE    4.200
 8 LYS  HG3   8 LYS  QZ    5.200
 8 LYS  QD    8 LYS  QE    2.700
 8 LYS  QD    8 LYS  QZ    3.500
 8 LYS  QE    8 LYS  QZ    2.500
 8 LYS  H     9 PRO  HD2   5.300
 8 LYS  H     9 PRO  HD3   5.200
 8 LYS  HA    9 PRO  HD2   2.700
 8 LYS  HA    9 PRO  HD3   2.800
 8 LYS  QE    9 PRO  HD2   4.900
 8 LYS  HB3  10 GLY  H     4.900
 8 LYS  H    11 HIS  HE1   5.000
 8 LYS  HB2  11 HIS  HE1   4.600
 8 LYS  HB3  11 HIS  HB2   4.300
 8 LYS  HB3  11 HIS  HE1   4.100
 8 LYS  HG3  11 HIS  HE1   5.300
 9 PRO  HA    9 PRO  HB2   2.600
 9 PRO  HA    9 PRO  HB3   3.300
 9 PRO  HA    9 PRO  HD2   4.400
 9 PRO  HA    9 PRO  HD3   3.900
 9 PRO  HB2   9 PRO  HD2   4.100
 9 PRO  HB2   9 PRO  HD3   4.400
 9 PRO  HB3   9 PRO  HD2   4.400
 9 PRO  HB3   9 PRO  HD3   4.200
 9 PRO  HA    9 PRO  QG    4.200
 9 PRO  HB2   9 PRO  QG    2.800
 9 PRO  HB3   9 PRO  QG    2.800
 9 PRO  QG    9 PRO  HD2   2.800
 9 PRO  QG    9 PRO  HD3   2.800
 9 PRO  HA   10 GLY  H     3.000
 9 PRO  HB2  10 GLY  H     3.600
 9 PRO  HB3  10 GLY  H     2.400
 9 PRO  QG   10 GLY  H     4.800
 9 PRO  HA   11 HIS  H     4.000
 9 PRO  HB3  11 HIS  H     5.200
10 GLY  H    10 GLY  HA3   3.200
10 GLY  HA2  10 GLY  H     3.100
10 GLY  HA2  10 GLY  HA3   2.000
10 GLY  H    11 HIS  H     3.000
10 GLY  H    11 HIS  HB2   4.600
10 GLY  HA2  11 HIS  H     3.000
10 GLY  HA3  11 HIS  H     3.700
10 GLY  HA3  15 GLN  HE21  4.500
10 GLY  HA3  15 GLN  HE22  4.600
11 HIS  HA   11 HIS  H     3.200
11 HIS  HA   11 HIS  HB2   3.200
11 HIS  HA   11 HIS  HB3   3.000
11 HIS  HA   11 HIS  HD2   4.800
11 HIS  HB2  11 HIS  H     2.700
11 HIS  HB2  11 HIS  HD2   4.000
11 HIS  HB2  11 HIS  HE1   5.200
11 HIS  HB3  11 HIS  H     3.800
11 HIS  HB3  11 HIS  HD2   2.900
11 HIS  HD2  11 HIS  HE1   4.500
11 HIS  H    12 LEU  H     4.800
11 HIS  H    12 LEU  HG    5.200
11 HIS  HA   12 LEU  H     2.500
11 HIS  HB2  12 LEU  H     4.200
11 HIS  HB3  12 LEU  H     2.900
11 HIS  HD2  12 LEU  H     5.100
11 HIS  HA   15 GLN  H     5.000
11 HIS  HA   15 GLN  HE22  4.500
11 HIS  HB2  15 GLN  HB3   5.200
11 HIS  HD2  15 GLN  HB2   5.000
11 HIS  HD2  15 GLN  HB3   3.900
11 HIS  HD2  15 GLN  QG    4.200
11 HIS  HD2  16 CYS  HA    5.000
11 HIS  HD2  16 CYS  HB2   2.700
11 HIS  HB2  19 PRO  HB2   5.000
11 HIS  HB3  19 PRO  HB2   5.300
12 LEU  HA   12 LEU  H     3.200
12 LEU  HA   12 LEU  HB2   3.300
12 LEU  HA   12 LEU  HB3   2.800
12 LEU  HA   12 LEU  HG    3.400
12 LEU  HB2  12 LEU  H     3.100
12 LEU  HB3  12 LEU  H     4.100
12 LEU  HG   12 LEU  H     3.800
12 LEU  HA   12 LEU  QQD   3.200
12 LEU  HB2  12 LEU  QQD   3.300
12 LEU  HB3  12 LEU  QQD   2.800
12 LEU  HG   12 LEU  QQD   2.200
12 LEU  QB   12 LEU  H     3.500
12 LEU  QQD  12 LEU  H     5.200
12 LEU  QB   12 LEU  QQD   2.900
12 LEU  H    13 SER  H     4.700
12 LEU  HA   13 SER  H     2.500
12 LEU  HB2  13 SER  H     4.000
12 LEU  HB3  13 SER  H     2.800
12 LEU  HG   13 SER  H     5.200
12 LEU  QQD  13 SER  H     4.600
12 LEU  HB2  14 SER  H     4.000
12 LEU  H    15 GLN  H     4.500
12 LEU  H    15 GLN  HE22  5.000
12 LEU  HA   15 GLN  H     5.000
12 LEU  HB2  15 GLN  H     3.300
12 LEU  HB2  15 GLN  HA    5.100
12 LEU  HB2  15 GLN  HB2   4.300
12 LEU  HB2  15 GLN  HB3   4.100
12 LEU  HB3  15 GLN  H     4.200
12 LEU  HB3  15 GLN  HB2   5.100
12 LEU  HB3  15 GLN  HB3   5.200
12 LEU  HG   15 GLN  HB2   5.200
12 LEU  HG   15 GLN  HB3   5.200
12 LEU  QB   15 GLN  H     4.000
12 LEU  H    16 CYS  H     4.700
13 SER  HA   13 SER  H     3.100
13 SER  QB   13 SER  H     3.200
13 SER  H    14 SER  H     3.400
13 SER  HA   14 SER  H     3.700
13 SER  HA   14 SER  HA    5.100
13 SER  QB   14 SER  H     4.100
13 SER  HA   17 ARG  HA    5.200
14 SER  HA   14 SER  H     3.300
14 SER  HA   14 SER  QB    2.900
14 SER  QB   14 SER  H     3.700
14 SER  H    15 GLN  H     2.300
14 SER  H    15 GLN  HB2   5.100
14 SER  H    15 GLN  HB3   5.200
14 SER  HA   15 GLN  H     3.700
14 SER  HB2  15 GLN  H     4.500
14 SER  HB3  15 GLN  H     4.700
14 SER  QB   15 GLN  H     4.600
14 SER  H    16 CYS  H     4.800
14 SER  HA   16 CYS  H     5.100
15 GLN  HA   15 GLN  H     3.200
15 GLN  HA   15 GLN  HB2   2.800
15 GLN  HA   15 GLN  HB3   3.300
15 GLN  HA   15 GLN  HE21  4.900
15 GLN  HA   15 GLN  HE22  5.000
15 GLN  HB2  15 GLN  H     2.900
15 GLN  HB2  15 GLN  HE21  4.700
15 GLN  HB2  15 GLN  HE22  4.900
15 GLN  HB3  15 GLN  H     2.800
15 GLN  HB3  15 GLN  HE21  4.800
15 GLN  HB3  15 GLN  HE22  5.000
15 GLN  HA   15 GLN  QG    4.300
15 GLN  HB2  15 GLN  QG    2.900
15 GLN  HB3  15 GLN  QG    2.900
15 GLN  H    16 CYS  H     2.600
15 GLN  H    16 CYS  HB2   5.200
15 GLN  HA   16 CYS  H     3.600
15 GLN  HB2  16 CYS  H     4.100
15 GLN  HB3  16 CYS  H     3.000
15 GLN  HB3  16 CYS  HB2   4.500
15 GLN  QG   16 CYS  H     4.800
16 CYS  HA   16 CYS  H     3.200
16 CYS  HA   16 CYS  HB2   3.300
16 CYS  HA   16 CYS  HB3   3.100
16 CYS  HB2  16 CYS  H     2.900
16 CYS  HB3  16 CYS  H     4.000
16 CYS  H    17 ARG  H     4.700
16 CYS  HA   17 ARG  H     2.700
16 CYS  HA   17 ARG  HE    4.700
16 CYS  HB2  17 ARG  H     4.100
16 CYS  HB3  17 ARG  H     2.500
16 CYS  HB3  17 ARG  HA    5.200
16 CYS  HA   18 ALA  H     5.000
16 CYS  HB2  18 ALA  H     4.200
16 CYS  HB2  19 PRO  HA    5.200
17 ARG  HA   17 ARG  H     3.100
17 ARG  HA   17 ARG  QB    2.900
17 ARG  HA   17 ARG  QD    4.900
17 ARG  HA   17 ARG  QG    3.800
17 ARG  QB   17 ARG  H     2.500
17 ARG  QB   17 ARG  HE    5.200
17 ARG  QD   17 ARG  H     5.000
17 ARG  QD   17 ARG  HE    3.000
17 ARG  QG   17 ARG  H     4.800
17 ARG  QG   17 ARG  HE    4.000
17 ARG  QB   17 ARG  QD    3.800
17 ARG  QB   17 ARG  QG    2.700
17 ARG  QG   17 ARG  QD    2.700
17 ARG  H    18 ALA  H     3.300
17 ARG  HA   18 ALA  H     3.700
18 ALA  HA   18 ALA  H     3.200
18 ALA  HA   18 ALA  QB    2.800
18 ALA  QB   18 ALA  H     3.600
18 ALA  H    19 PRO  HD2   5.200
18 ALA  H    19 PRO  HD3   5.200
18 ALA  HA   19 PRO  HD2   2.700
18 ALA  HA   19 PRO  HD3   2.900
18 ALA  QB   19 PRO  HD2   3.400
18 ALA  QB   19 PRO  HD3   4.700
18 ALA  QB   22 CYS  H     4.500
18 ALA  QB   23 PHE  HA    4.100
18 ALA  QB   24 LYS  HA    4.900
19 PRO  HA   19 PRO  HB2   2.600
19 PRO  HA   19 PRO  HB3   3.000
19 PRO  HA   19 PRO  HD2   4.400
19 PRO  HA   19 PRO  HD3   4.000
19 PRO  HB2  19 PRO  HD2   4.100
19 PRO  HB2  19 PRO  HD3   3.200
19 PRO  HB3  19 PRO  HD2   4.400
19 PRO  HB3  19 PRO  HD3   4.200
19 PRO  HA   19 PRO  QG    4.200
19 PRO  HB2  19 PRO  QG    2.800
19 PRO  HB3  19 PRO  QG    2.700
19 PRO  QG   19 PRO  HD2   2.600
19 PRO  QG   19 PRO  HD3   2.800
19 PRO  HA   20 LYS  H     2.600
19 PRO  HB2  20 LYS  H     3.800
19 PRO  HB3  20 LYS  H     2.800
19 PRO  QG   20 LYS  H     5.000
19 PRO  HA   21 VAL  H     4.600
19 PRO  HB2  21 VAL  H     4.800
19 PRO  HB3  21 VAL  H     3.100
19 PRO  HB3  21 VAL  QG2   4.400
19 PRO  QG   21 VAL  HB    3.600
19 PRO  QG   21 VAL  QG2   4.500
19 PRO  HD2  26 LYS  QD    5.000
20 LYS  HA   20 LYS  H     3.100
20 LYS  HA   20 LYS  QB    2.900
20 LYS  HA   20 LYS  QD    5.000
20 LYS  HA   20 LYS  QG    4.200
20 LYS  QB   20 LYS  H     3.000
20 LYS  QD   20 LYS  H     5.000
20 LYS  QG   20 LYS  H     4.700
20 LYS  QB   20 LYS  QD    3.400
20 LYS  QB   20 LYS  QE    4.700
20 LYS  QD   20 LYS  QE    2.700
20 LYS  QG   20 LYS  QD    2.700
20 LYS  QG   20 LYS  QE    3.300
20 LYS  H    21 VAL  H     3.300
20 LYS  HA   21 VAL  H     3.600
20 LYS  QB   21 VAL  H     4.400
20 LYS  H    22 CYS  H     4.900
21 VAL  HA   21 VAL  H     3.100
21 VAL  HA   21 VAL  HB    3.300
21 VAL  HB   21 VAL  H     2.900
21 VAL  HA   21 VAL  QG1   3.300
21 VAL  HA   21 VAL  QG2   3.300
21 VAL  HB   21 VAL  QG1   2.700
21 VAL  HB   21 VAL  QG2   2.700
21 VAL  QG1  21 VAL  H     4.700
21 VAL  QG2  21 VAL  H     3.200
21 VAL  H    22 CYS  H     3.100
21 VAL  HA   22 CYS  H     3.800
21 VAL  HB   22 CYS  H     3.100
21 VAL  HB   22 CYS  HB2   4.100
21 VAL  HB   22 CYS  HB3   4.500
21 VAL  QG1  22 CYS  H     4.900
21 VAL  QG2  22 CYS  H     5.100
21 VAL  HB   26 LYS  HB2   5.200
21 VAL  HB   26 LYS  HB3   5.200
21 VAL  QG1  26 LYS  HA    5.100
21 VAL  HB   30 HIS  HE1   5.300
21 VAL  QG1  30 HIS  HE1   5.100
21 VAL  HB   31 PHE  HB3   5.200
21 VAL  HA   31 PHE  QD    5.200
21 VAL  QG1  31 PHE  QD    4.300
21 VAL  QG1  31 PHE  QE    4.700
22 CYS  HA   22 CYS  H     3.200
22 CYS  HA   22 CYS  HB2   2.800
22 CYS  HA   22 CYS  HB3   3.300
22 CYS  HB2  22 CYS  H     3.300
22 CYS  HB3  22 CYS  H     3.200
22 CYS  H    23 PHE  H     4.500
22 CYS  H    23 PHE  HA    5.200
22 CYS  HA   23 PHE  H     2.800
22 CYS  HA   23 PHE  HA    5.000
22 CYS  HA   23 PHE  HD2   3.900
22 CYS  HB2  23 PHE  H     3.800
22 CYS  HB3  23 PHE  H     3.000
22 CYS  HA   24 LYS  H     4.400
22 CYS  HB3  25 CYS  H     4.700
22 CYS  HB2  26 LYS  H     3.100
22 CYS  HB3  26 LYS  H     2.800
22 CYS  HB2  27 GLN  H     4.700
22 CYS  HA   30 HIS  HE1   4.700
22 CYS  HB2  30 HIS  HE1   2.800
22 CYS  HB3  30 HIS  HE1   4.100
22 CYS  HA   35 CYS  HB2   4.100
22 CYS  HA   35 CYS  HB3   3.700
23 PHE  HA   23 PHE  H     3.200
23 PHE  HA   23 PHE  HB2   2.700
23 PHE  HA   23 PHE  HB3   2.800
23 PHE  HB2  23 PHE  H     4.000
23 PHE  HB2  23 PHE  HD2   4.000
23 PHE  HB3  23 PHE  H     3.500
23 PHE  HB3  23 PHE  HD2   2.900
23 PHE  HD2  23 PHE  H     3.200
23 PHE  HA   23 PHE  QD    3.900
23 PHE  HB2  23 PHE  QE    4.900
23 PHE  HB3  23 PHE  QE    4.900
23 PHE  QE   23 PHE  H     5.200
23 PHE  H    24 LYS  H     2.000
23 PHE  HA   24 LYS  H     3.600
23 PHE  HA   24 LYS  HA    4.900
23 PHE  HB3  24 LYS  H     4.500
23 PHE  HD2  24 LYS  HB2   5.200
23 PHE  QE   24 LYS  HB2   5.100
23 PHE  QE   24 LYS  HB3   4.300
23 PHE  H    26 LYS  H     4.200
24 LYS  HA   24 LYS  H     3.200
24 LYS  HA   24 LYS  HB2   3.300
24 LYS  HA   24 LYS  HB3   3.300
24 LYS  HB2  24 LYS  H     4.400
24 LYS  HB3  24 LYS  H     4.100
24 LYS  HA   24 LYS  QD    5.000
24 LYS  HA   24 LYS  QE    5.300
24 LYS  HA   24 LYS  QG    3.900
24 LYS  HB2  24 LYS  QD    3.300
24 LYS  HB2  24 LYS  QE    4.700
24 LYS  HB2  24 LYS  QG    2.900
24 LYS  HB3  24 LYS  QD    3.900
24 LYS  HB3  24 LYS  QE    4.900
24 LYS  HB3  24 LYS  QG    2.900
24 LYS  QG   24 LYS  H     5.000
24 LYS  QD   24 LYS  QE    2.700
24 LYS  QD   24 LYS  QZ    3.600
24 LYS  QE   24 LYS  QZ    2.500
24 LYS  QG   24 LYS  QD    2.700
24 LYS  QG   24 LYS  QE    3.900
24 LYS  QG   24 LYS  QZ    4.900
24 LYS  H    25 CYS  H     2.800
24 LYS  HA   25 CYS  H     3.800
24 LYS  HB2  25 CYS  H     4.100
24 LYS  HB3  25 CYS  HA    4.700
24 LYS  QD   25 CYS  H     5.200
24 LYS  QG   25 CYS  H     4.900
24 LYS  H    26 LYS  H     3.300
24 LYS  H    26 LYS  HA    5.100
24 LYS  H    26 LYS  HB3   4.200
24 LYS  HB3  26 LYS  H     5.200
25 CYS  HA   25 CYS  H     3.200
25 CYS  HB2  25 CYS  H     3.600
25 CYS  HB3  25 CYS  H     3.500
25 CYS  H    26 LYS  H     3.000
25 CYS  H    26 LYS  HB3   5.100
25 CYS  H    26 LYS  HG2   5.200
25 CYS  HA   26 LYS  H     3.800
25 CYS  HB2  26 LYS  H     3.400
25 CYS  HB3  26 LYS  H     4.500
25 CYS  HA   27 GLN  H     4.600
25 CYS  HB2  27 GLN  H     3.800
25 CYS  HB2  27 GLN  QG    4.500
26 LYS  HA   26 LYS  H     2.600
26 LYS  HA   26 LYS  HB2   2.700
26 LYS  HA   26 LYS  HB3   2.700
26 LYS  HB2  26 LYS  H     4.100
26 LYS  HB2  26 LYS  HG2   3.300
26 LYS  HB3  26 LYS  H     3.000
26 LYS  HB3  26 LYS  HG2   3.300
26 LYS  HG2  26 LYS  H     4.200
26 LYS  HB2  26 LYS  QD    3.800
26 LYS  HB2  26 LYS  QE    5.000
26 LYS  HB3  26 LYS  QD    3.600
26 LYS  HB3  26 LYS  QE    4.900
26 LYS  HG2  26 LYS  QD    2.900
26 LYS  HG2  26 LYS  QE    4.200
26 LYS  HG2  26 LYS  QZ    4.700
26 LYS  QD   26 LYS  H     5.200
26 LYS  QD   26 LYS  QE    2.700
26 LYS  QD   26 LYS  QZ    3.600
26 LYS  H    27 GLN  H     3.400
26 LYS  H    27 GLN  HE22  5.200
26 LYS  HA   27 GLN  H     3.100
26 LYS  HA   27 GLN  HA    5.000
26 LYS  HB2  27 GLN  H     4.800
26 LYS  HG2  27 GLN  HE21  5.100
26 LYS  H    30 HIS  HE1   3.400
26 LYS  HB3  30 HIS  HE1   5.100
27 GLN  HA   27 GLN  H     3.200
27 GLN  HA   27 GLN  HB2   3.300
27 GLN  HA   27 GLN  HB3   2.800
27 GLN  HA   27 GLN  HE21  5.200
27 GLN  HA   27 GLN  HE22  5.000
27 GLN  HB2  27 GLN  H     2.800
27 GLN  HB2  27 GLN  HE21  5.000
27 GLN  HB2  27 GLN  HE22  5.000
27 GLN  HB3  27 GLN  H     3.900
27 GLN  HB3  27 GLN  HE21  4.900
27 GLN  HB3  27 GLN  HE22  5.000
27 GLN  HE21 27 GLN  H     5.300
27 GLN  HB2  27 GLN  QG    2.900
27 GLN  HB3  27 GLN  QG    2.900
27 GLN  QG   27 GLN  H     2.700
27 GLN  QG   27 GLN  HE22  4.000
27 GLN  HA   28 PRO  QD    2.600
27 GLN  HA   29 GLY  H     4.900
27 GLN  HB2  29 GLY  H     4.100
27 GLN  HB3  29 GLY  H     3.800
27 GLN  H    30 HIS  H     5.200
27 GLN  H    30 HIS  HD2   5.100
27 GLN  H    30 HIS  HE1   3.400
27 GLN  HB2  30 HIS  H     3.400
27 GLN  HB2  30 HIS  HA    5.100
27 GLN  HB2  30 HIS  HB2   4.100
27 GLN  HB2  30 HIS  HD2   4.900
27 GLN  HB2  30 HIS  HE1   4.600
27 GLN  HB3  30 HIS  H     4.100
28 PRO  HA   28 PRO  HB2   2.400
28 PRO  HA   28 PRO  HB3   3.000
28 PRO  HA   28 PRO  QD    3.900
28 PRO  HA   28 PRO  QG    4.100
28 PRO  HB2  28 PRO  QD    4.200
28 PRO  HB2  28 PRO  QG    2.800
28 PRO  HB3  28 PRO  QD    4.200
28 PRO  HB3  28 PRO  QG    2.800
28 PRO  QG   28 PRO  QD    2.600
28 PRO  HA   29 GLY  H     3.800
28 PRO  HB2  29 GLY  H     4.900
28 PRO  HB3  29 GLY  H     4.100
28 PRO  QG   29 GLY  H     5.100
28 PRO  HA   30 HIS  H     5.000
28 PRO  HB3  30 HIS  H     5.200
29 GLY  H    29 GLY  HA3   3.000
29 GLY  HA2  29 GLY  H     3.300
29 GLY  HA2  29 GLY  HA3   2.000
29 GLY  H    30 HIS  H     2.300
29 GLY  H    30 HIS  HA    4.800
29 GLY  HA2  30 HIS  H     3.600
29 GLY  HA3  30 HIS  H     3.500
29 GLY  H    31 PHE  H     4.700
29 GLY  HA2  31 PHE  H     4.200
29 GLY  HA2  31 PHE  QD    4.900
29 GLY  HA2  31 PHE  QE    4.300
29 GLY  HA2  32 SER  H     4.700
30 HIS  HA   30 HIS  H     3.200
30 HIS  HA   30 HIS  HB2   2.600
30 HIS  HA   30 HIS  HD2   4.900
30 HIS  HB2  30 HIS  H     3.900
30 HIS  HB2  30 HIS  HD2   2.800
30 HIS  HD2  30 HIS  HE1   4.500
30 HIS  HE1  30 HIS  H     5.200
30 HIS  H    31 PHE  H     3.000
30 HIS  HA   31 PHE  H     3.800
30 HIS  HB2  31 PHE  H     4.400
30 HIS  HD2  31 PHE  HA    4.500
30 HIS  HE1  31 PHE  H     4.400
30 HIS  HA   32 SER  H     4.600
30 HIS  HA   33 LYS  H     4.200
30 HIS  HD2  34 GLN  HE22  3.500
30 HIS  HB2  34 GLN  QB    4.700
30 HIS  HD2  34 GLN  QB    3.900
30 HIS  HD2  34 GLN  QG    5.100
30 HIS  HD2  35 CYS  H     5.000
30 HIS  HD2  35 CYS  HB2   5.100
31 PHE  HA   31 PHE  H     3.100
31 PHE  HA   31 PHE  HB2   2.800
31 PHE  HA   31 PHE  HB3   2.800
31 PHE  HB2  31 PHE  H     3.800
31 PHE  HB3  31 PHE  H     2.900
31 PHE  HA   31 PHE  QD    4.000
31 PHE  HB2  31 PHE  QD    2.600
31 PHE  HB3  31 PHE  QD    2.500
31 PHE  HB3  31 PHE  QE    4.900
31 PHE  QD   31 PHE  H     3.500
31 PHE  QE   31 PHE  H     4.900
31 PHE  H    32 SER  H     3.200
31 PHE  HA   32 SER  H     3.700
31 PHE  HB2  32 SER  H     4.300
31 PHE  HB3  32 SER  H     4.400
31 PHE  QD   32 SER  HA    5.100
31 PHE  QE   32 SER  H     4.800
31 PHE  H    33 LYS  H     4.700
31 PHE  QD   35 CYS  HB2   5.500
31 PHE  HA   36 ARG  H     3.400
32 SER  HA   32 SER  H     3.100
32 SER  HA   32 SER  HB2   3.300
32 SER  HA   32 SER  HB3   2.700
32 SER  HB2  32 SER  H     2.800
32 SER  HB3  32 SER  H     3.700
32 SER  H    33 LYS  H     3.100
32 SER  HA   33 LYS  H     3.600
32 SER  HB2  33 LYS  H     3.800
32 SER  HB3  33 LYS  H     4.600
32 SER  HB2  33 LYS  QB    5.200
32 SER  HB2  33 LYS  QG    5.000
32 SER  H    34 GLN  H     4.800
32 SER  HA   34 GLN  H     4.600
32 SER  H    36 ARG  H     5.400
32 SER  HA   36 ARG  H     4.800
32 SER  H    36 ARG  QB    5.000
32 SER  HA   37 SER  H     5.100
33 LYS  HA   33 LYS  H     3.200
33 LYS  HA   33 LYS  QB    3.000
33 LYS  HA   33 LYS  QD    5.000
33 LYS  HA   33 LYS  QE    5.200
33 LYS  HA   33 LYS  QG    4.000
33 LYS  QB   33 LYS  H     3.800
33 LYS  QD   33 LYS  H     5.200
33 LYS  QE   33 LYS  H     5.200
33 LYS  QG   33 LYS  H     4.900
33 LYS  QB   33 LYS  QD    3.400
33 LYS  QB   33 LYS  QE    4.800
33 LYS  QB   33 LYS  QG    2.800
33 LYS  QD   33 LYS  QE    2.700
33 LYS  QG   33 LYS  QE    3.300
33 LYS  H    34 GLN  H     2.400
33 LYS  H    34 GLN  HA    5.100
33 LYS  H    34 GLN  HB2   4.700
33 LYS  H    34 GLN  HB3   4.500
33 LYS  HA   34 GLN  H     3.200
33 LYS  QB   34 GLN  H     4.800
33 LYS  H    35 CYS  H     4.800
33 LYS  H    36 ARG  H     4.700
33 LYS  H    37 SER  HA    5.100
33 LYS  HA   37 SER  H     5.000
34 GLN  HA   34 GLN  H     3.200
34 GLN  HA   34 GLN  HB2   2.800
34 GLN  HA   34 GLN  HB3   3.300
34 GLN  HB2  34 GLN  H     3.600
34 GLN  HB2  34 GLN  HE21  4.700
34 GLN  HB2  34 GLN  HE22  4.800
34 GLN  HB3  34 GLN  H     3.300
34 GLN  HB3  34 GLN  HE21  4.400
34 GLN  HB3  34 GLN  HE22  4.400
34 GLN  HA   34 GLN  QG    3.700
34 GLN  HB2  34 GLN  QG    2.900
34 GLN  HB3  34 GLN  QG    2.900
34 GLN  QG   34 GLN  H     5.100
34 GLN  QG   34 GLN  HE21  4.000
34 GLN  QG   34 GLN  HE22  4.000
34 GLN  H    35 CYS  H     3.200
34 GLN  HA   35 CYS  H     3.700
34 GLN  HB2  35 CYS  H     3.700
34 GLN  HB3  35 CYS  H     2.300
34 GLN  HE21 35 CYS  H     5.200
34 GLN  HE21 35 CYS  HB2   4.800
34 GLN  HE21 35 CYS  HB3   4.900
34 GLN  HA   36 ARG  H     5.200
34 GLN  H    37 SER  H     4.000
34 GLN  H    37 SER  HA    4.700
34 GLN  HA   37 SER  H     4.500
35 CYS  HA   35 CYS  H     3.300
35 CYS  HA   35 CYS  HB2   3.300
35 CYS  HA   35 CYS  HB3   2.700
35 CYS  HB2  35 CYS  H     2.700
35 CYS  HB3  35 CYS  H     3.600
35 CYS  H    36 ARG  H     3.200
35 CYS  HA   36 ARG  H     3.500
35 CYS  HA   36 ARG  HE    4.900
35 CYS  HB2  36 ARG  H     3.900
35 CYS  HB2  36 ARG  HE    4.700
35 CYS  HB3  36 ARG  H     4.500
35 CYS  HB3  36 ARG  HE    4.200
35 CYS  H    36 ARG  QB    4.700
35 CYS  HB2  36 ARG  QB    5.100
35 CYS  H    37 SER  H     4.800
36 ARG  HA   36 ARG  H     3.300
36 ARG  HA   36 ARG  HE    2.900
36 ARG  HE   36 ARG  H     4.500
36 ARG  HA   36 ARG  QB    3.000
36 ARG  HA   36 ARG  QD    4.200
36 ARG  HA   36 ARG  QG    3.700
36 ARG  QB   36 ARG  H     3.500
36 ARG  QB   36 ARG  HE    4.900
36 ARG  QD   36 ARG  HE    3.000
36 ARG  QG   36 ARG  H     5.200
36 ARG  QG   36 ARG  HE    4.000
36 ARG  QB   36 ARG  QD    3.900
36 ARG  QB   36 ARG  QG    2.700
36 ARG  QG   36 ARG  QD    2.700
36 ARG  H    37 SER  H     2.500
36 ARG  HA   37 SER  H     3.300
36 ARG  H    37 SER  QB    5.200
36 ARG  QB   37 SER  H     4.400
37 SER  HA   37 SER  H     3.200
37 SER  HA   37 SER  QB    2.900
37 SER  QB   37 SER  H     3.500
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLN  22           H3       GLN  22  -8.017  -0.764  -7.344
    2    H2   GLN  22           H2       GLN  22  -7.484   0.549  -6.520
    3    H3   GLN  22           H1       GLN  22  -6.741   0.096  -7.915
    4    HA   GLN  22           HA       GLN  22  -5.971  -1.942  -6.911
    5   1HB   GLN  22          1HB       GLN  22  -5.142   0.752  -6.076
    6   2HB   GLN  22          2HB       GLN  22  -4.796  -0.413  -4.823
    7   1HG   GLN  22          1HG       GLN  22  -3.942  -0.712  -7.740
    8   2HG   GLN  22          2HG       GLN  22  -2.941  -0.024  -6.465
    9   1HE2  GLN  22          1HE2      GLN  22  -1.800  -2.109  -7.751
   10   2HE2  GLN  22          2HE2      GLN  22  -1.879  -3.551  -6.744
   11    H    THR  23           H        THR  23  -5.314  -2.625  -4.462
   12    HA   THR  23           HA       THR  23  -7.879  -3.009  -2.943
   13    HB   THR  23           HB       THR  23  -5.527  -4.908  -3.317
   14    HG1  THR  23           HG1      THR  23  -6.780  -4.834  -5.145
   15   1HG2  THR  23          1HG2      THR  23  -8.199  -5.380  -1.925
   16   2HG2  THR  23          2HG2      THR  23  -6.970  -6.609  -2.272
   17   3HG2  THR  23          3HG2      THR  23  -6.605  -5.312  -1.132
   18    H    CYS  24           H        CYS  24  -7.767  -2.860  -0.694
   19    HA   CYS  24           HA       CYS  24  -5.922  -1.008   0.369
   20   1HB   CYS  24          1HB       CYS  24  -8.312  -1.602   1.100
   21   2HB   CYS  24          2HB       CYS  24  -7.603  -2.972   1.960
   22    H    TYR  25           H        TYR  25  -4.284  -1.134   1.886
   23    HA   TYR  25           HA       TYR  25  -2.674  -3.529   2.146
   24   1HB   TYR  25          1HB       TYR  25  -1.201  -2.279   3.355
   25   2HB   TYR  25          2HB       TYR  25  -1.877  -1.082   2.274
   26    HD1  TYR  25           HD1      TYR  25  -0.835  -1.657   5.543
   27    HD2  TYR  25           HD2      TYR  25  -4.128   0.144   3.408
   28    HE1  TYR  25           HE1      TYR  25  -1.371  -0.267   7.534
   29    HE2  TYR  25           HE2      TYR  25  -4.693   1.472   5.419
   30    HH   TYR  25           HH       TYR  25  -2.803   1.272   8.449
   31    H    ASN  26           H        ASN  26  -5.432  -2.341   3.915
   32    HA   ASN  26           HA       ASN  26  -4.960  -4.340   6.104
   33   1HB   ASN  26          1HB       ASN  26  -4.123  -2.093   6.714
   34   2HB   ASN  26          2HB       ASN  26  -5.711  -1.399   6.385
   35   1HD2  ASN  26          1HD2      ASN  26  -3.922  -3.637   8.524
   36   2HD2  ASN  26          2HD2      ASN  26  -5.086  -3.530   9.835
   37    H    CYS  27           H        CYS  27  -7.489  -2.285   4.514
   38    HA   CYS  27           HA       CYS  27  -9.687  -3.468   5.899
   39   1HB   CYS  27          1HB       CYS  27  -9.629  -2.153   3.144
   40   2HB   CYS  27          2HB       CYS  27 -11.048  -2.409   4.160
   41    H    GLY  28           H        GLY  28  -7.783  -4.639   3.220
   42   1HA   GLY  28          2HA       GLY  28  -9.171  -7.142   2.901
   43   2HA   GLY  28          1HA       GLY  28  -7.894  -6.496   1.867
   44    H    LYS  29           H        LYS  29 -10.039  -4.068   1.726
   45    HA   LYS  29           HA       LYS  29 -12.038  -5.207  -0.132
   46   1HB   LYS  29          1HB       LYS  29 -11.657  -2.611   1.359
   47   2HB   LYS  29          2HB       LYS  29 -12.495  -2.528  -0.171
   48   1HG   LYS  29          1HG       LYS  29 -14.120  -2.655   1.491
   49   2HG   LYS  29          2HG       LYS  29 -14.181  -4.159   0.585
   50   1HD   LYS  29          1HD       LYS  29 -12.655  -3.945   3.208
   51   2HD   LYS  29          2HD       LYS  29 -14.406  -4.165   3.188
   52   1HE   LYS  29          1HE       LYS  29 -14.230  -6.246   1.944
   53   2HE   LYS  29          2HE       LYS  29 -12.481  -6.052   1.781
   54   1HZ   LYS  29          2HZ       LYS  29 -13.894  -6.372   4.371
   55   2HZ   LYS  29          3HZ       LYS  29 -13.032  -7.541   3.618
   56   3HZ   LYS  29          1HZ       LYS  29 -12.272  -6.200   4.179
   57    HA   PRO  30           HA       PRO  30 -10.002  -3.423  -3.837
   58   1HB   PRO  30          2HB       PRO  30 -12.058  -3.570  -5.589
   59   2HB   PRO  30          1HB       PRO  30 -11.263  -5.045  -4.976
   60   1HG   PRO  30          1HG       PRO  30 -13.819  -3.760  -3.955
   61   2HG   PRO  30          2HG       PRO  30 -13.554  -5.473  -4.421
   62   1HD   PRO  30          1HD       PRO  30 -13.377  -4.573  -1.833
   63   2HD   PRO  30          2HD       PRO  30 -12.377  -5.924  -2.447
   64    H    GLY  31           H        GLY  31 -11.219  -1.616  -5.519
   65   1HA   GLY  31          2HA       GLY  31 -12.921   0.351  -4.355
   66   2HA   GLY  31          1HA       GLY  31 -11.838   0.601  -5.733
   67    H    HIS  32           H        HIS  32  -9.428  -0.066  -4.179
   68    HA   HIS  32           HA       HIS  32  -9.235   2.218  -2.270
   69   1HB   HIS  32          1HB       HIS  32  -8.319  -0.629  -2.179
   70   2HB   HIS  32          2HB       HIS  32  -7.229   0.576  -1.512
   71    HD1  HIS  32           HD1      HIS  32 -10.904  -0.562  -0.975
   72    HD2  HIS  32           HD2      HIS  32  -7.705   1.462   0.864
   73    HE1  HIS  32           HE1      HIS  32 -11.607  -0.144   1.454
   74    H    LEU  33           H        LEU  33  -7.348   3.289  -2.058
   75    HA   LEU  33           HA       LEU  33  -5.269   3.367  -4.121
   76   1HB   LEU  33          1HB       LEU  33  -7.369   5.561  -3.686
   77   2HB   LEU  33          2HB       LEU  33  -5.856   5.833  -4.535
   78    HG   LEU  33           HG       LEU  33  -8.054   3.954  -5.486
   79   1HD1  LEU  33          3HD1      LEU  33  -8.700   6.323  -5.570
   80   2HD1  LEU  33          1HD1      LEU  33  -7.206   6.711  -6.451
   81   3HD1  LEU  33          2HD1      LEU  33  -8.441   5.667  -7.195
   82   1HD2  LEU  33          3HD2      LEU  33  -5.482   4.902  -6.839
   83   2HD2  LEU  33          1HD2      LEU  33  -5.820   3.243  -6.299
   84   3HD2  LEU  33          2HD2      LEU  33  -6.770   3.950  -7.610
   85    H    SER  34           H        SER  34  -3.752   5.160  -3.565
   86    HA   SER  34           HA       SER  34  -2.888   5.386  -0.906
   87   1HB   SER  34          1HB       SER  34  -2.465   7.304  -3.229
   88   2HB   SER  34          2HB       SER  34  -1.419   7.124  -1.809
   89    HG   SER  34           HG       SER  34  -0.748   5.937  -3.751
   90    H    SER  35           H        SER  35  -5.673   6.851  -2.082
   91    HA   SER  35           HA       SER  35  -5.694   8.965   0.030
   92   1HB   SER  35          1HB       SER  35  -7.357  10.098  -1.421
   93   2HB   SER  35          2HB       SER  35  -5.775   9.913  -2.203
   94    HG   SER  35           HG       SER  35  -7.532   9.317  -3.587
   95    H    GLN  36           H        GLN  36  -7.125   5.979  -0.935
   96    HA   GLN  36           HA       GLN  36  -9.652   6.360   0.548
   97   1HB   GLN  36          1HB       GLN  36  -9.325   4.849  -1.520
   98   2HB   GLN  36          2HB       GLN  36  -8.397   3.781  -0.466
   99   1HG   GLN  36          1HG       GLN  36 -10.566   2.861  -0.514
  100   2HG   GLN  36          2HG       GLN  36 -10.492   3.673   1.041
  101   1HE2  GLN  36          2HE2      GLN  36 -12.041   3.562  -2.123
  102   2HE2  GLN  36          1HE2      GLN  36 -13.203   4.842  -1.784
  103    H    CYS  37           H        CYS  37  -6.487   4.821   0.911
  104    HA   CYS  37           HA       CYS  37  -6.620   4.921   3.851
  105   1HB   CYS  37          1HB       CYS  37  -6.179   2.433   2.163
  106   2HB   CYS  37          2HB       CYS  37  -5.385   2.591   3.718
  107    H    ARG  38           H        ARG  38  -4.306   4.353   4.696
  108    HA   ARG  38           HA       ARG  38  -2.488   6.326   3.830
  109   1HB   ARG  38          1HB       ARG  38  -1.982   3.770   5.426
  110   2HB   ARG  38          2HB       ARG  38  -0.772   5.006   5.128
  111   1HG   ARG  38          1HG       ARG  38  -1.403   5.721   7.130
  112   2HG   ARG  38          2HG       ARG  38  -2.551   6.664   6.199
  113   1HD   ARG  38          1HD       ARG  38  -3.214   3.938   7.387
  114   2HD   ARG  38          2HD       ARG  38  -3.310   5.408   8.342
  115    HE   ARG  38           HE       ARG  38  -4.928   6.271   6.576
  116   1HH1  ARG  38          1HH2      ARG  38  -4.840   2.847   7.442
  117   2HH1  ARG  38          2HH2      ARG  38  -6.540   2.665   7.095
  118   1HH2  ARG  38          1HH1      ARG  38  -7.085   5.915   6.201
  119   2HH2  ARG  38          2HH1      ARG  38  -7.720   4.302   6.307
  120    H    ALA  39           H        ALA  39  -2.673   2.980   2.734
  121    HA   ALA  39           HA       ALA  39  -1.416   3.735   0.247
  122   1HB   ALA  39          3HB       ALA  39  -0.080   1.611   1.993
  123   2HB   ALA  39          1HB       ALA  39   0.375   1.999   0.328
  124   3HB   ALA  39          2HB       ALA  39   0.617   3.203   1.606
  125    HA   PRO  40           HA       PRO  40  -3.770  -0.078  -0.899
  126   1HB   PRO  40          2HB       PRO  40  -2.706  -0.653  -3.325
  127   2HB   PRO  40          1HB       PRO  40  -3.780   0.760  -3.074
  128   1HG   PRO  40          1HG       PRO  40  -0.745   0.727  -3.140
  129   2HG   PRO  40          2HG       PRO  40  -1.858   1.814  -4.030
  130   1HD   PRO  40          1HD       PRO  40  -0.680   2.507  -1.650
  131   2HD   PRO  40          2HD       PRO  40  -2.309   3.078  -2.107
  132    H    LYS  41           H        LYS  41  -3.114  -2.370  -1.467
  133    HA   LYS  41           HA       LYS  41  -1.434  -3.450   0.454
  134   1HB   LYS  41          1HB       LYS  41  -3.339  -4.528  -0.844
  135   2HB   LYS  41          2HB       LYS  41  -2.224  -4.775  -2.175
  136   1HG   LYS  41          1HG       LYS  41  -2.557  -6.811  -0.880
  137   2HG   LYS  41          2HG       LYS  41  -0.873  -6.309  -0.791
  138   1HD   LYS  41          1HD       LYS  41  -1.226  -5.405   1.479
  139   2HD   LYS  41          2HD       LYS  41  -2.966  -5.766   1.363
  140   1HE   LYS  41          1HE       LYS  41  -2.440  -8.180   1.147
  141   2HE   LYS  41          2HE       LYS  41  -0.713  -7.818   1.267
  142   1HZ   LYS  41          2HZ       LYS  41  -2.719  -7.251   3.391
  143   2HZ   LYS  41          3HZ       LYS  41  -1.648  -8.481   3.417
  144   3HZ   LYS  41          1HZ       LYS  41  -1.120  -6.940   3.507
  145    H    VAL  42           H        VAL  42  -0.310  -2.223  -2.516
  146    HA   VAL  42           HA       VAL  42   2.189  -3.480  -2.926
  147    HB   VAL  42           HB       VAL  42   1.481  -0.524  -3.149
  148   1HG1  VAL  42          2HG1      VAL  42   3.663  -2.147  -4.518
  149   2HG1  VAL  42          3HG1      VAL  42   3.218  -0.477  -4.931
  150   3HG1  VAL  42          1HG1      VAL  42   3.897  -0.829  -3.346
  151   1HG2  VAL  42          1HG2      VAL  42   1.240  -2.763  -5.207
  152   2HG2  VAL  42          2HG2      VAL  42  -0.107  -1.860  -4.475
  153   3HG2  VAL  42          3HG2      VAL  42   1.021  -1.031  -5.542
  154    H    CYS  43           H        CYS  43   1.208  -1.208  -0.397
  155    HA   CYS  43           HA       CYS  43   3.764  -1.521   1.057
  156   1HB   CYS  43          1HB       CYS  43   3.922   0.384  -0.608
  157   2HB   CYS  43          2HB       CYS  43   2.623   1.198   0.272
  158    H    PHE  44           H        PHE  44   3.136   0.599   2.800
  159    HA   PHE  44           HA       PHE  44   0.446   0.183   3.960
  160   1HB   PHE  44          1HB       PHE  44   1.196  -0.252   6.152
  161   2HB   PHE  44          2HB       PHE  44   2.057  -1.382   5.127
  162    HD1  PHE  44           HD1      PHE  44   2.331   1.296   7.558
  163    HD2  PHE  44           HD2      PHE  44   4.527  -0.851   4.526
  164    HE1  PHE  44           HE1      PHE  44   4.465   2.150   8.496
  165    HE2  PHE  44           HE2      PHE  44   6.657   0.013   5.466
  166    HZ   PHE  44           HZ       PHE  44   6.630   1.518   7.445
  167    H    LYS  45           H        LYS  45   3.259   2.234   3.460
  168    HA   LYS  45           HA       LYS  45   1.730   4.638   4.242
  169   1HB   LYS  45          1HB       LYS  45   2.698   3.788   6.368
  170   2HB   LYS  45          2HB       LYS  45   4.317   3.861   5.666
  171   1HG   LYS  45          1HG       LYS  45   4.089   6.331   5.429
  172   2HG   LYS  45          2HG       LYS  45   2.443   6.236   6.090
  173   1HD   LYS  45          1HD       LYS  45   3.362   5.313   8.210
  174   2HD   LYS  45          2HD       LYS  45   5.004   5.412   7.537
  175   1HE   LYS  45          1HE       LYS  45   4.735   7.872   7.267
  176   2HE   LYS  45          2HE       LYS  45   3.105   7.769   7.945
  177   1HZ   LYS  45          1HZ       LYS  45   4.097   6.953  10.022
  178   2HZ   LYS  45          2HZ       LYS  45   5.604   7.058   9.394
  179   3HZ   LYS  45          3HZ       LYS  45   4.724   8.408   9.636
  180    H    CYS  46           H        CYS  46   5.102   3.601   3.416
  181    HA   CYS  46           HA       CYS  46   5.748   6.156   2.338
  182   1HB   CYS  46          1HB       CYS  46   7.862   4.730   1.625
  183   2HB   CYS  46          2HB       CYS  46   7.551   5.216   3.287
  184    H    LYS  47           H        LYS  47   4.734   3.197   0.737
  185    HA   LYS  47           HA       LYS  47   4.182   2.700  -1.430
  186   1HB   LYS  47          1HB       LYS  47   2.247   4.021  -2.097
  187   2HB   LYS  47          2HB       LYS  47   2.273   3.666  -0.376
  188   1HG   LYS  47          1HG       LYS  47   3.046   5.936   0.136
  189   2HG   LYS  47          2HG       LYS  47   3.131   6.337  -1.579
  190   1HD   LYS  47          1HD       LYS  47   0.791   6.241  -1.831
  191   2HD   LYS  47          2HD       LYS  47   0.530   5.402  -0.294
  192   1HE   LYS  47          1HE       LYS  47   1.701   8.214  -0.483
  193   2HE   LYS  47          2HE       LYS  47  -0.036   7.909  -0.363
  194   1HZ   LYS  47          1HZ       LYS  47   1.946   7.002   1.664
  195   2HZ   LYS  47          2HZ       LYS  47   0.939   8.287   1.828
  196   3HZ   LYS  47          3HZ       LYS  47   0.334   6.766   1.731
  197    H    GLN  48           H        GLN  48   6.769   4.219  -1.626
  198    HA   GLN  48           HA       GLN  48   6.638   5.774  -4.032
  199   1HB   GLN  48          1HB       GLN  48   9.003   4.295  -2.811
  200   2HB   GLN  48          2HB       GLN  48   9.114   5.513  -4.072
  201   1HG   GLN  48          1HG       GLN  48   8.204   5.936  -1.201
  202   2HG   GLN  48          2HG       GLN  48   9.689   6.499  -1.940
  203   1HE2  GLN  48          2HE2      GLN  48   6.422   7.335  -1.268
  204   2HE2  GLN  48          1HE2      GLN  48   6.384   8.803  -2.252
  205    HA   PRO  49           HA       PRO  49   5.986   3.193  -7.341
  206   1HB   PRO  49          2HB       PRO  49   8.564   4.106  -8.633
  207   2HB   PRO  49          1HB       PRO  49   6.933   3.958  -9.362
  208   1HG   PRO  49          1HG       PRO  49   7.806   6.369  -8.523
  209   2HG   PRO  49          2HG       PRO  49   6.133   5.847  -8.131
  210   1HD   PRO  49          1HD       PRO  49   8.579   5.825  -6.364
  211   2HD   PRO  49          2HD       PRO  49   6.898   6.301  -5.987
  212    H    GLY  50           H        GLY  50   9.220   2.494  -6.091
  213   1HA   GLY  50          2HA       GLY  50  10.291   0.472  -7.444
  214   2HA   GLY  50          1HA       GLY  50   8.857  -0.366  -6.853
  215    H    HIS  51           H        HIS  51   9.610   1.688  -4.372
  216    HA   HIS  51           HA       HIS  51  11.945   0.597  -3.197
  217   1HB   HIS  51          1HB       HIS  51  11.380   1.863  -1.311
  218   2HB   HIS  51          2HB       HIS  51  10.693   2.775  -2.642
  219    HD1  HIS  51           HD1      HIS  51   7.787   1.931  -2.951
  220    HD2  HIS  51           HD2      HIS  51   9.860   1.393   0.680
  221    HE1  HIS  51           HE1      HIS  51   6.047   1.340  -1.206
  222    H    PHE  52           H        PHE  52   8.651  -0.630  -3.139
  223    HA   PHE  52           HA       PHE  52   8.665  -1.960  -0.675
  224   1HB   PHE  52          1HB       PHE  52   6.759  -3.286  -1.662
  225   2HB   PHE  52          2HB       PHE  52   6.606  -1.543  -1.683
  226    HD1  PHE  52           HD1      PHE  52   7.083  -4.548  -3.806
  227    HD2  PHE  52           HD2      PHE  52   6.554  -0.264  -3.759
  228    HE1  PHE  52           HE1      PHE  52   6.639  -4.569  -6.246
  229    HE2  PHE  52           HE2      PHE  52   6.106  -0.295  -6.194
  230    HZ   PHE  52           HZ       PHE  52   6.156  -2.442  -7.447
  231    H    SER  53           H        SER  53   9.619  -3.296  -3.868
  232    HA   SER  53           HA       SER  53  10.180  -5.933  -3.075
  233   1HB   SER  53          1HB       SER  53  11.582  -4.264  -5.196
  234   2HB   SER  53          2HB       SER  53  11.570  -6.037  -5.094
  235    HG   SER  53           HG       SER  53   9.978  -5.258  -6.546
  236    H    LYS  54           H        LYS  54  11.840  -3.216  -1.924
  237    HA   LYS  54           HA       LYS  54  14.038  -4.918  -0.870
  238   1HB   LYS  54          1HB       LYS  54  15.681  -3.168  -1.279
  239   2HB   LYS  54          2HB       LYS  54  14.948  -3.712  -2.783
  240   1HG   LYS  54          1HG       LYS  54  13.544  -1.697  -2.895
  241   2HG   LYS  54          2HG       LYS  54  14.096  -1.185  -1.293
  242   1HD   LYS  54          1HD       LYS  54  15.242   0.114  -2.951
  243   2HD   LYS  54          2HD       LYS  54  16.411  -0.959  -2.168
  244   1HE   LYS  54          1HE       LYS  54  16.242  -2.528  -4.104
  245   2HE   LYS  54          2HE       LYS  54  15.067  -1.450  -4.870
  246   1HZ   LYS  54          1HZ       LYS  54  16.804   0.266  -4.944
  247   2HZ   LYS  54          2HZ       LYS  54  17.884  -0.738  -4.239
  248   3HZ   LYS  54          3HZ       LYS  54  17.309  -1.073  -5.727
  249    H    GLN  55           H        GLN  55  11.423  -3.562   0.183
  250    HA   GLN  55           HA       GLN  55  12.613  -2.987   2.811
  251   1HB   GLN  55          1HB       GLN  55  12.571  -0.765   1.577
  252   2HB   GLN  55          2HB       GLN  55  10.811  -0.890   1.530
  253   1HG   GLN  55          1HG       GLN  55  10.880  -1.084   4.093
  254   2HG   GLN  55          2HG       GLN  55  12.607  -0.728   3.997
  255   1HE2  GLN  55          1HE2      GLN  55   9.342   0.546   3.578
  256   2HE2  GLN  55          2HE2      GLN  55   9.809   2.239   3.514
  257    H    CYS  56           H        CYS  56   9.462  -2.740   1.081
  258    HA   CYS  56           HA       CYS  56   8.055  -3.617   3.524
  259   1HB   CYS  56          1HB       CYS  56   7.035  -2.299   0.975
  260   2HB   CYS  56          2HB       CYS  56   6.109  -2.587   2.451
  261    H    ARG  57           H        ARG  57   9.093  -5.088   0.721
  262    HA   ARG  57           HA       ARG  57   7.350  -7.444   1.045
  263   1HB   ARG  57          1HB       ARG  57   6.537  -5.555  -0.714
  264   2HB   ARG  57          2HB       ARG  57   7.741  -6.293  -1.743
  265   1HG   ARG  57          1HG       ARG  57   5.452  -7.146  -2.123
  266   2HG   ARG  57          2HG       ARG  57   6.548  -8.441  -1.659
  267   1HD   ARG  57          1HD       ARG  57   4.263  -8.550  -0.587
  268   2HD   ARG  57          2HD       ARG  57   5.607  -8.601   0.534
  269    HE   ARG  57           HE       ARG  57   5.129  -6.418   1.312
  270   1HH1  ARG  57          2HH2      ARG  57   2.817  -7.208  -1.231
  271   2HH1  ARG  57          1HH2      ARG  57   1.823  -5.822  -0.798
  272   1HH2  ARG  57          1HH1      ARG  57   3.771  -4.746   1.749
  273   2HH2  ARG  57          2HH1      ARG  57   2.325  -4.525   0.771
  274    H    SER  58           H        SER  58  10.264  -6.692   1.353
  275    HA   SER  58           HA       SER  58  12.028  -7.791  -0.479
  276   1HB   SER  58          1HB       SER  58  12.225  -7.964   2.549
  277   2HB   SER  58          2HB       SER  58  13.564  -8.068   1.390
  278    HG   SER  58           HG       SER  58  13.301  -5.937   2.268

  No H/Q in entry =         278
  Start of MODEL    2
    1    H1   GLN  22           H1       GLN  22  -6.944   0.796  -5.659
    2    H2   GLN  22           H3       GLN  22  -7.020   0.316  -7.235
    3    H3   GLN  22           H2       GLN  22  -8.080  -0.282  -6.128
    4    HA   GLN  22           HA       GLN  22  -6.472  -1.950  -6.606
    5   1HB   GLN  22          1HB       GLN  22  -4.662  -0.412  -7.325
    6   2HB   GLN  22          2HB       GLN  22  -4.442   0.122  -5.660
    7   1HG   GLN  22          1HG       GLN  22  -2.706  -1.457  -6.292
    8   2HG   GLN  22          2HG       GLN  22  -3.689  -2.152  -5.013
    9   1HE2  GLN  22          2HE2      GLN  22  -2.204  -2.949  -7.917
   10   2HE2  GLN  22          1HE2      GLN  22  -3.255  -4.292  -8.349
   11    H    THR  23           H        THR  23  -6.298  -3.505  -5.023
   12    HA   THR  23           HA       THR  23  -7.776  -3.231  -2.724
   13    HB   THR  23           HB       THR  23  -5.524  -5.228  -3.112
   14    HG1  THR  23           HG1      THR  23  -7.090  -6.411  -4.203
   15   1HG2  THR  23          1HG2      THR  23  -8.203  -5.441  -1.657
   16   2HG2  THR  23          2HG2      THR  23  -7.037  -6.761  -1.885
   17   3HG2  THR  23          3HG2      THR  23  -6.603  -5.381  -0.872
   18    H    CYS  24           H        CYS  24  -7.575  -2.603  -0.712
   19    HA   CYS  24           HA       CYS  24  -5.608  -0.969   0.318
   20   1HB   CYS  24          1HB       CYS  24  -7.998  -1.408   1.072
   21   2HB   CYS  24          2HB       CYS  24  -7.401  -2.844   1.903
   22    H    TYR  25           H        TYR  25  -3.949  -1.147   1.849
   23    HA   TYR  25           HA       TYR  25  -2.434  -3.584   2.114
   24   1HB   TYR  25          1HB       TYR  25  -0.970  -2.423   3.412
   25   2HB   TYR  25          2HB       TYR  25  -1.582  -1.171   2.357
   26    HD1  TYR  25           HD1      TYR  25  -0.536  -1.761   5.572
   27    HD2  TYR  25           HD2      TYR  25  -3.926  -0.033   3.532
   28    HE1  TYR  25           HE1      TYR  25  -1.063  -0.403   7.586
   29    HE2  TYR  25           HE2      TYR  25  -4.484   1.260   5.570
   30    HH   TYR  25           HH       TYR  25  -2.510   1.112   8.541
   31    H    ASN  26           H        ASN  26  -5.216  -2.439   3.783
   32    HA   ASN  26           HA       ASN  26  -4.867  -4.410   6.027
   33   1HB   ASN  26          1HB       ASN  26  -4.338  -2.160   6.755
   34   2HB   ASN  26          2HB       ASN  26  -5.774  -1.497   5.982
   35   1HD2  ASN  26          1HD2      ASN  26  -7.822  -1.679   7.039
   36   2HD2  ASN  26          2HD2      ASN  26  -7.911  -2.259   8.695
   37    H    CYS  27           H        CYS  27  -7.307  -2.493   4.205
   38    HA   CYS  27           HA       CYS  27  -9.504  -3.759   5.527
   39   1HB   CYS  27          1HB       CYS  27  -9.461  -1.919   3.104
   40   2HB   CYS  27          2HB       CYS  27 -10.832  -2.229   4.174
   41    H    GLY  28           H        GLY  28  -7.728  -4.888   2.859
   42   1HA   GLY  28          2HA       GLY  28  -9.318  -7.151   2.351
   43   2HA   GLY  28          1HA       GLY  28  -8.044  -6.538   1.294
   44    H    LYS  29           H        LYS  29  -9.436  -4.006   0.745
   45    HA   LYS  29           HA       LYS  29 -11.829  -4.878  -0.827
   46   1HB   LYS  29          1HB       LYS  29 -12.314  -3.649   1.254
   47   2HB   LYS  29          2HB       LYS  29 -11.322  -2.314   0.707
   48   1HG   LYS  29          1HG       LYS  29 -13.590  -1.706   0.353
   49   2HG   LYS  29          2HG       LYS  29 -12.913  -2.006  -1.248
   50   1HD   LYS  29          1HD       LYS  29 -13.992  -4.245  -1.292
   51   2HD   LYS  29          2HD       LYS  29 -14.584  -3.995   0.364
   52   1HE   LYS  29          1HE       LYS  29 -15.874  -2.010  -0.410
   53   2HE   LYS  29          2HE       LYS  29 -15.309  -2.287  -2.062
   54   1HZ   LYS  29          3HZ       LYS  29 -16.963  -4.191  -0.484
   55   2HZ   LYS  29          1HZ       LYS  29 -17.509  -3.253  -1.699
   56   3HZ   LYS  29          2HZ       LYS  29 -16.446  -4.449  -2.013
   57    HA   PRO  30           HA       PRO  30  -9.228  -3.592  -4.301
   58   1HB   PRO  30          2HB       PRO  30 -11.936  -3.590  -5.635
   59   2HB   PRO  30          1HB       PRO  30 -10.366  -4.188  -6.265
   60   1HG   PRO  30          1HG       PRO  30 -12.142  -5.933  -5.224
   61   2HG   PRO  30          2HG       PRO  30 -10.408  -6.065  -4.777
   62   1HD   PRO  30          1HD       PRO  30 -12.675  -4.850  -3.198
   63   2HD   PRO  30          2HD       PRO  30 -11.330  -5.894  -2.644
   64    H    GLY  31           H        GLY  31 -12.151  -1.739  -3.506
   65   1HA   GLY  31          2HA       GLY  31 -12.831   0.414  -3.927
   66   2HA   GLY  31          1HA       GLY  31 -11.629   0.512  -5.210
   67    H    HIS  32           H        HIS  32  -9.298   0.084  -3.543
   68    HA   HIS  32           HA       HIS  32  -9.300   2.487  -1.782
   69   1HB   HIS  32          1HB       HIS  32  -7.905  -0.156  -1.638
   70   2HB   HIS  32          2HB       HIS  32  -7.054   1.257  -1.030
   71    HD1  HIS  32           HD1      HIS  32 -10.428  -0.543  -0.437
   72    HD2  HIS  32           HD2      HIS  32  -7.649   2.029   1.355
   73    HE1  HIS  32           HE1      HIS  32 -11.212  -0.211   1.987
   74    H    LEU  33           H        LEU  33  -7.526   3.762  -1.637
   75    HA   LEU  33           HA       LEU  33  -5.656   4.214  -3.845
   76   1HB   LEU  33          1HB       LEU  33  -8.002   6.063  -3.150
   77   2HB   LEU  33          2HB       LEU  33  -6.623   6.570  -4.112
   78    HG   LEU  33           HG       LEU  33  -8.620   4.431  -4.951
   79   1HD1  LEU  33          1HD1      LEU  33  -9.587   6.686  -4.880
   80   2HD1  LEU  33          2HD1      LEU  33  -8.248   7.306  -5.870
   81   3HD1  LEU  33          3HD1      LEU  33  -9.391   6.121  -6.547
   82   1HD2  LEU  33          1HD2      LEU  33  -6.333   5.769  -6.476
   83   2HD2  LEU  33          2HD2      LEU  33  -6.392   4.063  -5.980
   84   3HD2  LEU  33          3HD2      LEU  33  -7.543   4.670  -7.175
   85    H    SER  34           H        SER  34  -4.391   6.266  -3.281
   86    HA   SER  34           HA       SER  34  -3.371   6.465  -0.682
   87   1HB   SER  34          1HB       SER  34  -3.590   8.677  -2.759
   88   2HB   SER  34          2HB       SER  34  -2.400   8.571  -1.448
   89    HG   SER  34           HG       SER  34  -1.678   7.827  -3.580
   90    H    SER  35           H        SER  35  -6.388   7.773  -1.832
   91    HA   SER  35           HA       SER  35  -6.741   9.623   0.454
   92   1HB   SER  35          1HB       SER  35  -8.797  10.259  -0.808
   93   2HB   SER  35          2HB       SER  35  -7.304  10.467  -1.737
   94    HG   SER  35           HG       SER  35  -8.971   9.417  -2.947
   95    H    GLN  36           H        GLN  36  -7.286   6.348  -0.092
   96    HA   GLN  36           HA       GLN  36  -9.814   6.239   1.501
   97   1HB   GLN  36          1HB       GLN  36  -9.488   5.148  -0.866
   98   2HB   GLN  36          2HB       GLN  36  -8.535   3.952   0.001
   99   1HG   GLN  36          1HG       GLN  36 -10.646   2.966  -0.038
  100   2HG   GLN  36          2HG       GLN  36 -10.668   3.729   1.545
  101   1HE2  GLN  36          2HE2      GLN  36 -12.071   3.658  -1.687
  102   2HE2  GLN  36          1HE2      GLN  36 -13.277   4.904  -1.377
  103    H    CYS  37           H        CYS  37  -6.509   4.921   1.311
  104    HA   CYS  37           HA       CYS  37  -6.313   4.832   4.228
  105   1HB   CYS  37          1HB       CYS  37  -5.973   2.367   2.474
  106   2HB   CYS  37          2HB       CYS  37  -4.964   2.568   3.875
  107    H    ARG  38           H        ARG  38  -3.982   4.361   4.815
  108    HA   ARG  38           HA       ARG  38  -2.163   6.217   3.719
  109   1HB   ARG  38          1HB       ARG  38  -1.657   3.685   5.340
  110   2HB   ARG  38          2HB       ARG  38  -0.457   4.936   5.026
  111   1HG   ARG  38          1HG       ARG  38  -1.114   6.059   6.807
  112   2HG   ARG  38          2HG       ARG  38  -2.690   6.343   6.088
  113   1HD   ARG  38          1HD       ARG  38  -1.941   3.864   7.707
  114   2HD   ARG  38          2HD       ARG  38  -2.677   5.293   8.409
  115    HE   ARG  38           HE       ARG  38  -4.009   3.178   6.987
  116   1HH1  ARG  38          1HH1      ARG  38  -4.342   6.525   7.951
  117   2HH1  ARG  38          2HH1      ARG  38  -6.070   6.513   7.742
  118   1HH2  ARG  38          1HH2      ARG  38  -6.237   3.337   6.462
  119   2HH2  ARG  38          2HH2      ARG  38  -7.090   4.745   6.985
  120    H    ALA  39           H        ALA  39  -2.573   2.799   2.781
  121    HA   ALA  39           HA       ALA  39  -1.412   3.411   0.204
  122   1HB   ALA  39          2HB       ALA  39   0.667   2.952   1.489
  123   2HB   ALA  39          3HB       ALA  39  -0.014   1.392   2.021
  124   3HB   ALA  39          1HB       ALA  39   0.378   1.657   0.319
  125    HA   PRO  40           HA       PRO  40  -3.659  -0.493  -0.816
  126   1HB   PRO  40          2HB       PRO  40  -2.557  -1.100  -3.222
  127   2HB   PRO  40          1HB       PRO  40  -3.698   0.266  -3.020
  128   1HG   PRO  40          1HG       PRO  40  -0.665   0.361  -3.079
  129   2HG   PRO  40          2HG       PRO  40  -1.820   1.380  -3.995
  130   1HD   PRO  40          1HD       PRO  40  -0.664   2.177  -1.642
  131   2HD   PRO  40          2HD       PRO  40  -2.317   2.675  -2.102
  132    H    LYS  41           H        LYS  41  -2.921  -2.776  -1.386
  133    HA   LYS  41           HA       LYS  41  -1.125  -3.765   0.522
  134   1HB   LYS  41          1HB       LYS  41  -3.126  -4.867  -0.719
  135   2HB   LYS  41          2HB       LYS  41  -1.978  -5.268  -1.981
  136   1HG   LYS  41          1HG       LYS  41  -2.385  -7.156  -0.505
  137   2HG   LYS  41          2HG       LYS  41  -0.698  -6.668  -0.368
  138   1HD   LYS  41          1HD       LYS  41  -1.152  -5.551   1.774
  139   2HD   LYS  41          2HD       LYS  41  -2.898  -5.849   1.584
  140   1HE   LYS  41          1HE       LYS  41  -2.485  -8.284   1.674
  141   2HE   LYS  41          2HE       LYS  41  -0.749  -7.994   1.852
  142   1HZ   LYS  41          1HZ       LYS  41  -2.821  -7.069   3.780
  143   2HZ   LYS  41          2HZ       LYS  41  -1.840  -8.354   4.007
  144   3HZ   LYS  41          3HZ       LYS  41  -1.217  -6.845   3.951
  145    H    VAL  42           H        VAL  42  -0.148  -2.413  -2.358
  146    HA   VAL  42           HA       VAL  42   2.379  -3.637  -2.893
  147    HB   VAL  42           HB       VAL  42   1.541  -0.707  -3.007
  148   1HG1  VAL  42          3HG1      VAL  42   3.820  -2.158  -4.403
  149   2HG1  VAL  42          1HG1      VAL  42   3.298  -0.495  -4.753
  150   3HG1  VAL  42          2HG1      VAL  42   3.973  -0.881  -3.172
  151   1HG2  VAL  42          3HG2      VAL  42   1.462  -2.870  -5.159
  152   2HG2  VAL  42          1HG2      VAL  42   0.050  -2.090  -4.410
  153   3HG2  VAL  42          2HG2      VAL  42   1.138  -1.143  -5.422
  154    H    CYS  43           H        CYS  43   1.343  -1.409  -0.311
  155    HA   CYS  43           HA       CYS  43   3.963  -1.600   1.072
  156   1HB   CYS  43          1HB       CYS  43   3.986   0.230  -0.670
  157   2HB   CYS  43          2HB       CYS  43   2.677   1.030   0.209
  158    H    PHE  44           H        PHE  44   3.346   0.561   2.768
  159    HA   PHE  44           HA       PHE  44   0.710   0.061   4.037
  160   1HB   PHE  44          1HB       PHE  44   1.548  -0.123   6.220
  161   2HB   PHE  44          2HB       PHE  44   2.521  -1.231   5.274
  162    HD1  PHE  44           HD1      PHE  44   2.503   1.731   7.393
  163    HD2  PHE  44           HD2      PHE  44   4.910  -0.526   4.612
  164    HE1  PHE  44           HE1      PHE  44   4.532   2.925   8.179
  165    HE2  PHE  44           HE2      PHE  44   6.935   0.672   5.404
  166    HZ   PHE  44           HZ       PHE  44   6.751   2.402   7.178
  167    H    LYS  45           H        LYS  45   3.265   2.284   3.158
  168    HA   LYS  45           HA       LYS  45   1.500   4.579   3.617
  169   1HB   LYS  45          1HB       LYS  45   2.560   4.177   5.859
  170   2HB   LYS  45          2HB       LYS  45   4.150   4.414   5.130
  171   1HG   LYS  45          1HG       LYS  45   3.516   6.747   4.533
  172   2HG   LYS  45          2HG       LYS  45   1.894   6.475   5.203
  173   1HD   LYS  45          1HD       LYS  45   2.901   6.041   7.438
  174   2HD   LYS  45          2HD       LYS  45   4.518   6.326   6.758
  175   1HE   LYS  45          1HE       LYS  45   3.838   8.636   6.129
  176   2HE   LYS  45          2HE       LYS  45   2.233   8.351   6.812
  177   1HZ   LYS  45          2HZ       LYS  45   3.291   8.028   8.989
  178   2HZ   LYS  45          3HZ       LYS  45   4.773   8.298   8.356
  179   3HZ   LYS  45          1HZ       LYS  45   3.670   9.498   8.394
  180    H    CYS  46           H        CYS  46   4.960   3.782   2.944
  181    HA   CYS  46           HA       CYS  46   5.461   6.172   1.572
  182   1HB   CYS  46          1HB       CYS  46   7.434   4.347   0.748
  183   2HB   CYS  46          2HB       CYS  46   7.494   5.507   2.060
  184    H    LYS  47           H        LYS  47   4.533   3.044   0.242
  185    HA   LYS  47           HA       LYS  47   4.043   2.300  -1.870
  186   1HB   LYS  47          1HB       LYS  47   1.988   3.314  -2.651
  187   2HB   LYS  47          2HB       LYS  47   2.044   3.170  -0.900
  188   1HG   LYS  47          1HG       LYS  47   2.646   5.590  -0.734
  189   2HG   LYS  47          2HG       LYS  47   2.491   5.741  -2.485
  190   1HD   LYS  47          1HD       LYS  47   0.135   5.256  -2.389
  191   2HD   LYS  47          2HD       LYS  47   0.228   4.733  -0.700
  192   1HE   LYS  47          1HE       LYS  47   0.918   7.558  -1.602
  193   2HE   LYS  47          2HE       LYS  47  -0.710   7.069  -1.119
  194   1HZ   LYS  47          3HZ       LYS  47   1.650   6.803   0.672
  195   2HZ   LYS  47          1HZ       LYS  47   0.556   8.028   0.746
  196   3HZ   LYS  47          2HZ       LYS  47   0.111   6.478   1.055
  197    H    GLN  48           H        GLN  48   6.472   4.009  -2.166
  198    HA   GLN  48           HA       GLN  48   6.293   5.306  -4.714
  199   1HB   GLN  48          1HB       GLN  48   8.736   4.159  -3.298
  200   2HB   GLN  48          2HB       GLN  48   8.780   5.261  -4.666
  201   1HG   GLN  48          1HG       GLN  48   7.742   5.874  -1.872
  202   2HG   GLN  48          2HG       GLN  48   9.206   6.482  -2.620
  203   1HE2  GLN  48          2HE2      GLN  48   5.862   7.118  -2.127
  204   2HE2  GLN  48          1HE2      GLN  48   5.751   8.476  -3.253
  205    HA   PRO  49           HA       PRO  49   5.950   2.377  -7.759
  206   1HB   PRO  49          2HB       PRO  49   8.489   3.363  -9.077
  207   2HB   PRO  49          1HB       PRO  49   6.895   3.019  -9.824
  208   1HG   PRO  49          1HG       PRO  49   7.555   5.557  -9.205
  209   2HG   PRO  49          2HG       PRO  49   5.918   4.945  -8.798
  210   1HD   PRO  49          1HD       PRO  49   8.307   5.283  -6.988
  211   2HD   PRO  49          2HD       PRO  49   6.586   5.659  -6.694
  212    H    GLY  50           H        GLY  50   9.140   1.991  -6.309
  213   1HA   GLY  50          2HA       GLY  50  10.391  -0.072  -7.480
  214   2HA   GLY  50          1HA       GLY  50   8.984  -0.931  -6.855
  215    H    HIS  51           H        HIS  51   9.627   1.418  -4.578
  216    HA   HIS  51           HA       HIS  51  11.945   0.480  -3.243
  217   1HB   HIS  51          1HB       HIS  51  11.360   1.983  -1.558
  218   2HB   HIS  51          2HB       HIS  51  10.650   2.708  -2.991
  219    HD1  HIS  51           HD1      HIS  51   7.766   1.714  -3.178
  220    HD2  HIS  51           HD2      HIS  51   9.854   1.835   0.484
  221    HE1  HIS  51           HE1      HIS  51   6.047   1.348  -1.349
  222    H    PHE  52           H        PHE  52   8.687  -0.787  -3.159
  223    HA   PHE  52           HA       PHE  52   8.612  -1.793  -0.530
  224   1HB   PHE  52          1HB       PHE  52   6.727  -3.223  -1.461
  225   2HB   PHE  52          2HB       PHE  52   6.580  -1.485  -1.603
  226    HD1  PHE  52           HD1      PHE  52   7.130  -4.630  -3.513
  227    HD2  PHE  52           HD2      PHE  52   6.546  -0.360  -3.755
  228    HE1  PHE  52           HE1      PHE  52   6.748  -4.812  -5.957
  229    HE2  PHE  52           HE2      PHE  52   6.148  -0.554  -6.188
  230    HZ   PHE  52           HZ       PHE  52   6.263  -2.774  -7.302
  231    H    SER  53           H        SER  53   9.609  -3.488  -3.527
  232    HA   SER  53           HA       SER  53  10.085  -6.035  -2.406
  233   1HB   SER  53          1HB       SER  53  11.474  -4.699  -4.759
  234   2HB   SER  53          2HB       SER  53  11.428  -6.442  -4.421
  235    HG   SER  53           HG       SER  53   9.819  -5.832  -5.929
  236    H    LYS  54           H        LYS  54  11.788  -3.267  -1.571
  237    HA   LYS  54           HA       LYS  54  14.059  -4.862  -0.479
  238   1HB   LYS  54          1HB       LYS  54  15.640  -3.123  -1.097
  239   2HB   LYS  54          2HB       LYS  54  14.838  -3.785  -2.517
  240   1HG   LYS  54          1HG       LYS  54  13.375  -1.803  -2.664
  241   2HG   LYS  54          2HG       LYS  54  14.056  -1.162  -1.161
  242   1HD   LYS  54          1HD       LYS  54  15.049   0.016  -2.984
  243   2HD   LYS  54          2HD       LYS  54  16.295  -1.028  -2.280
  244   1HE   LYS  54          1HE       LYS  54  15.899  -2.695  -4.097
  245   2HE   LYS  54          2HE       LYS  54  14.639  -1.656  -4.775
  246   1HZ   LYS  54          3HZ       LYS  54  16.352   0.045  -5.153
  247   2HZ   LYS  54          1HZ       LYS  54  17.511  -0.924  -4.531
  248   3HZ   LYS  54          2HZ       LYS  54  16.758  -1.337  -5.917
  249    H    GLN  55           H        GLN  55  11.454  -3.349   0.556
  250    HA   GLN  55           HA       GLN  55  12.739  -2.549   3.084
  251   1HB   GLN  55          1HB       GLN  55  12.790  -0.492   1.622
  252   2HB   GLN  55          2HB       GLN  55  11.026  -0.542   1.553
  253   1HG   GLN  55          1HG       GLN  55  10.992  -0.354   4.083
  254   2HG   GLN  55          2HG       GLN  55  12.751  -0.209   4.053
  255   1HE2  GLN  55          1HE2      GLN  55   9.689   1.389   3.314
  256   2HE2  GLN  55          2HE2      GLN  55  10.385   2.990   3.089
  257    H    CYS  56           H        CYS  56   9.569  -2.449   1.375
  258    HA   CYS  56           HA       CYS  56   8.205  -2.783   3.978
  259   1HB   CYS  56          1HB       CYS  56   7.196  -1.775   1.288
  260   2HB   CYS  56          2HB       CYS  56   6.314  -1.749   2.821
  261    H    ARG  57           H        ARG  57   8.695  -4.586   1.088
  262    HA   ARG  57           HA       ARG  57   6.818  -6.726   1.980
  263   1HB   ARG  57          1HB       ARG  57   6.220  -4.997  -0.131
  264   2HB   ARG  57          2HB       ARG  57   7.052  -6.288  -0.968
  265   1HG   ARG  57          1HG       ARG  57   4.999  -7.247  -1.045
  266   2HG   ARG  57          2HG       ARG  57   5.325  -7.761   0.607
  267   1HD   ARG  57          1HD       ARG  57   3.742  -5.339  -0.343
  268   2HD   ARG  57          2HD       ARG  57   3.116  -6.764   0.497
  269    HE   ARG  57           HE       ARG  57   5.087  -5.472   2.144
  270   1HH1  ARG  57          1HH1      ARG  57   1.861  -4.764   0.994
  271   2HH1  ARG  57          2HH1      ARG  57   1.613  -3.575   2.249
  272   1HH2  ARG  57          2HH2      ARG  57   4.652  -4.103   3.733
  273   2HH2  ARG  57          1HH2      ARG  57   3.054  -3.393   3.910
  274    H    SER  58           H        SER  58   9.913  -6.029   1.474
  275    HA   SER  58           HA       SER  58  11.082  -8.130  -0.040
  276   1HB   SER  58          1HB       SER  58  13.090  -7.605   1.458
  277   2HB   SER  58          2HB       SER  58  12.441  -6.300   0.462
  278    HG   SER  58           HG       SER  58  11.837  -6.722   3.220

  No H/Q in entry =         278
  Start of MODEL    3
    1    H1   GLN  22           H2       GLN  22  -8.254  -0.885  -6.279
    2    H2   GLN  22           H1       GLN  22  -7.271   0.364  -5.899
    3    H3   GLN  22           H3       GLN  22  -7.246  -0.264  -7.420
    4    HA   GLN  22           HA       GLN  22  -6.399  -2.362  -6.595
    5   1HB   GLN  22          1HB       GLN  22  -4.816  -0.565  -7.331
    6   2HB   GLN  22          2HB       GLN  22  -4.704  -0.003  -5.656
    7   1HG   GLN  22          1HG       GLN  22  -3.746  -2.206  -4.987
    8   2HG   GLN  22          2HG       GLN  22  -3.969  -2.803  -6.635
    9   1HE2  GLN  22          2HE2      GLN  22  -1.806  -3.106  -7.287
   10   2HE2  GLN  22          1HE2      GLN  22  -0.633  -1.795  -7.273
   11    H    THR  23           H        THR  23  -6.436  -3.786  -4.907
   12    HA   THR  23           HA       THR  23  -7.881  -3.371  -2.640
   13    HB   THR  23           HB       THR  23  -5.581  -5.343  -2.825
   14    HG1  THR  23           HG1      THR  23  -7.075  -6.633  -3.913
   15   1HG2  THR  23          1HG2      THR  23  -8.326  -5.518  -1.494
   16   2HG2  THR  23          2HG2      THR  23  -7.146  -6.839  -1.603
   17   3HG2  THR  23          3HG2      THR  23  -6.763  -5.408  -0.644
   18    H    CYS  24           H        CYS  24  -7.658  -2.824  -0.558
   19    HA   CYS  24           HA       CYS  24  -5.709  -1.032   0.346
   20   1HB   CYS  24          1HB       CYS  24  -8.098  -1.482   1.138
   21   2HB   CYS  24          2HB       CYS  24  -7.455  -2.856   2.039
   22    H    TYR  25           H        TYR  25  -4.086  -1.156   1.933
   23    HA   TYR  25           HA       TYR  25  -2.533  -3.592   2.270
   24   1HB   TYR  25          1HB       TYR  25  -1.051  -2.337   3.468
   25   2HB   TYR  25          2HB       TYR  25  -1.695  -1.142   2.363
   26    HD1  TYR  25           HD1      TYR  25  -0.590  -1.541   5.589
   27    HD2  TYR  25           HD2      TYR  25  -4.047  -0.001   3.518
   28    HE1  TYR  25           HE1      TYR  25  -1.132  -0.105   7.546
   29    HE2  TYR  25           HE2      TYR  25  -4.630   1.344   5.500
   30    HH   TYR  25           HH       TYR  25  -2.620   1.399   8.455
   31    H    ASN  26           H        ASN  26  -5.372  -2.441   3.790
   32    HA   ASN  26           HA       ASN  26  -5.014  -4.225   6.184
   33   1HB   ASN  26          1HB       ASN  26  -4.487  -1.933   6.788
   34   2HB   ASN  26          2HB       ASN  26  -5.926  -1.318   5.978
   35   1HD2  ASN  26          2HD2      ASN  26  -7.977  -1.458   7.041
   36   2HD2  ASN  26          1HD2      ASN  26  -8.065  -1.956   8.724
   37    H    CYS  27           H        CYS  27  -7.450  -2.370   4.289
   38    HA   CYS  27           HA       CYS  27  -9.646  -3.579   5.648
   39   1HB   CYS  27          1HB       CYS  27  -9.594  -1.868   3.132
   40   2HB   CYS  27          2HB       CYS  27 -10.969  -2.121   4.214
   41    H    GLY  28           H        GLY  28  -7.870  -4.843   3.040
   42   1HA   GLY  28          2HA       GLY  28  -9.465  -7.126   2.642
   43   2HA   GLY  28          1HA       GLY  28  -8.186  -6.568   1.559
   44    H    LYS  29           H        LYS  29  -9.631  -4.045   0.930
   45    HA   LYS  29           HA       LYS  29 -11.995  -5.023  -0.614
   46   1HB   LYS  29          1HB       LYS  29 -12.467  -3.645   1.387
   47   2HB   LYS  29          2HB       LYS  29 -11.503  -2.345   0.717
   48   1HG   LYS  29          1HG       LYS  29 -13.777  -1.797   0.331
   49   2HG   LYS  29          2HG       LYS  29 -13.118  -2.242  -1.244
   50   1HD   LYS  29          1HD       LYS  29 -14.170  -4.495  -1.043
   51   2HD   LYS  29          2HD       LYS  29 -14.755  -4.072   0.579
   52   1HE   LYS  29          1HE       LYS  29 -16.065  -2.193  -0.401
   53   2HE   LYS  29          2HE       LYS  29 -15.505  -2.647  -2.016
   54   1HZ   LYS  29          2HZ       LYS  29 -17.138  -4.373  -0.225
   55   2HZ   LYS  29          3HZ       LYS  29 -17.694  -3.584  -1.538
   56   3HZ   LYS  29          1HZ       LYS  29 -16.623  -4.801  -1.718
   57    HA   PRO  30           HA       PRO  30  -9.402  -3.985  -4.157
   58   1HB   PRO  30          2HB       PRO  30 -12.104  -4.011  -5.509
   59   2HB   PRO  30          1HB       PRO  30 -10.548  -4.688  -6.085
   60   1HG   PRO  30          1HG       PRO  30 -12.374  -6.315  -4.947
   61   2HG   PRO  30          2HG       PRO  30 -10.646  -6.462  -4.483
   62   1HD   PRO  30          1HD       PRO  30 -12.883  -5.090  -2.993
   63   2HD   PRO  30          2HD       PRO  30 -11.567  -6.134  -2.372
   64    H    GLY  31           H        GLY  31 -12.285  -2.019  -3.483
   65   1HA   GLY  31          2HA       GLY  31 -12.915   0.119  -4.038
   66   2HA   GLY  31          1HA       GLY  31 -11.731   0.096  -5.342
   67    H    HIS  32           H        HIS  32  -9.429  -0.332  -3.547
   68    HA   HIS  32           HA       HIS  32  -9.319   2.228  -2.030
   69   1HB   HIS  32          1HB       HIS  32  -8.038  -0.455  -1.681
   70   2HB   HIS  32          2HB       HIS  32  -7.125   0.957  -1.174
   71    HD1  HIS  32           HD1      HIS  32 -10.580  -0.631  -0.467
   72    HD2  HIS  32           HD2      HIS  32  -7.664   1.902   1.163
   73    HE1  HIS  32           HE1      HIS  32 -11.336  -0.115   1.933
   74    H    LEU  33           H        LEU  33  -7.224   3.215  -1.876
   75    HA   LEU  33           HA       LEU  33  -5.482   3.396  -4.213
   76   1HB   LEU  33          1HB       LEU  33  -7.417   5.618  -3.357
   77   2HB   LEU  33          2HB       LEU  33  -6.017   5.906  -4.376
   78    HG   LEU  33           HG       LEU  33  -8.396   4.173  -5.153
   79   1HD1  LEU  33          2HD1      LEU  33  -8.934   6.565  -5.005
   80   2HD1  LEU  33          3HD1      LEU  33  -7.547   6.955  -6.045
   81   3HD1  LEU  33          1HD1      LEU  33  -8.913   6.014  -6.686
   82   1HD2  LEU  33          1HD2      LEU  33  -5.969   5.111  -6.761
   83   2HD2  LEU  33          2HD2      LEU  33  -6.322   3.432  -6.297
   84   3HD2  LEU  33          3HD2      LEU  33  -7.389   4.273  -7.424
   85    H    SER  34           H        SER  34  -3.819   5.100  -3.753
   86    HA   SER  34           HA       SER  34  -2.645   5.131  -1.191
   87   1HB   SER  34          1HB       SER  34  -2.380   7.057  -3.531
   88   2HB   SER  34          2HB       SER  34  -1.257   6.967  -2.162
   89    HG   SER  34           HG       SER  34  -0.598   5.702  -4.006
   90    H    SER  35           H        SER  35  -5.479   6.745  -1.938
   91    HA   SER  35           HA       SER  35  -5.185   8.642   0.349
   92   1HB   SER  35          1HB       SER  35  -6.775  10.102  -0.872
   93   2HB   SER  35          2HB       SER  35  -5.259   9.854  -1.758
   94    HG   SER  35           HG       SER  35  -7.121   9.605  -3.104
   95    H    GLN  36           H        GLN  36  -6.948   5.919  -0.834
   96    HA   GLN  36           HA       GLN  36  -9.426   6.419   0.657
   97   1HB   GLN  36          1HB       GLN  36  -9.126   4.909  -1.425
   98   2HB   GLN  36          2HB       GLN  36  -8.342   3.766  -0.338
   99   1HG   GLN  36          1HG       GLN  36 -10.554   2.992  -0.398
  100   2HG   GLN  36          2HG       GLN  36 -10.554   3.931   1.080
  101   1HE2  GLN  36          2HE2      GLN  36 -11.880   3.610  -2.164
  102   2HE2  GLN  36          1HE2      GLN  36 -12.937   5.013  -2.052
  103    H    CYS  37           H        CYS  37  -6.354   4.788   1.129
  104    HA   CYS  37           HA       CYS  37  -6.605   4.956   4.046
  105   1HB   CYS  37          1HB       CYS  37  -6.128   2.406   2.488
  106   2HB   CYS  37          2HB       CYS  37  -5.201   2.655   3.941
  107    H    ARG  38           H        ARG  38  -4.243   4.350   4.919
  108    HA   ARG  38           HA       ARG  38  -2.407   6.325   4.043
  109   1HB   ARG  38          1HB       ARG  38  -1.959   3.768   5.652
  110   2HB   ARG  38          2HB       ARG  38  -0.696   4.928   5.284
  111   1HG   ARG  38          1HG       ARG  38  -1.195   5.740   7.275
  112   2HG   ARG  38          2HG       ARG  38  -2.346   6.705   6.372
  113   1HD   ARG  38          1HD       ARG  38  -3.079   4.058   7.701
  114   2HD   ARG  38          2HD       ARG  38  -3.037   5.563   8.596
  115    HE   ARG  38           HE       ARG  38  -4.766   6.490   7.130
  116   1HH1  ARG  38          1HH1      ARG  38  -4.625   2.960   7.275
  117   2HH1  ARG  38          2HH1      ARG  38  -6.258   2.837   6.649
  118   1HH2  ARG  38          1HH2      ARG  38  -6.894   6.175   6.576
  119   2HH2  ARG  38          2HH2      ARG  38  -7.479   4.557   6.308
  120    H    ALA  39           H        ALA  39  -2.677   2.962   2.936
  121    HA   ALA  39           HA       ALA  39  -1.447   3.714   0.425
  122   1HB   ALA  39          3HB       ALA  39   0.587   3.176   1.774
  123   2HB   ALA  39          1HB       ALA  39  -0.114   1.586   2.164
  124   3HB   ALA  39          2HB       ALA  39   0.336   1.973   0.497
  125    HA   PRO  40           HA       PRO  40  -3.790  -0.115  -0.735
  126   1HB   PRO  40          2HB       PRO  40  -2.739  -0.670  -3.171
  127   2HB   PRO  40          1HB       PRO  40  -3.814   0.736  -2.914
  128   1HG   PRO  40          1HG       PRO  40  -0.778   0.701  -2.987
  129   2HG   PRO  40          2HG       PRO  40  -1.891   1.800  -3.862
  130   1HD   PRO  40          1HD       PRO  40  -0.695   2.467  -1.483
  131   2HD   PRO  40          2HD       PRO  40  -2.320   3.049  -1.935
  132    H    LYS  41           H        LYS  41  -3.086  -2.393  -1.415
  133    HA   LYS  41           HA       LYS  41  -1.383  -3.583   0.433
  134   1HB   LYS  41          1HB       LYS  41  -3.272  -4.577  -0.905
  135   2HB   LYS  41          2HB       LYS  41  -2.175  -4.718  -2.280
  136   1HG   LYS  41          1HG       LYS  41  -0.767  -6.293  -1.018
  137   2HG   LYS  41          2HG       LYS  41  -1.731  -6.017   0.450
  138   1HD   LYS  41          1HD       LYS  41  -3.718  -6.978  -0.675
  139   2HD   LYS  41          2HD       LYS  41  -2.764  -7.225  -2.158
  140   1HE   LYS  41          1HE       LYS  41  -1.210  -8.710  -0.901
  141   2HE   LYS  41          2HE       LYS  41  -2.167  -8.471   0.568
  142   1HZ   LYS  41          1HZ       LYS  41  -3.170  -9.736  -1.930
  143   2HZ   LYS  41          2HZ       LYS  41  -2.776 -10.531  -0.564
  144   3HZ   LYS  41          3HZ       LYS  41  -4.054  -9.518  -0.570
  145    H    VAL  42           H        VAL  42  -0.288  -2.038  -2.397
  146    HA   VAL  42           HA       VAL  42   2.248  -3.234  -2.883
  147    HB   VAL  42           HB       VAL  42   1.447  -0.294  -2.973
  148   1HG1  VAL  42          1HG1      VAL  42   3.699  -1.775  -4.383
  149   2HG1  VAL  42          2HG1      VAL  42   3.212  -0.099  -4.717
  150   3HG1  VAL  42          3HG1      VAL  42   3.884  -0.515  -3.142
  151   1HG2  VAL  42          2HG2      VAL  42   1.344  -2.437  -5.144
  152   2HG2  VAL  42          3HG2      VAL  42  -0.056  -1.642  -4.391
  153   3HG2  VAL  42          1HG2      VAL  42   1.044  -0.702  -5.391
  154    H    CYS  43           H        CYS  43   1.193  -1.092  -0.234
  155    HA   CYS  43           HA       CYS  43   3.808  -1.348   1.134
  156   1HB   CYS  43          1HB       CYS  43   3.874   0.540  -0.556
  157   2HB   CYS  43          2HB       CYS  43   2.605   1.350   0.371
  158    H    PHE  44           H        PHE  44   3.217   0.812   2.852
  159    HA   PHE  44           HA       PHE  44   0.587   0.410   4.129
  160   1HB   PHE  44          1HB       PHE  44   1.408  -0.016   6.299
  161   2HB   PHE  44          2HB       PHE  44   2.228  -1.161   5.255
  162    HD1  PHE  44           HD1      PHE  44   2.606   1.518   7.662
  163    HD2  PHE  44           HD2      PHE  44   4.679  -0.639   4.551
  164    HE1  PHE  44           HE1      PHE  44   4.776   2.343   8.537
  165    HE2  PHE  44           HE2      PHE  44   6.847   0.198   5.426
  166    HZ   PHE  44           HZ       PHE  44   6.903   1.687   7.414
  167    H    LYS  45           H        LYS  45   3.298   2.433   3.349
  168    HA   LYS  45           HA       LYS  45   1.965   4.875   4.348
  169   1HB   LYS  45          1HB       LYS  45   3.144   4.012   6.334
  170   2HB   LYS  45          2HB       LYS  45   4.642   3.873   5.416
  171   1HG   LYS  45          1HG       LYS  45   4.618   6.396   5.128
  172   2HG   LYS  45          2HG       LYS  45   3.152   6.445   6.112
  173   1HD   LYS  45          1HD       LYS  45   5.043   7.003   7.495
  174   2HD   LYS  45          2HD       LYS  45   4.440   5.420   8.007
  175   1HE   LYS  45          1HE       LYS  45   6.244   4.304   6.723
  176   2HE   LYS  45          2HE       LYS  45   6.800   5.868   6.115
  177   1HZ   LYS  45          1HZ       LYS  45   6.813   5.059   8.976
  178   2HZ   LYS  45          2HZ       LYS  45   8.126   5.130   8.009
  179   3HZ   LYS  45          3HZ       LYS  45   7.334   6.498   8.405
  180    H    CYS  46           H        CYS  46   5.258   3.843   3.302
  181    HA   CYS  46           HA       CYS  46   5.807   6.349   2.113
  182   1HB   CYS  46          1HB       CYS  46   7.880   4.858   1.301
  183   2HB   CYS  46          2HB       CYS  46   7.690   5.479   2.935
  184    H    LYS  47           H        LYS  47   4.736   3.356   0.639
  185    HA   LYS  47           HA       LYS  47   4.152   2.775  -1.500
  186   1HB   LYS  47          1HB       LYS  47   2.105   3.886  -2.057
  187   2HB   LYS  47          2HB       LYS  47   2.291   3.709  -0.323
  188   1HG   LYS  47          1HG       LYS  47   3.153   6.191  -0.372
  189   2HG   LYS  47          2HG       LYS  47   2.425   6.249  -1.981
  190   1HD   LYS  47          1HD       LYS  47   0.234   5.650  -0.999
  191   2HD   LYS  47          2HD       LYS  47   1.002   5.405   0.581
  192   1HE   LYS  47          1HE       LYS  47   1.758   7.780   0.570
  193   2HE   LYS  47          2HE       LYS  47   0.838   8.059  -0.916
  194   1HZ   LYS  47          2HZ       LYS  47  -0.386   7.047   1.597
  195   2HZ   LYS  47          3HZ       LYS  47  -0.337   8.647   1.217
  196   3HZ   LYS  47          1HZ       LYS  47  -1.198   7.611   0.297
  197    H    GLN  48           H        GLN  48   6.665   4.250  -1.823
  198    HA   GLN  48           HA       GLN  48   6.489   5.780  -4.248
  199   1HB   GLN  48          1HB       GLN  48   8.869   4.309  -3.040
  200   2HB   GLN  48          2HB       GLN  48   8.964   5.495  -4.333
  201   1HG   GLN  48          1HG       GLN  48   8.116   6.006  -1.458
  202   2HG   GLN  48          2HG       GLN  48   9.597   6.523  -2.238
  203   1HE2  GLN  48          2HE2      GLN  48   6.357   7.435  -1.536
  204   2HE2  GLN  48          1HE2      GLN  48   6.329   8.876  -2.560
  205    HA   PRO  49           HA       PRO  49   5.802   3.097  -7.487
  206   1HB   PRO  49          2HB       PRO  49   8.352   4.010  -8.837
  207   2HB   PRO  49          1HB       PRO  49   6.711   3.832  -9.538
  208   1HG   PRO  49          1HG       PRO  49   7.575   6.267  -8.766
  209   2HG   PRO  49          2HG       PRO  49   5.912   5.741  -8.338
  210   1HD   PRO  49          1HD       PRO  49   8.385   5.774  -6.608
  211   2HD   PRO  49          2HD       PRO  49   6.709   6.254  -6.217
  212    H    GLY  50           H        GLY  50   9.030   2.439  -6.217
  213   1HA   GLY  50          2HA       GLY  50  10.131   0.434  -7.584
  214   2HA   GLY  50          1HA       GLY  50   8.714  -0.427  -6.986
  215    H    HIS  51           H        HIS  51   9.526   1.670  -4.529
  216    HA   HIS  51           HA       HIS  51  11.846   0.541  -3.363
  217   1HB   HIS  51          1HB       HIS  51  11.332   1.875  -1.508
  218   2HB   HIS  51          2HB       HIS  51  10.642   2.765  -2.853
  219    HD1  HIS  51           HD1      HIS  51   7.711   1.956  -3.101
  220    HD2  HIS  51           HD2      HIS  51   9.836   1.512   0.514
  221    HE1  HIS  51           HE1      HIS  51   5.993   1.465  -1.306
  222    H    PHE  52           H        PHE  52   8.548  -0.623  -3.281
  223    HA   PHE  52           HA       PHE  52   8.493  -1.754  -0.722
  224   1HB   PHE  52          1HB       PHE  52   6.508  -3.006  -1.601
  225   2HB   PHE  52          2HB       PHE  52   6.469  -1.268  -1.796
  226    HD1  PHE  52           HD1      PHE  52   6.536  -0.211  -4.011
  227    HD2  PHE  52           HD2      PHE  52   6.699  -4.505  -3.581
  228    HE1  PHE  52           HE1      PHE  52   6.060  -0.477  -6.426
  229    HE2  PHE  52           HE2      PHE  52   6.232  -4.759  -6.001
  230    HZ   PHE  52           HZ       PHE  52   5.917  -2.745  -7.432
  231    H    SER  53           H        SER  53   9.374  -3.370  -3.792
  232    HA   SER  53           HA       SER  53   9.681  -5.995  -2.803
  233   1HB   SER  53          1HB       SER  53  11.178  -4.631  -5.072
  234   2HB   SER  53          2HB       SER  53  11.017  -6.382  -4.828
  235    HG   SER  53           HG       SER  53   9.471  -5.586  -6.316
  236    H    LYS  54           H        LYS  54  11.576  -3.367  -1.872
  237    HA   LYS  54           HA       LYS  54  13.712  -5.156  -0.807
  238   1HB   LYS  54          1HB       LYS  54  15.417  -3.519  -1.350
  239   2HB   LYS  54          2HB       LYS  54  14.591  -4.083  -2.797
  240   1HG   LYS  54          1HG       LYS  54  13.285  -1.997  -2.923
  241   2HG   LYS  54          2HG       LYS  54  13.965  -1.448  -1.384
  242   1HD   LYS  54          1HD       LYS  54  15.087  -0.297  -3.160
  243   2HD   LYS  54          2HD       LYS  54  16.235  -1.425  -2.422
  244   1HE   LYS  54          1HE       LYS  54  15.813  -3.044  -4.278
  245   2HE   LYS  54          2HE       LYS  54  14.658  -1.913  -4.996
  246   1HZ   LYS  54          2HZ       LYS  54  16.495  -0.326  -5.268
  247   2HZ   LYS  54          3HZ       LYS  54  17.558  -1.377  -4.609
  248   3HZ   LYS  54          1HZ       LYS  54  16.844  -1.723  -6.033
  249    H    GLN  55           H        GLN  55  11.204  -3.601   0.286
  250    HA   GLN  55           HA       GLN  55  12.534  -2.900   2.823
  251   1HB   GLN  55          1HB       GLN  55  12.549  -0.801   1.379
  252   2HB   GLN  55          2HB       GLN  55  10.783  -0.831   1.433
  253   1HG   GLN  55          1HG       GLN  55  10.970  -0.771   3.988
  254   2HG   GLN  55          2HG       GLN  55  12.711  -0.555   3.788
  255   1HE2  GLN  55          1HE2      GLN  55   9.528   0.916   3.388
  256   2HE2  GLN  55          2HE2      GLN  55  10.112   2.558   3.162
  257    H    CYS  56           H        CYS  56   9.356  -2.905   1.125
  258    HA   CYS  56           HA       CYS  56   8.004  -3.221   3.757
  259   1HB   CYS  56          1HB       CYS  56   7.009  -2.099   1.108
  260   2HB   CYS  56          2HB       CYS  56   6.101  -2.158   2.623
  261    H    ARG  57           H        ARG  57   8.252  -4.749   0.620
  262    HA   ARG  57           HA       ARG  57   6.406  -6.983   1.429
  263   1HB   ARG  57          1HB       ARG  57   6.955  -5.859  -1.352
  264   2HB   ARG  57          2HB       ARG  57   5.937  -7.246  -1.005
  265   1HG   ARG  57          1HG       ARG  57   5.339  -4.379  -0.176
  266   2HG   ARG  57          2HG       ARG  57   4.653  -5.247  -1.541
  267   1HD   ARG  57          1HD       ARG  57   2.954  -5.578  -0.091
  268   2HD   ARG  57          2HD       ARG  57   3.908  -6.988   0.346
  269    HE   ARG  57           HE       ARG  57   4.853  -5.640   2.232
  270   1HH1  ARG  57          1HH2      ARG  57   1.824  -4.393   0.944
  271   2HH1  ARG  57          2HH2      ARG  57   1.644  -3.297   2.287
  272   1HH2  ARG  57          2HH1      ARG  57   4.501  -4.358   3.888
  273   2HH2  ARG  57          1HH1      ARG  57   3.019  -3.433   4.022
  274    H    SER  58           H        SER  58   9.575  -6.233   1.033
  275    HA   SER  58           HA       SER  58  10.784  -8.343  -0.424
  276   1HB   SER  58          1HB       SER  58  12.759  -7.815   1.105
  277   2HB   SER  58          2HB       SER  58  12.117  -6.505   0.110
  278    HG   SER  58           HG       SER  58  11.454  -6.953   2.849

  No H/Q in entry =         278
  Start of MODEL    4
    1    H1   GLN  22           H3       GLN  22  -7.309   0.743  -5.799
    2    H2   GLN  22           H2       GLN  22  -7.266   0.216  -7.353
    3    H3   GLN  22           H1       GLN  22  -8.264  -0.504  -6.256
    4    HA   GLN  22           HA       GLN  22  -6.434  -1.939  -6.616
    5   1HB   GLN  22          1HB       GLN  22  -4.147  -1.242  -5.957
    6   2HB   GLN  22          2HB       GLN  22  -4.721  -0.556  -7.454
    7   1HG   GLN  22          1HG       GLN  22  -4.859   1.072  -4.877
    8   2HG   GLN  22          2HG       GLN  22  -3.358   0.883  -5.769
    9   1HE2  GLN  22          1HE2      GLN  22  -3.375   3.248  -6.091
   10   2HE2  GLN  22          2HE2      GLN  22  -4.401   3.892  -7.366
   11    H    THR  23           H        THR  23  -6.330  -3.411  -5.021
   12    HA   THR  23           HA       THR  23  -7.785  -3.108  -2.736
   13    HB   THR  23           HB       THR  23  -5.498  -5.083  -3.031
   14    HG1  THR  23           HG1      THR  23  -6.994  -6.303  -4.187
   15   1HG2  THR  23          2HG2      THR  23  -8.246  -5.327  -1.717
   16   2HG2  THR  23          3HG2      THR  23  -7.054  -6.631  -1.879
   17   3HG2  THR  23          1HG2      THR  23  -6.690  -5.240  -0.853
   18    H    CYS  24           H        CYS  24  -7.584  -2.562  -0.675
   19    HA   CYS  24           HA       CYS  24  -5.609  -0.905   0.360
   20   1HB   CYS  24          1HB       CYS  24  -8.017  -1.357   1.099
   21   2HB   CYS  24          2HB       CYS  24  -7.403  -2.782   1.941
   22    H    TYR  25           H        TYR  25  -3.973  -1.124   1.907
   23    HA   TYR  25           HA       TYR  25  -2.505  -3.614   2.186
   24   1HB   TYR  25          1HB       TYR  25  -0.986  -2.442   3.416
   25   2HB   TYR  25          2HB       TYR  25  -1.594  -1.191   2.354
   26    HD1  TYR  25           HD1      TYR  25  -0.531  -1.786   5.577
   27    HD2  TYR  25           HD2      TYR  25  -3.883   0.020   3.542
   28    HE1  TYR  25           HE1      TYR  25  -1.017  -0.404   7.588
   29    HE2  TYR  25           HE2      TYR  25  -4.386   1.349   5.563
   30    HH   TYR  25           HH       TYR  25  -2.414   1.147   8.540
   31    H    ASN  26           H        ASN  26  -5.305  -2.431   3.748
   32    HA   ASN  26           HA       ASN  26  -4.962  -4.264   6.109
   33   1HB   ASN  26          1HB       ASN  26  -4.461  -1.976   6.739
   34   2HB   ASN  26          2HB       ASN  26  -5.898  -1.364   5.925
   35   1HD2  ASN  26          1HD2      ASN  26  -7.962  -1.548   6.965
   36   2HD2  ASN  26          2HD2      ASN  26  -8.054  -2.055   8.645
   37    H    CYS  27           H        CYS  27  -7.394  -2.436   4.189
   38    HA   CYS  27           HA       CYS  27  -9.587  -3.679   5.529
   39   1HB   CYS  27          1HB       CYS  27  -9.530  -1.919   3.048
   40   2HB   CYS  27          2HB       CYS  27 -10.918  -2.214   4.103
   41    H    GLY  28           H        GLY  28  -7.783  -4.914   2.931
   42   1HA   GLY  28          2HA       GLY  28  -9.378  -7.182   2.440
   43   2HA   GLY  28          1HA       GLY  28  -8.102  -6.580   1.375
   44    H    LYS  29           H        LYS  29  -9.386  -4.079   0.744
   45    HA   LYS  29           HA       LYS  29 -11.905  -4.839  -0.682
   46   1HB   LYS  29          1HB       LYS  29 -12.199  -3.583   1.421
   47   2HB   LYS  29          2HB       LYS  29 -11.168  -2.311   0.820
   48   1HG   LYS  29          1HG       LYS  29 -13.451  -1.601   0.611
   49   2HG   LYS  29          2HG       LYS  29 -12.806  -1.831  -1.003
   50   1HD   LYS  29          1HD       LYS  29 -15.112  -2.671  -0.826
   51   2HD   LYS  29          2HD       LYS  29 -13.995  -3.958  -1.239
   52   1HE   LYS  29          1HE       LYS  29 -15.577  -4.810   0.355
   53   2HE   LYS  29          2HE       LYS  29 -13.997  -4.739   1.130
   54   1HZ   LYS  29          3HZ       LYS  29 -16.171  -2.733   1.483
   55   2HZ   LYS  29          1HZ       LYS  29 -15.763  -3.877   2.569
   56   3HZ   LYS  29          2HZ       LYS  29 -14.718  -2.674   2.236
   57    HA   PRO  30           HA       PRO  30  -9.307  -3.722  -4.231
   58   1HB   PRO  30          2HB       PRO  30 -12.030  -3.809  -5.538
   59   2HB   PRO  30          1HB       PRO  30 -10.460  -4.419  -6.156
   60   1HG   PRO  30          1HG       PRO  30 -12.208  -6.133  -5.020
   61   2HG   PRO  30          2HG       PRO  30 -10.468  -6.227  -4.587
   62   1HD   PRO  30          1HD       PRO  30 -12.730  -4.969  -3.037
   63   2HD   PRO  30          2HD       PRO  30 -11.367  -5.971  -2.453
   64    H    GLY  31           H        GLY  31 -12.253  -1.869  -3.498
   65   1HA   GLY  31          2HA       GLY  31 -12.948   0.264  -3.992
   66   2HA   GLY  31          1HA       GLY  31 -11.757   0.321  -5.288
   67    H    HIS  32           H        HIS  32  -9.424  -0.053  -3.581
   68    HA   HIS  32           HA       HIS  32  -9.429   2.401  -1.896
   69   1HB   HIS  32          1HB       HIS  32  -8.020  -0.226  -1.723
   70   2HB   HIS  32          2HB       HIS  32  -7.139   1.198  -1.181
   71    HD1  HIS  32           HD1      HIS  32 -10.553  -0.490  -0.476
   72    HD2  HIS  32           HD2      HIS  32  -7.623   1.977   1.223
   73    HE1  HIS  32           HE1      HIS  32 -11.274  -0.088   1.956
   74    H    LEU  33           H        LEU  33  -7.555   3.618  -1.742
   75    HA   LEU  33           HA       LEU  33  -5.853   4.142  -4.072
   76   1HB   LEU  33          1HB       LEU  33  -8.052   6.024  -3.059
   77   2HB   LEU  33          2HB       LEU  33  -6.770   6.518  -4.150
   78    HG   LEU  33           HG       LEU  33  -8.928   4.481  -4.839
   79   1HD1  LEU  33          2HD1      LEU  33  -9.814   6.756  -4.554
   80   2HD1  LEU  33          3HD1      LEU  33  -8.579   7.388  -5.665
   81   3HD1  LEU  33          1HD1      LEU  33  -9.826   6.268  -6.256
   82   1HD2  LEU  33          1HD2      LEU  33  -6.798   5.834  -6.563
   83   2HD2  LEU  33          2HD2      LEU  33  -6.854   4.110  -6.132
   84   3HD2  LEU  33          3HD2      LEU  33  -8.113   4.797  -7.159
   85    H    SER  34           H        SER  34  -4.415   6.036  -3.508
   86    HA   SER  34           HA       SER  34  -3.296   6.122  -0.922
   87   1HB   SER  34          1HB       SER  34  -3.352   8.265  -3.085
   88   2HB   SER  34          2HB       SER  34  -2.218   8.206  -1.723
   89    HG   SER  34           HG       SER  34  -1.440   7.270  -3.753
   90    H    SER  35           H        SER  35  -6.259   7.586  -1.935
   91    HA   SER  35           HA       SER  35  -6.385   9.439   0.387
   92   1HB   SER  35          1HB       SER  35  -8.390  10.306  -0.813
   93   2HB   SER  35          2HB       SER  35  -6.898  10.413  -1.764
   94    HG   SER  35           HG       SER  35  -8.672   9.564  -2.979
   95    H    GLN  36           H        GLN  36  -7.306   6.250  -0.355
   96    HA   GLN  36           HA       GLN  36  -9.823   6.312   1.226
   97   1HB   GLN  36          1HB       GLN  36  -9.449   5.060  -1.039
   98   2HB   GLN  36          2HB       GLN  36  -8.543   3.901  -0.076
   99   1HG   GLN  36          1HG       GLN  36 -10.686   2.962  -0.138
  100   2HG   GLN  36          2HG       GLN  36 -10.719   3.789   1.410
  101   1HE2  GLN  36          2HE2      GLN  36 -12.076   3.620  -1.844
  102   2HE2  GLN  36          1HE2      GLN  36 -13.245   4.913  -1.602
  103    H    CYS  37           H        CYS  37  -6.563   4.882   1.274
  104    HA   CYS  37           HA       CYS  37  -6.500   4.943   4.195
  105   1HB   CYS  37          1HB       CYS  37  -6.125   2.387   2.585
  106   2HB   CYS  37          2HB       CYS  37  -5.237   2.631   4.063
  107    H    ARG  38           H        ARG  38  -4.154   4.352   4.891
  108    HA   ARG  38           HA       ARG  38  -2.337   6.250   3.877
  109   1HB   ARG  38          1HB       ARG  38  -1.797   3.695   5.464
  110   2HB   ARG  38          2HB       ARG  38  -0.593   4.918   5.096
  111   1HG   ARG  38          1HG       ARG  38  -1.090   5.668   7.115
  112   2HG   ARG  38          2HG       ARG  38  -2.322   6.584   6.265
  113   1HD   ARG  38          1HD       ARG  38  -2.861   3.854   7.510
  114   2HD   ARG  38          2HD       ARG  38  -2.880   5.319   8.477
  115    HE   ARG  38           HE       ARG  38  -4.654   6.198   6.917
  116   1HH1  ARG  38          1HH2      ARG  38  -4.457   2.727   7.561
  117   2HH1  ARG  38          2HH2      ARG  38  -6.161   2.527   7.240
  118   1HH2  ARG  38          2HH1      ARG  38  -6.818   5.810   6.609
  119   2HH2  ARG  38          1HH1      ARG  38  -7.392   4.169   6.580
  120    H    ALA  39           H        ALA  39  -2.655   2.852   2.855
  121    HA   ALA  39           HA       ALA  39  -1.405   3.522   0.330
  122   1HB   ALA  39          1HB       ALA  39   0.623   3.066   1.701
  123   2HB   ALA  39          2HB       ALA  39  -0.065   1.494   2.181
  124   3HB   ALA  39          3HB       ALA  39   0.398   1.784   0.500
  125    HA   PRO  40           HA       PRO  40  -3.634  -0.336  -0.817
  126   1HB   PRO  40          2HB       PRO  40  -2.509  -0.904  -3.221
  127   2HB   PRO  40          1HB       PRO  40  -3.604   0.490  -2.990
  128   1HG   PRO  40          1HG       PRO  40  -0.568   0.497  -2.982
  129   2HG   PRO  40          2HG       PRO  40  -1.667   1.566  -3.909
  130   1HD   PRO  40          1HD       PRO  40  -0.562   2.284  -1.506
  131   2HD   PRO  40          2HD       PRO  40  -2.189   2.833  -2.004
  132    H    LYS  41           H        LYS  41  -2.941  -2.596  -1.423
  133    HA   LYS  41           HA       LYS  41  -1.263  -3.759   0.476
  134   1HB   LYS  41          1HB       LYS  41  -3.213  -4.694  -0.907
  135   2HB   LYS  41          2HB       LYS  41  -2.034  -5.047  -2.170
  136   1HG   LYS  41          1HG       LYS  41  -0.832  -6.562  -0.641
  137   2HG   LYS  41          2HG       LYS  41  -1.884  -6.076   0.706
  138   1HD   LYS  41          1HD       LYS  41  -3.844  -7.017  -0.486
  139   2HD   LYS  41          2HD       LYS  41  -2.794  -7.494  -1.840
  140   1HE   LYS  41          1HE       LYS  41  -1.469  -8.929  -0.297
  141   2HE   LYS  41          2HE       LYS  41  -2.516  -8.456   1.046
  142   1HZ   LYS  41          3HZ       LYS  41  -3.416  -9.929  -1.375
  143   2HZ   LYS  41          1HZ       LYS  41  -3.196 -10.585   0.100
  144   3HZ   LYS  41          2HZ       LYS  41  -4.384  -9.493  -0.131
  145    H    VAL  42           H        VAL  42  -0.124  -2.298  -2.344
  146    HA   VAL  42           HA       VAL  42   2.385  -3.587  -2.813
  147    HB   VAL  42           HB       VAL  42   1.633  -0.635  -2.966
  148   1HG1  VAL  42          3HG1      VAL  42   3.888  -2.167  -4.317
  149   2HG1  VAL  42          1HG1      VAL  42   3.421  -0.493  -4.688
  150   3HG1  VAL  42          2HG1      VAL  42   4.063  -0.885  -3.096
  151   1HG2  VAL  42          2HG2      VAL  42   1.523  -2.814  -5.100
  152   2HG2  VAL  42          3HG2      VAL  42   0.125  -1.982  -4.384
  153   3HG2  VAL  42          1HG2      VAL  42   1.258  -1.081  -5.386
  154    H    CYS  43           H        CYS  43   1.339  -1.378  -0.231
  155    HA   CYS  43           HA       CYS  43   3.949  -1.576   1.168
  156   1HB   CYS  43          1HB       CYS  43   3.984   0.258  -0.572
  157   2HB   CYS  43          2HB       CYS  43   2.678   1.059   0.308
  158    H    PHE  44           H        PHE  44   3.313   0.605   2.845
  159    HA   PHE  44           HA       PHE  44   0.670   0.153   4.093
  160   1HB   PHE  44          1HB       PHE  44   1.471  -0.142   6.281
  161   2HB   PHE  44          2HB       PHE  44   2.397  -1.266   5.307
  162    HD1  PHE  44           HD1      PHE  44   2.508   1.579   7.562
  163    HD2  PHE  44           HD2      PHE  44   4.827  -0.630   4.670
  164    HE1  PHE  44           HE1      PHE  44   4.586   2.621   8.431
  165    HE2  PHE  44           HE2      PHE  44   6.901   0.416   5.545
  166    HZ   PHE  44           HZ       PHE  44   6.785   2.045   7.418
  167    H    LYS  45           H        LYS  45   3.280   2.295   3.246
  168    HA   LYS  45           HA       LYS  45   1.688   4.658   3.991
  169   1HB   LYS  45          1HB       LYS  45   2.869   4.094   6.094
  170   2HB   LYS  45          2HB       LYS  45   4.409   4.070   5.250
  171   1HG   LYS  45          1HG       LYS  45   4.201   6.097   6.521
  172   2HG   LYS  45          2HG       LYS  45   4.213   6.508   4.808
  173   1HD   LYS  45          1HD       LYS  45   1.755   6.824   4.844
  174   2HD   LYS  45          2HD       LYS  45   1.708   6.301   6.546
  175   1HE   LYS  45          1HE       LYS  45   3.220   8.195   7.145
  176   2HE   LYS  45          2HE       LYS  45   3.222   8.723   5.459
  177   1HZ   LYS  45          2HZ       LYS  45   0.814   9.090   5.646
  178   2HZ   LYS  45          3HZ       LYS  45   0.820   8.603   7.210
  179   3HZ   LYS  45          1HZ       LYS  45   1.605   9.962   6.774
  180    H    CYS  46           H        CYS  46   5.091   3.855   3.053
  181    HA   CYS  46           HA       CYS  46   5.367   6.336   1.682
  182   1HB   CYS  46          1HB       CYS  46   7.654   5.237   1.105
  183   2HB   CYS  46          2HB       CYS  46   7.254   5.683   2.762
  184    H    LYS  47           H        LYS  47   4.685   3.121   0.444
  185    HA   LYS  47           HA       LYS  47   4.212   2.327  -1.661
  186   1HB   LYS  47          1HB       LYS  47   2.132   3.304  -2.437
  187   2HB   LYS  47          2HB       LYS  47   2.203   3.165  -0.688
  188   1HG   LYS  47          1HG       LYS  47   2.745   5.584  -0.509
  189   2HG   LYS  47          2HG       LYS  47   2.622   5.744  -2.263
  190   1HD   LYS  47          1HD       LYS  47   0.273   5.201  -2.214
  191   2HD   LYS  47          2HD       LYS  47   0.345   4.703  -0.516
  192   1HE   LYS  47          1HE       LYS  47   1.016   7.526  -1.435
  193   2HE   LYS  47          2HE       LYS  47  -0.623   7.024  -1.001
  194   1HZ   LYS  47          2HZ       LYS  47   1.679   6.791   0.874
  195   2HZ   LYS  47          3HZ       LYS  47   0.590   8.022   0.889
  196   3HZ   LYS  47          1HZ       LYS  47   0.121   6.484   1.209
  197    H    GLN  48           H        GLN  48   6.616   4.015  -2.022
  198    HA   GLN  48           HA       GLN  48   6.382   5.372  -4.530
  199   1HB   GLN  48          1HB       GLN  48   8.838   4.174  -3.180
  200   2HB   GLN  48          2HB       GLN  48   8.882   5.282  -4.545
  201   1HG   GLN  48          1HG       GLN  48   7.877   5.901  -1.739
  202   2HG   GLN  48          2HG       GLN  48   9.345   6.486  -2.494
  203   1HE2  GLN  48          2HE2      GLN  48   6.005   7.161  -1.996
  204   2HE2  GLN  48          1HE2      GLN  48   5.911   8.529  -3.111
  205    HA   PRO  49           HA       PRO  49   5.968   2.540  -7.666
  206   1HB   PRO  49          2HB       PRO  49   8.475   3.581  -9.003
  207   2HB   PRO  49          1HB       PRO  49   6.866   3.257  -9.728
  208   1HG   PRO  49          1HG       PRO  49   7.531   5.776  -9.037
  209   2HG   PRO  49          2HG       PRO  49   5.905   5.144  -8.614
  210   1HD   PRO  49          1HD       PRO  49   8.333   5.427  -6.848
  211   2HD   PRO  49          2HD       PRO  49   6.618   5.790  -6.503
  212    H    GLY  50           H        GLY  50   9.181   2.119  -6.283
  213   1HA   GLY  50          2HA       GLY  50  10.436   0.124  -7.551
  214   2HA   GLY  50          1HA       GLY  50   9.045  -0.778  -6.958
  215    H    HIS  51           H        HIS  51   9.665   1.456  -4.569
  216    HA   HIS  51           HA       HIS  51  12.005   0.481  -3.292
  217   1HB   HIS  51          1HB       HIS  51  11.398   1.878  -1.520
  218   2HB   HIS  51          2HB       HIS  51  10.678   2.674  -2.910
  219    HD1  HIS  51           HD1      HIS  51   7.808   1.752  -3.159
  220    HD2  HIS  51           HD2      HIS  51   9.893   1.426   0.492
  221    HE1  HIS  51           HE1      HIS  51   6.088   1.171  -1.389
  222    H    PHE  52           H        PHE  52   8.735  -0.773  -3.230
  223    HA   PHE  52           HA       PHE  52   8.653  -1.848  -0.650
  224   1HB   PHE  52          1HB       PHE  52   6.733  -3.210  -1.579
  225   2HB   PHE  52          2HB       PHE  52   6.633  -1.474  -1.742
  226    HD1  PHE  52           HD1      PHE  52   7.107  -4.655  -3.601
  227    HD2  PHE  52           HD2      PHE  52   6.633  -0.376  -3.914
  228    HE1  PHE  52           HE1      PHE  52   6.714  -4.870  -6.039
  229    HE2  PHE  52           HE2      PHE  52   6.220  -0.602  -6.342
  230    HZ   PHE  52           HZ       PHE  52   6.274  -2.844  -7.418
  231    H    SER  53           H        SER  53   9.627  -3.530  -3.663
  232    HA   SER  53           HA       SER  53  10.117  -6.090  -2.559
  233   1HB   SER  53          1HB       SER  53  11.541  -4.709  -4.867
  234   2HB   SER  53          2HB       SER  53  11.478  -6.458  -4.565
  235    HG   SER  53           HG       SER  53   9.912  -5.787  -6.103
  236    H    LYS  54           H        LYS  54  11.741  -3.290  -1.701
  237    HA   LYS  54           HA       LYS  54  14.214  -4.724  -0.821
  238   1HB   LYS  54          1HB       LYS  54  14.021  -1.871  -1.884
  239   2HB   LYS  54          2HB       LYS  54  15.488  -2.712  -1.371
  240   1HG   LYS  54          1HG       LYS  54  15.175  -4.359  -3.226
  241   2HG   LYS  54          2HG       LYS  54  13.756  -3.445  -3.774
  242   1HD   LYS  54          1HD       LYS  54  15.182  -1.429  -4.086
  243   2HD   LYS  54          2HD       LYS  54  16.607  -2.391  -3.626
  244   1HE   LYS  54          1HE       LYS  54  16.133  -3.961  -5.504
  245   2HE   LYS  54          2HE       LYS  54  14.723  -2.995  -5.956
  246   1HZ   LYS  54          1HZ       LYS  54  16.230  -1.125  -6.396
  247   2HZ   LYS  54          2HZ       LYS  54  17.533  -2.024  -5.985
  248   3HZ   LYS  54          3HZ       LYS  54  16.653  -2.413  -7.303
  249    H    GLN  55           H        GLN  55  11.490  -3.440   0.408
  250    HA   GLN  55           HA       GLN  55  12.754  -2.878   2.991
  251   1HB   GLN  55          1HB       GLN  55  12.849  -0.671   1.820
  252   2HB   GLN  55          2HB       GLN  55  11.096  -0.703   1.635
  253   1HG   GLN  55          1HG       GLN  55  10.888  -0.778   4.154
  254   2HG   GLN  55          2HG       GLN  55  12.647  -0.672   4.267
  255   1HE2  GLN  55          1HE2      GLN  55   9.676   1.077   3.458
  256   2HE2  GLN  55          2HE2      GLN  55  10.422   2.673   3.427
  257    H    CYS  56           H        CYS  56   9.555  -2.211   1.470
  258    HA   CYS  56           HA       CYS  56   8.246  -2.939   3.944
  259   1HB   CYS  56          1HB       CYS  56   7.174  -1.859   1.301
  260   2HB   CYS  56          2HB       CYS  56   6.284  -1.941   2.830
  261    H    ARG  57           H        ARG  57   8.766  -4.659   1.012
  262    HA   ARG  57           HA       ARG  57   6.831  -6.802   1.737
  263   1HB   ARG  57          1HB       ARG  57   6.166  -4.847  -0.105
  264   2HB   ARG  57          2HB       ARG  57   6.978  -5.986  -1.153
  265   1HG   ARG  57          1HG       ARG  57   4.957  -7.001  -1.295
  266   2HG   ARG  57          2HG       ARG  57   5.304  -7.680   0.291
  267   1HD   ARG  57          1HD       ARG  57   3.660  -5.220  -0.404
  268   2HD   ARG  57          2HD       ARG  57   3.094  -6.717   0.350
  269    HE   ARG  57           HE       ARG  57   5.077  -5.534   2.042
  270   1HH1  ARG  57          1HH2      ARG  57   1.837  -4.708   0.995
  271   2HH1  ARG  57          2HH2      ARG  57   1.646  -3.563   2.297
  272   1HH2  ARG  57          2HH1      ARG  57   4.714  -4.225   3.690
  273   2HH2  ARG  57          1HH1      ARG  57   3.140  -3.479   3.932
  274    H    SER  58           H        SER  58   9.874  -6.374   1.525
  275    HA   SER  58           HA       SER  58  11.194  -7.785  -0.420
  276   1HB   SER  58          1HB       SER  58  11.822  -7.886   2.549
  277   2HB   SER  58          2HB       SER  58  12.953  -8.147   1.208
  278    HG   SER  58           HG       SER  58  13.018  -5.981   2.054

  No H/Q in entry =         278
  Start of MODEL    5
    1    H1   GLN  22           H2       GLN  22  -8.160  -0.367  -6.125
    2    H2   GLN  22           H1       GLN  22  -7.095   0.784  -5.659
    3    H3   GLN  22           H3       GLN  22  -7.147   0.300  -7.234
    4    HA   GLN  22           HA       GLN  22  -6.435  -1.919  -6.616
    5   1HB   GLN  22          1HB       GLN  22  -4.735  -0.241  -7.308
    6   2HB   GLN  22          2HB       GLN  22  -4.568   0.287  -5.637
    7   1HG   GLN  22          1HG       GLN  22  -2.718  -1.151  -6.247
    8   2HG   GLN  22          2HG       GLN  22  -3.677  -1.953  -5.013
    9   1HE2  GLN  22          2HE2      GLN  22  -2.069  -2.552  -7.898
   10   2HE2  GLN  22          1HE2      GLN  22  -3.007  -3.955  -8.394
   11    H    THR  23           H        THR  23  -6.266  -3.475  -5.041
   12    HA   THR  23           HA       THR  23  -7.734  -3.247  -2.733
   13    HB   THR  23           HB       THR  23  -5.433  -5.185  -3.136
   14    HG1  THR  23           HG1      THR  23  -6.976  -6.408  -4.225
   15   1HG2  THR  23          3HG2      THR  23  -8.094  -5.461  -1.658
   16   2HG2  THR  23          1HG2      THR  23  -6.917  -6.765  -1.918
   17   3HG2  THR  23          2HG2      THR  23  -6.483  -5.391  -0.896
   18    H    CYS  24           H        CYS  24  -7.527  -2.699  -0.683
   19    HA   CYS  24           HA       CYS  24  -5.576  -1.000   0.321
   20   1HB   CYS  24          1HB       CYS  24  -7.966  -1.476   1.078
   21   2HB   CYS  24          2HB       CYS  24  -7.337  -2.887   1.928
   22    H    TYR  25           H        TYR  25  -3.938  -1.163   1.864
   23    HA   TYR  25           HA       TYR  25  -2.398  -3.608   2.155
   24   1HB   TYR  25          1HB       TYR  25  -0.903  -2.377   3.359
   25   2HB   TYR  25          2HB       TYR  25  -1.554  -1.159   2.284
   26    HD1  TYR  25           HD1      TYR  25  -0.452  -1.681   5.506
   27    HD2  TYR  25           HD2      TYR  25  -3.858   0.016   3.470
   28    HE1  TYR  25           HE1      TYR  25  -0.952  -0.282   7.498
   29    HE2  TYR  25           HE2      TYR  25  -4.385   1.355   5.478
   30    HH   TYR  25           HH       TYR  25  -2.378   1.250   8.440
   31    H    ASN  26           H        ASN  26  -5.215  -2.490   3.730
   32    HA   ASN  26           HA       ASN  26  -4.810  -4.314   6.088
   33   1HB   ASN  26          1HB       ASN  26  -4.331  -2.017   6.715
   34   2HB   ASN  26          2HB       ASN  26  -5.793  -1.427   5.931
   35   1HD2  ASN  26          2HD2      ASN  26  -7.830  -1.647   7.013
   36   2HD2  ASN  26          1HD2      ASN  26  -7.885  -2.169   8.691
   37    H    CYS  27           H        CYS  27  -7.283  -2.514   4.199
   38    HA   CYS  27           HA       CYS  27  -9.450  -3.802   5.554
   39   1HB   CYS  27          1HB       CYS  27  -9.446  -1.997   3.108
   40   2HB   CYS  27          2HB       CYS  27 -10.811  -2.316   4.184
   41    H    GLY  28           H        GLY  28  -7.660  -4.938   2.900
   42   1HA   GLY  28          2HA       GLY  28  -9.210  -7.234   2.421
   43   2HA   GLY  28          1HA       GLY  28  -7.950  -6.609   1.352
   44    H    LYS  29           H        LYS  29  -9.395  -4.108   0.783
   45    HA   LYS  29           HA       LYS  29 -11.773  -5.044  -0.776
   46   1HB   LYS  29          1HB       LYS  29 -12.274  -3.809   1.306
   47   2HB   LYS  29          2HB       LYS  29 -11.327  -2.454   0.730
   48   1HG   LYS  29          1HG       LYS  29 -13.598  -1.899   0.375
   49   2HG   LYS  29          2HG       LYS  29 -12.947  -2.244  -1.227
   50   1HD   LYS  29          1HD       LYS  29 -13.982  -4.511  -1.157
   51   2HD   LYS  29          2HD       LYS  29 -14.557  -4.193   0.493
   52   1HE   LYS  29          1HE       LYS  29 -15.878  -2.255  -0.364
   53   2HE   LYS  29          2HE       LYS  29 -15.343  -2.628  -2.008
   54   1HZ   LYS  29          1HZ       LYS  29 -16.458  -4.795  -1.798
   55   2HZ   LYS  29          2HZ       LYS  29 -16.950  -4.439  -0.280
   56   3HZ   LYS  29          3HZ       LYS  29 -17.526  -3.588  -1.545
   57    HA   PRO  30           HA       PRO  30  -9.223  -3.716  -4.263
   58   1HB   PRO  30          2HB       PRO  30 -11.934  -3.730  -5.593
   59   2HB   PRO  30          1HB       PRO  30 -10.363  -4.325  -6.221
   60   1HG   PRO  30          1HG       PRO  30 -12.137  -6.069  -5.177
   61   2HG   PRO  30          2HG       PRO  30 -10.401  -6.201  -4.735
   62   1HD   PRO  30          1HD       PRO  30 -12.664  -4.987  -3.146
   63   2HD   PRO  30          2HD       PRO  30 -11.315  -6.034  -2.602
   64    H    GLY  31           H        GLY  31 -12.160  -1.890  -3.456
   65   1HA   GLY  31          2HA       GLY  31 -12.876   0.247  -3.899
   66   2HA   GLY  31          1HA       GLY  31 -11.674   0.351  -5.184
   67    H    HIS  32           H        HIS  32  -9.331  -0.004  -3.533
   68    HA   HIS  32           HA       HIS  32  -9.388   2.390  -1.759
   69   1HB   HIS  32          1HB       HIS  32  -7.934  -0.222  -1.634
   70   2HB   HIS  32          2HB       HIS  32  -7.113   1.207  -1.018
   71    HD1  HIS  32           HD1      HIS  32 -10.418  -0.705  -0.429
   72    HD2  HIS  32           HD2      HIS  32  -7.756   1.996   1.355
   73    HE1  HIS  32           HE1      HIS  32 -11.235  -0.377   1.987
   74    H    LEU  33           H        LEU  33  -7.673   3.720  -1.610
   75    HA   LEU  33           HA       LEU  33  -5.747   4.224  -3.746
   76   1HB   LEU  33          1HB       LEU  33  -8.184   6.003  -3.183
   77   2HB   LEU  33          2HB       LEU  33  -6.781   6.538  -4.097
   78    HG   LEU  33           HG       LEU  33  -8.683   4.333  -4.984
   79   1HD1  LEU  33          1HD1      LEU  33  -9.713   6.559  -4.987
   80   2HD1  LEU  33          2HD1      LEU  33  -8.347   7.206  -5.925
   81   3HD1  LEU  33          3HD1      LEU  33  -9.426   5.983  -6.637
   82   1HD2  LEU  33          3HD2      LEU  33  -6.373   5.713  -6.437
   83   2HD2  LEU  33          1HD2      LEU  33  -6.401   4.014  -5.913
   84   3HD2  LEU  33          2HD2      LEU  33  -7.520   4.565  -7.163
   85    H    SER  34           H        SER  34  -4.586   6.355  -3.125
   86    HA   SER  34           HA       SER  34  -3.851   6.705  -0.421
   87   1HB   SER  34          1HB       SER  34  -3.953   8.709  -2.710
   88   2HB   SER  34          2HB       SER  34  -3.083   8.960  -1.184
   89    HG   SER  34           HG       SER  34  -1.941   7.991  -3.143
   90    H    SER  35           H        SER  35  -6.711   7.901  -2.084
   91    HA   SER  35           HA       SER  35  -7.538   9.719   0.058
   92   1HB   SER  35          1HB       SER  35  -9.072   8.710  -2.367
   93   2HB   SER  35          2HB       SER  35  -9.500  10.090  -1.335
   94    HG   SER  35           HG       SER  35  -8.419  10.778  -3.225
   95    H    GLN  36           H        GLN  36  -7.467   6.442   0.093
   96    HA   GLN  36           HA       GLN  36 -10.073   6.137   1.543
   97   1HB   GLN  36          1HB       GLN  36  -9.711   5.065  -0.842
   98   2HB   GLN  36          2HB       GLN  36  -8.699   3.921   0.027
   99   1HG   GLN  36          1HG       GLN  36 -10.759   2.839   0.004
  100   2HG   GLN  36          2HG       GLN  36 -10.807   3.607   1.585
  101   1HE2  GLN  36          2HE2      GLN  36 -12.202   3.487  -1.661
  102   2HE2  GLN  36          1HE2      GLN  36 -13.472   4.664  -1.339
  103    H    CYS  37           H        CYS  37  -6.706   4.918   1.277
  104    HA   CYS  37           HA       CYS  37  -6.468   4.873   4.197
  105   1HB   CYS  37          1HB       CYS  37  -6.064   2.409   2.460
  106   2HB   CYS  37          2HB       CYS  37  -5.115   2.636   3.903
  107    H    ARG  38           H        ARG  38  -4.079   4.392   4.764
  108    HA   ARG  38           HA       ARG  38  -2.373   6.373   3.692
  109   1HB   ARG  38          1HB       ARG  38  -1.671   3.810   5.201
  110   2HB   ARG  38          2HB       ARG  38  -0.530   5.079   4.796
  111   1HG   ARG  38          1HG       ARG  38  -0.948   5.719   6.882
  112   2HG   ARG  38          2HG       ARG  38  -2.198   6.673   6.102
  113   1HD   ARG  38          1HD       ARG  38  -2.741   3.901   7.236
  114   2HD   ARG  38          2HD       ARG  38  -2.685   5.308   8.285
  115    HE   ARG  38           HE       ARG  38  -4.490   6.311   6.807
  116   1HH1  ARG  38          2HH1      ARG  38  -4.379   2.831   7.420
  117   2HH1  ARG  38          1HH1      ARG  38  -6.096   2.685   7.149
  118   1HH2  ARG  38          2HH2      ARG  38  -6.679   6.005   6.627
  119   2HH2  ARG  38          1HH2      ARG  38  -7.329   4.393   6.684
  120    H    ALA  39           H        ALA  39  -2.563   2.936   2.742
  121    HA   ALA  39           HA       ALA  39  -1.406   3.587   0.140
  122   1HB   ALA  39          1HB       ALA  39  -0.017   1.631   2.032
  123   2HB   ALA  39          2HB       ALA  39   0.446   1.929   0.352
  124   3HB   ALA  39          3HB       ALA  39   0.624   3.220   1.551
  125    HA   PRO  40           HA       PRO  40  -3.616  -0.328  -0.864
  126   1HB   PRO  40          2HB       PRO  40  -2.497  -0.949  -3.260
  127   2HB   PRO  40          1HB       PRO  40  -3.628   0.424  -3.071
  128   1HG   PRO  40          1HG       PRO  40  -0.595   0.494  -3.105
  129   2HG   PRO  40          2HG       PRO  40  -1.732   1.521  -4.031
  130   1HD   PRO  40          1HD       PRO  40  -0.586   2.310  -1.668
  131   2HD   PRO  40          2HD       PRO  40  -2.231   2.825  -2.145
  132    H    LYS  41           H        LYS  41  -2.905  -2.605  -1.437
  133    HA   LYS  41           HA       LYS  41  -1.170  -3.715   0.444
  134   1HB   LYS  41          1HB       LYS  41  -3.116  -4.725  -0.890
  135   2HB   LYS  41          2HB       LYS  41  -1.955  -5.039  -2.179
  136   1HG   LYS  41          1HG       LYS  41  -0.653  -6.493  -0.656
  137   2HG   LYS  41          2HG       LYS  41  -1.721  -6.059   0.695
  138   1HD   LYS  41          1HD       LYS  41  -3.636  -7.101  -0.493
  139   2HD   LYS  41          2HD       LYS  41  -2.564  -7.522  -1.849
  140   1HE   LYS  41          1HE       LYS  41  -1.156  -8.872  -0.296
  141   2HE   LYS  41          2HE       LYS  41  -2.243  -8.468   1.038
  142   1HZ   LYS  41          3HZ       LYS  41  -4.031  -9.616  -0.162
  143   2HZ   LYS  41          1HZ       LYS  41  -3.023  -9.991  -1.393
  144   3HZ   LYS  41          2HZ       LYS  41  -2.782 -10.632   0.086
  145    H    VAL  42           H        VAL  42  -0.137  -2.294  -2.455
  146    HA   VAL  42           HA       VAL  42   2.394  -3.496  -2.952
  147    HB   VAL  42           HB       VAL  42   1.587  -0.559  -3.077
  148   1HG1  VAL  42          3HG1      VAL  42   3.835  -2.052  -4.482
  149   2HG1  VAL  42          1HG1      VAL  42   3.334  -0.384  -4.839
  150   3HG1  VAL  42          2HG1      VAL  42   4.015  -0.771  -3.262
  151   1HG2  VAL  42          2HG2      VAL  42   1.456  -2.730  -5.217
  152   2HG2  VAL  42          3HG2      VAL  42   0.064  -1.921  -4.463
  153   3HG2  VAL  42          1HG2      VAL  42   1.161  -1.000  -5.488
  154    H    CYS  43           H        CYS  43   1.358  -1.300  -0.345
  155    HA   CYS  43           HA       CYS  43   3.977  -1.509   1.025
  156   1HB   CYS  43          1HB       CYS  43   4.013   0.334  -0.715
  157   2HB   CYS  43          2HB       CYS  43   2.734   1.149   0.194
  158    H    PHE  44           H        PHE  44   3.351   0.701   2.689
  159    HA   PHE  44           HA       PHE  44   0.724   0.253   3.968
  160   1HB   PHE  44          1HB       PHE  44   1.537  -0.050   6.147
  161   2HB   PHE  44          2HB       PHE  44   2.465  -1.169   5.170
  162    HD1  PHE  44           HD1      PHE  44   2.569   1.658   7.441
  163    HD2  PHE  44           HD2      PHE  44   4.888  -0.510   4.517
  164    HE1  PHE  44           HE1      PHE  44   4.645   2.709   8.306
  165    HE2  PHE  44           HE2      PHE  44   6.959   0.549   5.386
  166    HZ   PHE  44           HZ       PHE  44   6.842   2.161   7.274
  167    H    LYS  45           H        LYS  45   3.392   2.367   3.170
  168    HA   LYS  45           HA       LYS  45   1.796   4.749   3.817
  169   1HB   LYS  45          1HB       LYS  45   2.864   4.204   5.986
  170   2HB   LYS  45          2HB       LYS  45   4.445   4.157   5.220
  171   1HG   LYS  45          1HG       LYS  45   4.183   6.205   6.453
  172   2HG   LYS  45          2HG       LYS  45   4.295   6.588   4.737
  173   1HD   LYS  45          1HD       LYS  45   1.837   6.917   4.633
  174   2HD   LYS  45          2HD       LYS  45   1.697   6.436   6.342
  175   1HE   LYS  45          1HE       LYS  45   3.186   8.337   6.975
  176   2HE   LYS  45          2HE       LYS  45   3.288   8.817   5.277
  177   1HZ   LYS  45          3HZ       LYS  45   0.876   9.204   5.315
  178   2HZ   LYS  45          1HZ       LYS  45   0.790   8.764   6.892
  179   3HZ   LYS  45          2HZ       LYS  45   1.609  10.106   6.459
  180    H    CYS  46           H        CYS  46   5.213   3.852   3.036
  181    HA   CYS  46           HA       CYS  46   5.671   6.320   1.713
  182   1HB   CYS  46          1HB       CYS  46   7.900   5.076   1.162
  183   2HB   CYS  46          2HB       CYS  46   7.492   5.538   2.812
  184    H    LYS  47           H        LYS  47   4.843   3.180   0.386
  185    HA   LYS  47           HA       LYS  47   4.384   2.452  -1.742
  186   1HB   LYS  47          1HB       LYS  47   2.337   3.479  -2.483
  187   2HB   LYS  47          2HB       LYS  47   2.419   3.368  -0.731
  188   1HG   LYS  47          1HG       LYS  47   3.137   5.818  -0.700
  189   2HG   LYS  47          2HG       LYS  47   2.762   5.882  -2.426
  190   1HD   LYS  47          1HD       LYS  47   0.419   5.390  -1.970
  191   2HD   LYS  47          2HD       LYS  47   0.790   4.996  -0.273
  192   1HE   LYS  47          1HE       LYS  47   1.628   7.323   0.065
  193   2HE   LYS  47          2HE       LYS  47   1.109   7.732  -1.580
  194   1HZ   LYS  47          2HZ       LYS  47  -0.682   6.747   0.579
  195   2HZ   LYS  47          3HZ       LYS  47  -0.560   8.315   0.110
  196   3HZ   LYS  47          1HZ       LYS  47  -1.159   7.203  -0.934
  197    H    GLN  48           H        GLN  48   6.850   4.048  -2.042
  198    HA   GLN  48           HA       GLN  48   6.715   5.453  -4.531
  199   1HB   GLN  48          1HB       GLN  48   9.094   4.111  -3.180
  200   2HB   GLN  48          2HB       GLN  48   9.205   5.243  -4.518
  201   1HG   GLN  48          1HG       GLN  48   8.211   5.848  -1.706
  202   2HG   GLN  48          2HG       GLN  48   9.711   6.379  -2.441
  203   1HE2  GLN  48          2HE2      GLN  48   6.406   7.203  -1.941
  204   2HE2  GLN  48          1HE2      GLN  48   6.383   8.599  -3.025
  205    HA   PRO  49           HA       PRO  49   6.200   2.717  -7.729
  206   1HB   PRO  49          2HB       PRO  49   8.809   3.602  -8.983
  207   2HB   PRO  49          1HB       PRO  49   7.206   3.394  -9.757
  208   1HG   PRO  49          1HG       PRO  49   8.012   5.854  -9.009
  209   2HG   PRO  49          2HG       PRO  49   6.337   5.325  -8.643
  210   1HD   PRO  49          1HD       PRO  49   8.724   5.432  -6.803
  211   2HD   PRO  49          2HD       PRO  49   7.025   5.891  -6.500
  212    H    GLY  50           H        GLY  50   9.384   2.080  -6.330
  213   1HA   GLY  50          2HA       GLY  50  10.490   0.002  -7.600
  214   2HA   GLY  50          1HA       GLY  50   9.046  -0.804  -6.987
  215    H    HIS  51           H        HIS  51   9.816   1.383  -4.610
  216    HA   HIS  51           HA       HIS  51  12.114   0.310  -3.352
  217   1HB   HIS  51          1HB       HIS  51  11.564   1.714  -1.563
  218   2HB   HIS  51          2HB       HIS  51  10.881   2.548  -2.950
  219    HD1  HIS  51           HD1      HIS  51   7.972   1.755  -3.203
  220    HD2  HIS  51           HD2      HIS  51  10.041   1.317   0.443
  221    HE1  HIS  51           HE1      HIS  51   6.227   1.248  -1.434
  222    H    PHE  52           H        PHE  52   8.802  -0.807  -3.264
  223    HA   PHE  52           HA       PHE  52   8.648  -1.782  -0.668
  224   1HB   PHE  52          1HB       PHE  52   6.708  -3.156  -1.621
  225   2HB   PHE  52          2HB       PHE  52   6.642  -1.414  -1.735
  226    HD1  PHE  52           HD1      PHE  52   7.120  -4.547  -3.695
  227    HD2  PHE  52           HD2      PHE  52   6.623  -0.263  -3.862
  228    HE1  PHE  52           HE1      PHE  52   6.762  -4.675  -6.146
  229    HE2  PHE  52           HE2      PHE  52   6.241  -0.403  -6.300
  230    HZ   PHE  52           HZ       PHE  52   6.326  -2.603  -7.457
  231    H    SER  53           H        SER  53   9.580  -3.663  -3.574
  232    HA   SER  53           HA       SER  53   9.824  -6.197  -2.353
  233   1HB   SER  53          1HB       SER  53  11.450  -5.048  -4.654
  234   2HB   SER  53          2HB       SER  53  11.222  -6.769  -4.282
  235    HG   SER  53           HG       SER  53   9.773  -6.037  -5.907
  236    H    LYS  54           H        LYS  54  11.728  -3.488  -1.656
  237    HA   LYS  54           HA       LYS  54  13.977  -5.113  -0.530
  238   1HB   LYS  54          1HB       LYS  54  14.124  -2.331  -1.771
  239   2HB   LYS  54          2HB       LYS  54  15.479  -3.262  -1.145
  240   1HG   LYS  54          1HG       LYS  54  13.818  -4.000  -3.593
  241   2HG   LYS  54          2HG       LYS  54  15.396  -3.223  -3.603
  242   1HD   LYS  54          1HD       LYS  54  16.448  -5.188  -2.590
  243   2HD   LYS  54          2HD       LYS  54  14.876  -6.000  -2.451
  244   1HE   LYS  54          1HE       LYS  54  14.598  -5.874  -4.922
  245   2HE   LYS  54          2HE       LYS  54  16.187  -5.112  -5.057
  246   1HZ   LYS  54          2HZ       LYS  54  15.692  -7.839  -3.976
  247   2HZ   LYS  54          3HZ       LYS  54  16.308  -7.509  -5.450
  248   3HZ   LYS  54          1HZ       LYS  54  17.164  -7.138  -4.112
  249    H    GLN  55           H        GLN  55  11.357  -3.602   0.537
  250    HA   GLN  55           HA       GLN  55  12.651  -2.809   3.066
  251   1HB   GLN  55          1HB       GLN  55  12.647  -0.746   1.587
  252   2HB   GLN  55          2HB       GLN  55  10.883  -0.818   1.588
  253   1HG   GLN  55          1HG       GLN  55  10.984  -0.679   4.142
  254   2HG   GLN  55          2HG       GLN  55  12.726  -0.433   3.994
  255   1HE2  GLN  55          1HE2      GLN  55   9.530   0.952   3.412
  256   2HE2  GLN  55          2HE2      GLN  55  10.085   2.599   3.152
  257    H    CYS  56           H        CYS  56   9.495  -2.904   1.331
  258    HA   CYS  56           HA       CYS  56   8.106  -3.178   3.946
  259   1HB   CYS  56          1HB       CYS  56   7.135  -2.202   1.228
  260   2HB   CYS  56          2HB       CYS  56   6.199  -2.214   2.727
  261    H    ARG  57           H        ARG  57   8.552  -4.869   0.942
  262    HA   ARG  57           HA       ARG  57   6.643  -7.065   1.697
  263   1HB   ARG  57          1HB       ARG  57   7.369  -6.030  -1.077
  264   2HB   ARG  57          2HB       ARG  57   6.294  -7.377  -0.748
  265   1HG   ARG  57          1HG       ARG  57   5.714  -4.476  -0.035
  266   2HG   ARG  57          2HG       ARG  57   5.123  -5.356  -1.438
  267   1HD   ARG  57          1HD       ARG  57   3.306  -5.583  -0.117
  268   2HD   ARG  57          2HD       ARG  57   4.159  -7.043   0.374
  269    HE   ARG  57           HE       ARG  57   5.058  -5.680   2.315
  270   1HH1  ARG  57          2HH2      ARG  57   2.018  -4.574   0.925
  271   2HH1  ARG  57          1HH2      ARG  57   1.772  -3.457   2.239
  272   1HH2  ARG  57          2HH1      ARG  57   4.606  -4.399   3.944
  273   2HH2  ARG  57          1HH1      ARG  57   3.084  -3.533   4.025
  274    H    SER  58           H        SER  58   9.730  -6.496   1.876
  275    HA   SER  58           HA       SER  58  11.329  -8.104   0.344
  276   1HB   SER  58          1HB       SER  58  11.578  -7.739   3.348
  277   2HB   SER  58          2HB       SER  58  12.879  -8.144   2.211
  278    HG   SER  58           HG       SER  58  12.798  -5.883   2.691

  No H/Q in entry =         278
  Start of MODEL    6
    1    H1   GLN  22           H3       GLN  22  -7.105   0.980  -5.618
    2    H2   GLN  22           H2       GLN  22  -7.158   0.544  -7.208
    3    H3   GLN  22           H1       GLN  22  -8.178  -0.149  -6.121
    4    HA   GLN  22           HA       GLN  22  -6.474  -1.701  -6.655
    5   1HB   GLN  22          1HB       GLN  22  -4.757  -0.031  -7.310
    6   2HB   GLN  22          2HB       GLN  22  -4.577   0.455  -5.626
    7   1HG   GLN  22          1HG       GLN  22  -2.746  -0.992  -6.295
    8   2HG   GLN  22          2HG       GLN  22  -3.698  -1.800  -5.059
    9   1HE2  GLN  22          1HE2      GLN  22  -2.132  -2.385  -7.968
   10   2HE2  GLN  22          2HE2      GLN  22  -3.098  -3.768  -8.470
   11    H    THR  23           H        THR  23  -6.226  -3.299  -5.125
   12    HA   THR  23           HA       THR  23  -7.737  -3.175  -2.841
   13    HB   THR  23           HB       THR  23  -5.386  -5.046  -3.254
   14    HG1  THR  23           HG1      THR  23  -6.891  -6.274  -4.394
   15   1HG2  THR  23          1HG2      THR  23  -8.058  -5.392  -1.816
   16   2HG2  THR  23          2HG2      THR  23  -6.872  -6.684  -2.099
   17   3HG2  THR  23          3HG2      THR  23  -6.456  -5.333  -1.040
   18    H    CYS  24           H        CYS  24  -7.593  -2.639  -0.781
   19    HA   CYS  24           HA       CYS  24  -5.707  -0.925   0.303
   20   1HB   CYS  24          1HB       CYS  24  -8.080  -1.478   1.038
   21   2HB   CYS  24          2HB       CYS  24  -7.431  -2.919   1.815
   22    H    TYR  25           H        TYR  25  -4.030  -1.072   1.811
   23    HA   TYR  25           HA       TYR  25  -2.437  -3.461   2.023
   24   1HB   TYR  25          1HB       TYR  25  -0.982  -2.275   3.288
   25   2HB   TYR  25          2HB       TYR  25  -1.667  -1.018   2.288
   26    HD1  TYR  25           HD1      TYR  25  -0.486  -1.642   5.436
   27    HD2  TYR  25           HD2      TYR  25  -4.025  -0.010   3.575
   28    HE1  TYR  25           HE1      TYR  25  -1.009  -0.392   7.519
   29    HE2  TYR  25           HE2      TYR  25  -4.571   1.180   5.684
   30    HH   TYR  25           HH       TYR  25  -2.502   0.983   8.588
   31    H    ASN  26           H        ASN  26  -5.247  -2.479   3.722
   32    HA   ASN  26           HA       ASN  26  -4.789  -4.480   5.920
   33   1HB   ASN  26          1HB       ASN  26  -4.395  -2.223   6.711
   34   2HB   ASN  26          2HB       ASN  26  -5.869  -1.626   5.954
   35   1HD2  ASN  26          2HD2      ASN  26  -7.906  -1.968   6.997
   36   2HD2  ASN  26          1HD2      ASN  26  -7.961  -2.604   8.634
   37    H    CYS  27           H        CYS  27  -7.348  -2.637   4.181
   38    HA   CYS  27           HA       CYS  27  -9.455  -4.083   5.462
   39   1HB   CYS  27          1HB       CYS  27  -9.548  -2.177   3.086
   40   2HB   CYS  27          2HB       CYS  27 -10.880  -2.586   4.177
   41    H    GLY  28           H        GLY  28  -7.717  -4.785   2.554
   42   1HA   GLY  28          2HA       GLY  28  -9.215  -7.138   1.906
   43   2HA   GLY  28          1HA       GLY  28  -7.933  -6.404   0.942
   44    H    LYS  29           H        LYS  29 -10.050  -3.923   1.118
   45    HA   LYS  29           HA       LYS  29 -12.033  -4.767  -0.917
   46   1HB   LYS  29          1HB       LYS  29 -11.580  -2.344   0.799
   47   2HB   LYS  29          2HB       LYS  29 -12.427  -2.130  -0.724
   48   1HG   LYS  29          1HG       LYS  29 -14.024  -2.363   0.989
   49   2HG   LYS  29          2HG       LYS  29 -14.142  -3.765  -0.064
   50   1HD   LYS  29          1HD       LYS  29 -12.541  -3.872   2.518
   51   2HD   LYS  29          2HD       LYS  29 -14.300  -4.016   2.541
   52   1HE   LYS  29          1HE       LYS  29 -14.257  -5.958   1.074
   53   2HE   LYS  29          2HE       LYS  29 -12.508  -5.831   0.884
   54   1HZ   LYS  29          1HZ       LYS  29 -13.885  -6.369   3.457
   55   2HZ   LYS  29          2HZ       LYS  29 -13.077  -7.478   2.567
   56   3HZ   LYS  29          3HZ       LYS  29 -12.262  -6.234   3.260
   57    HA   PRO  30           HA       PRO  30  -9.249  -3.637  -4.339
   58   1HB   PRO  30          2HB       PRO  30 -11.920  -3.541  -5.739
   59   2HB   PRO  30          1HB       PRO  30 -10.370  -4.240  -6.303
   60   1HG   PRO  30          1HG       PRO  30 -12.295  -5.853  -5.312
   61   2HG   PRO  30          2HG       PRO  30 -10.587  -6.100  -4.815
   62   1HD   PRO  30          1HD       PRO  30 -12.801  -4.697  -3.305
   63   2HD   PRO  30          2HD       PRO  30 -11.576  -5.860  -2.715
   64    H    GLY  31           H        GLY  31 -12.168  -1.776  -3.543
   65   1HA   GLY  31          2HA       GLY  31 -12.862   0.368  -3.988
   66   2HA   GLY  31          1HA       GLY  31 -11.620   0.486  -5.231
   67    H    HIS  32           H        HIS  32  -9.336   0.081  -3.503
   68    HA   HIS  32           HA       HIS  32  -9.434   2.447  -1.694
   69   1HB   HIS  32          1HB       HIS  32  -7.989  -0.168  -1.588
   70   2HB   HIS  32          2HB       HIS  32  -7.167   1.244  -0.939
   71    HD1  HIS  32           HD1      HIS  32 -10.563  -0.559  -0.442
   72    HD2  HIS  32           HD2      HIS  32  -7.770   1.912   1.468
   73    HE1  HIS  32           HE1      HIS  32 -11.358  -0.316   1.989
   74    H    LEU  33           H        LEU  33  -7.639   3.714  -1.440
   75    HA   LEU  33           HA       LEU  33  -5.747   4.300  -3.592
   76   1HB   LEU  33          1HB       LEU  33  -8.107   6.102  -2.827
   77   2HB   LEU  33          2HB       LEU  33  -6.719   6.661  -3.749
   78    HG   LEU  33           HG       LEU  33  -8.713   4.573  -4.715
   79   1HD1  LEU  33          1HD1      LEU  33  -9.677   6.824  -4.531
   80   2HD1  LEU  33          2HD1      LEU  33  -8.330   7.493  -5.477
   81   3HD1  LEU  33          3HD1      LEU  33  -9.469   6.349  -6.225
   82   1HD2  LEU  33          2HD2      LEU  33  -6.416   5.987  -6.154
   83   2HD2  LEU  33          3HD2      LEU  33  -6.477   4.257  -5.745
   84   3HD2  LEU  33          1HD2      LEU  33  -7.620   4.925  -6.915
   85    H    SER  34           H        SER  34  -4.460   6.294  -2.870
   86    HA   SER  34           HA       SER  34  -3.613   6.376  -0.185
   87   1HB   SER  34          1HB       SER  34  -3.595   8.655  -2.196
   88   2HB   SER  34          2HB       SER  34  -2.518   8.459  -0.800
   89    HG   SER  34           HG       SER  34  -1.674   7.775  -2.914
   90    H    SER  35           H        SER  35  -6.510   7.750  -1.522
   91    HA   SER  35           HA       SER  35  -7.011   9.571   0.757
   92   1HB   SER  35          1HB       SER  35  -9.005  10.194  -0.605
   93   2HB   SER  35          2HB       SER  35  -7.467  10.427  -1.453
   94    HG   SER  35           HG       SER  35  -9.057   9.370  -2.757
   95    H    GLN  36           H        GLN  36  -7.476   6.297   0.170
   96    HA   GLN  36           HA       GLN  36 -10.056   6.132   1.675
   97   1HB   GLN  36          1HB       GLN  36  -9.654   5.078  -0.697
   98   2HB   GLN  36          2HB       GLN  36  -8.703   3.886   0.177
   99   1HG   GLN  36          1HG       GLN  36 -10.793   2.866   0.069
  100   2HG   GLN  36          2HG       GLN  36 -10.871   3.604   1.661
  101   1HE2  GLN  36          2HE2      GLN  36 -12.181   3.571  -1.619
  102   2HE2  GLN  36          1HE2      GLN  36 -13.419   4.787  -1.314
  103    H    CYS  37           H        CYS  37  -6.739   4.848   1.527
  104    HA   CYS  37           HA       CYS  37  -6.558   4.718   4.450
  105   1HB   CYS  37          1HB       CYS  37  -6.121   2.305   2.640
  106   2HB   CYS  37          2HB       CYS  37  -5.218   2.490   4.117
  107    H    ARG  38           H        ARG  38  -4.175   4.244   5.004
  108    HA   ARG  38           HA       ARG  38  -2.476   6.235   3.915
  109   1HB   ARG  38          1HB       ARG  38  -1.867   3.754   5.572
  110   2HB   ARG  38          2HB       ARG  38  -0.670   4.994   5.196
  111   1HG   ARG  38          1HG       ARG  38  -1.394   6.385   6.772
  112   2HG   ARG  38          2HG       ARG  38  -3.063   6.292   6.241
  113   1HD   ARG  38          1HD       ARG  38  -1.690   4.256   8.047
  114   2HD   ARG  38          2HD       ARG  38  -2.696   5.580   8.622
  115    HE   ARG  38           HE       ARG  38  -3.578   3.040   7.586
  116   1HH1  ARG  38          2HH2      ARG  38  -4.676   6.364   7.905
  117   2HH1  ARG  38          1HH2      ARG  38  -6.350   5.904   7.784
  118   1HH2  ARG  38          2HH1      ARG  38  -5.717   2.551   7.402
  119   2HH2  ARG  38          1HH1      ARG  38  -6.913   3.805   7.434
  120    H    ALA  39           H        ALA  39  -2.750   2.853   2.864
  121    HA   ALA  39           HA       ALA  39  -1.618   3.634   0.328
  122   1HB   ALA  39          3HB       ALA  39  -0.132   1.560   2.009
  123   2HB   ALA  39          1HB       ALA  39   0.242   1.949   0.326
  124   3HB   ALA  39          2HB       ALA  39   0.489   3.173   1.577
  125    HA   PRO  40           HA       PRO  40  -3.717  -0.291  -0.903
  126   1HB   PRO  40          2HB       PRO  40  -2.562  -0.745  -3.317
  127   2HB   PRO  40          1HB       PRO  40  -3.763   0.562  -3.076
  128   1HG   PRO  40          1HG       PRO  40  -0.735   0.781  -3.086
  129   2HG   PRO  40          2HG       PRO  40  -1.918   1.791  -3.977
  130   1HD   PRO  40          1HD       PRO  40  -0.830   2.537  -1.578
  131   2HD   PRO  40          2HD       PRO  40  -2.500   2.979  -2.037
  132    H    LYS  41           H        LYS  41  -2.929  -2.513  -1.476
  133    HA   LYS  41           HA       LYS  41  -1.169  -3.468   0.447
  134   1HB   LYS  41          1HB       LYS  41  -3.080  -4.639  -0.817
  135   2HB   LYS  41          2HB       LYS  41  -1.931  -4.945  -2.106
  136   1HG   LYS  41          1HG       LYS  41  -2.251  -6.900  -0.683
  137   2HG   LYS  41          2HG       LYS  41  -0.579  -6.357  -0.587
  138   1HD   LYS  41          1HD       LYS  41  -1.000  -5.317   1.603
  139   2HD   LYS  41          2HD       LYS  41  -2.737  -5.689   1.465
  140   1HE   LYS  41          1HE       LYS  41  -2.227  -8.099   1.482
  141   2HE   LYS  41          2HE       LYS  41  -0.495  -7.748   1.579
  142   1HZ   LYS  41          1HZ       LYS  41  -2.491  -6.939   3.634
  143   2HZ   LYS  41          2HZ       LYS  41  -1.467  -8.204   3.777
  144   3HZ   LYS  41          3HZ       LYS  41  -0.886  -6.680   3.729
  145    H    VAL  42           H        VAL  42  -0.127  -2.240  -2.537
  146    HA   VAL  42           HA       VAL  42   2.396  -3.464  -2.945
  147    HB   VAL  42           HB       VAL  42   1.674  -0.512  -3.194
  148   1HG1  VAL  42          3HG1      VAL  42   3.830  -2.162  -4.576
  149   2HG1  VAL  42          1HG1      VAL  42   3.400  -0.488  -4.988
  150   3HG1  VAL  42          2HG1      VAL  42   4.097  -0.845  -3.411
  151   1HG2  VAL  42          3HG2      VAL  42   1.404  -2.774  -5.223
  152   2HG2  VAL  42          1HG2      VAL  42   0.071  -1.848  -4.497
  153   3HG2  VAL  42          2HG2      VAL  42   1.199  -1.046  -5.583
  154    H    CYS  43           H        CYS  43   1.364  -1.203  -0.426
  155    HA   CYS  43           HA       CYS  43   3.970  -1.360   0.977
  156   1HB   CYS  43          1HB       CYS  43   3.956   0.478  -0.768
  157   2HB   CYS  43          2HB       CYS  43   2.645   1.256   0.129
  158    H    PHE  44           H        PHE  44   3.411   0.670   2.728
  159    HA   PHE  44           HA       PHE  44   0.710   0.322   3.919
  160   1HB   PHE  44          1HB       PHE  44   1.493   0.158   6.116
  161   2HB   PHE  44          2HB       PHE  44   2.465  -0.995   5.222
  162    HD1  PHE  44           HD1      PHE  44   2.470   1.962   7.326
  163    HD2  PHE  44           HD2      PHE  44   4.880  -0.310   4.560
  164    HE1  PHE  44           HE1      PHE  44   4.510   3.116   8.151
  165    HE2  PHE  44           HE2      PHE  44   6.910   0.858   5.380
  166    HZ   PHE  44           HZ       PHE  44   6.730   2.575   7.168
  167    H    LYS  45           H        LYS  45   3.302   2.420   2.929
  168    HA   LYS  45           HA       LYS  45   1.687   4.818   3.450
  169   1HB   LYS  45          1HB       LYS  45   2.806   4.410   5.622
  170   2HB   LYS  45          2HB       LYS  45   4.386   4.449   4.838
  171   1HG   LYS  45          1HG       LYS  45   3.983   6.814   4.165
  172   2HG   LYS  45          2HG       LYS  45   2.393   6.766   4.938
  173   1HD   LYS  45          1HD       LYS  45   5.064   6.352   6.363
  174   2HD   LYS  45          2HD       LYS  45   4.169   7.875   6.303
  175   1HE   LYS  45          1HE       LYS  45   2.235   6.786   7.433
  176   2HE   LYS  45          2HE       LYS  45   3.150   5.276   7.537
  177   1HZ   LYS  45          1HZ       LYS  45   4.793   6.448   8.912
  178   2HZ   LYS  45          2HZ       LYS  45   3.942   7.838   8.819
  179   3HZ   LYS  45          3HZ       LYS  45   3.316   6.550   9.596
  180    H    CYS  46           H        CYS  46   5.143   4.024   2.752
  181    HA   CYS  46           HA       CYS  46   5.581   6.341   1.258
  182   1HB   CYS  46          1HB       CYS  46   7.654   4.679   0.538
  183   2HB   CYS  46          2HB       CYS  46   7.569   5.698   1.964
  184    H    LYS  47           H        LYS  47   4.619   3.193   0.059
  185    HA   LYS  47           HA       LYS  47   4.115   2.354  -1.996
  186   1HB   LYS  47          1HB       LYS  47   2.154   3.358  -2.869
  187   2HB   LYS  47          2HB       LYS  47   2.174   3.523  -1.119
  188   1HG   LYS  47          1HG       LYS  47   2.859   5.914  -1.345
  189   2HG   LYS  47          2HG       LYS  47   2.910   5.733  -3.097
  190   1HD   LYS  47          1HD       LYS  47   0.839   6.804  -2.543
  191   2HD   LYS  47          2HD       LYS  47   0.480   5.173  -3.094
  192   1HE   LYS  47          1HE       LYS  47  -0.923   5.577  -1.218
  193   2HE   LYS  47          2HE       LYS  47   0.320   4.450  -0.673
  194   1HZ   LYS  47          2HZ       LYS  47   0.351   7.383  -0.175
  195   2HZ   LYS  47          3HZ       LYS  47  -0.060   6.233   0.925
  196   3HZ   LYS  47          1HZ       LYS  47   1.470   6.309   0.386
  197    H    GLN  48           H        GLN  48   6.650   3.991  -2.348
  198    HA   GLN  48           HA       GLN  48   6.570   5.116  -4.963
  199   1HB   GLN  48          1HB       GLN  48   8.939   3.932  -3.461
  200   2HB   GLN  48          2HB       GLN  48   9.054   4.959  -4.881
  201   1HG   GLN  48          1HG       GLN  48   8.006   5.758  -2.138
  202   2HG   GLN  48          2HG       GLN  48   9.509   6.258  -2.888
  203   1HE2  GLN  48          2HE2      GLN  48   6.190   7.072  -2.484
  204   2HE2  GLN  48          1HE2      GLN  48   6.160   8.379  -3.674
  205    HA   PRO  49           HA       PRO  49   6.098   2.087  -7.876
  206   1HB   PRO  49          2HB       PRO  49   8.695   2.873  -9.216
  207   2HB   PRO  49          1HB       PRO  49   7.091   2.578  -9.961
  208   1HG   PRO  49          1HG       PRO  49   7.883   5.106  -9.452
  209   2HG   PRO  49          2HG       PRO  49   6.211   4.602  -9.037
  210   1HD   PRO  49          1HD       PRO  49   8.596   4.904  -7.216
  211   2HD   PRO  49          2HD       PRO  49   6.892   5.374  -6.958
  212    H    GLY  50           H        GLY  50   9.339   1.671  -6.503
  213   1HA   GLY  50          2HA       GLY  50  10.477  -0.501  -7.514
  214   2HA   GLY  50          1HA       GLY  50   9.057  -1.284  -6.825
  215    H    HIS  51           H        HIS  51   9.690   1.130  -4.664
  216    HA   HIS  51           HA       HIS  51  12.034   0.290  -3.304
  217   1HB   HIS  51          1HB       HIS  51  11.421   1.823  -1.655
  218   2HB   HIS  51          2HB       HIS  51  10.720   2.499  -3.113
  219    HD1  HIS  51           HD1      HIS  51   7.839   1.504  -3.294
  220    HD2  HIS  51           HD2      HIS  51   9.897   1.708   0.382
  221    HE1  HIS  51           HE1      HIS  51   6.102   1.200  -1.474
  222    H    PHE  52           H        PHE  52   8.782  -1.020  -3.149
  223    HA   PHE  52           HA       PHE  52   8.757  -1.933  -0.499
  224   1HB   PHE  52          1HB       PHE  52   6.894  -3.413  -1.262
  225   2HB   PHE  52          2HB       PHE  52   6.729  -1.713  -1.649
  226    HD1  PHE  52           HD1      PHE  52   6.723  -0.898  -3.952
  227    HD2  PHE  52           HD2      PHE  52   7.283  -5.090  -3.082
  228    HE1  PHE  52           HE1      PHE  52   6.334  -1.448  -6.334
  229    HE2  PHE  52           HE2      PHE  52   6.898  -5.630  -5.471
  230    HZ   PHE  52           HZ       PHE  52   6.428  -3.811  -7.104
  231    H    SER  53           H        SER  53   9.829  -3.738  -3.414
  232    HA   SER  53           HA       SER  53  10.426  -6.196  -2.194
  233   1HB   SER  53          1HB       SER  53  11.851  -4.855  -4.521
  234   2HB   SER  53          2HB       SER  53  11.874  -6.588  -4.136
  235    HG   SER  53           HG       SER  53  10.308  -6.091  -5.734
  236    H    LYS  54           H        LYS  54  11.983  -3.294  -1.437
  237    HA   LYS  54           HA       LYS  54  14.213  -4.743  -0.105
  238   1HB   LYS  54          1HB       LYS  54  15.802  -3.010  -0.745
  239   2HB   LYS  54          2HB       LYS  54  15.118  -3.799  -2.162
  240   1HG   LYS  54          1HG       LYS  54  13.633  -1.875  -2.573
  241   2HG   LYS  54          2HG       LYS  54  14.166  -1.108  -1.071
  242   1HD   LYS  54          1HD       LYS  54  15.272  -0.035  -2.903
  243   2HD   LYS  54          2HD       LYS  54  16.480  -0.955  -1.991
  244   1HE   LYS  54          1HE       LYS  54  16.340  -2.788  -3.680
  245   2HE   LYS  54          2HE       LYS  54  15.115  -1.872  -4.570
  246   1HZ   LYS  54          2HZ       LYS  54  16.786  -0.129  -4.930
  247   2HZ   LYS  54          3HZ       LYS  54  17.914  -0.979  -4.109
  248   3HZ   LYS  54          1HZ       LYS  54  17.327  -1.550  -5.519
  249    H    GLN  55           H        GLN  55  11.528  -3.325   0.686
  250    HA   GLN  55           HA       GLN  55  12.638  -2.358   3.228
  251   1HB   GLN  55          1HB       GLN  55  12.603  -0.335   1.677
  252   2HB   GLN  55          2HB       GLN  55  10.845  -0.479   1.639
  253   1HG   GLN  55          1HG       GLN  55  10.902  -0.310   4.204
  254   2HG   GLN  55          2HG       GLN  55  12.626   0.043   4.066
  255   1HE2  GLN  55          1HE2      GLN  55   9.356   1.203   3.416
  256   2HE2  GLN  55          2HE2      GLN  55   9.801   2.880   3.135
  257    H    CYS  56           H        CYS  56   9.554  -2.487   1.374
  258    HA   CYS  56           HA       CYS  56   8.069  -2.969   3.892
  259   1HB   CYS  56          1HB       CYS  56   7.125  -1.999   1.164
  260   2HB   CYS  56          2HB       CYS  56   6.163  -2.080   2.644
  261    H    ARG  57           H        ARG  57   9.181  -4.813   1.359
  262    HA   ARG  57           HA       ARG  57   7.448  -7.108   1.988
  263   1HB   ARG  57          1HB       ARG  57   6.648  -5.527  -0.058
  264   2HB   ARG  57          2HB       ARG  57   7.884  -6.396  -0.934
  265   1HG   ARG  57          1HG       ARG  57   5.625  -7.346  -1.228
  266   2HG   ARG  57          2HG       ARG  57   6.721  -8.529  -0.523
  267   1HD   ARG  57          1HD       ARG  57   4.411  -8.500   0.494
  268   2HD   ARG  57          2HD       ARG  57   5.719  -8.322   1.646
  269    HE   ARG  57           HE       ARG  57   5.151  -6.070   2.044
  270   1HH1  ARG  57          1HH1      ARG  57   3.061  -7.268  -0.530
  271   2HH1  ARG  57          2HH1      ARG  57   2.067  -5.819  -0.444
  272   1HH2  ARG  57          2HH2      ARG  57   3.779  -4.341   2.074
  273   2HH2  ARG  57          1HH2      ARG  57   2.440  -4.282   0.935
  274    H    SER  58           H        SER  58  10.345  -6.278   2.236
  275    HA   SER  58           HA       SER  58  12.164  -7.583   0.611
  276   1HB   SER  58          1HB       SER  58  12.304  -7.349   3.637
  277   2HB   SER  58          2HB       SER  58  13.667  -7.568   2.523
  278    HG   SER  58           HG       SER  58  13.334  -5.347   3.113

  No H/Q in entry =         278
  Start of MODEL    7
    1    H1   GLN  22           H1       GLN  22  -8.062  -0.472  -6.212
    2    H2   GLN  22           H3       GLN  22  -7.098   0.762  -5.746
    3    H3   GLN  22           H2       GLN  22  -7.051   0.226  -7.303
    4    HA   GLN  22           HA       GLN  22  -6.184  -1.915  -6.585
    5   1HB   GLN  22          1HB       GLN  22  -4.618   0.524  -5.636
    6   2HB   GLN  22          2HB       GLN  22  -3.954  -1.105  -5.623
    7   1HG   GLN  22          1HG       GLN  22  -4.920   0.320  -8.147
    8   2HG   GLN  22          2HG       GLN  22  -3.260   0.258  -7.579
    9   1HE2  GLN  22          1HE2      GLN  22  -2.847  -0.747  -9.762
   10   2HE2  GLN  22          2HE2      GLN  22  -3.112  -2.481  -9.899
   11    H    THR  23           H        THR  23  -6.263  -3.437  -5.022
   12    HA   THR  23           HA       THR  23  -7.759  -3.164  -2.752
   13    HB   THR  23           HB       THR  23  -5.482  -5.151  -3.045
   14    HG1  THR  23           HG1      THR  23  -6.981  -6.350  -4.229
   15   1HG2  THR  23          1HG2      THR  23  -8.247  -5.390  -1.765
   16   2HG2  THR  23          2HG2      THR  23  -7.064  -6.700  -1.927
   17   3HG2  THR  23          3HG2      THR  23  -6.700  -5.325  -0.881
   18    H    CYS  24           H        CYS  24  -7.580  -2.627  -0.681
   19    HA   CYS  24           HA       CYS  24  -5.607  -0.978   0.357
   20   1HB   CYS  24          1HB       CYS  24  -8.010  -1.421   1.099
   21   2HB   CYS  24          2HB       CYS  24  -7.404  -2.847   1.941
   22    H    TYR  25           H        TYR  25  -3.976  -1.187   1.906
   23    HA   TYR  25           HA       TYR  25  -2.487  -3.666   2.179
   24   1HB   TYR  25          1HB       TYR  25  -0.973  -2.477   3.398
   25   2HB   TYR  25          2HB       TYR  25  -1.601  -1.232   2.339
   26    HD1  TYR  25           HD1      TYR  25  -0.509  -1.811   5.556
   27    HD2  TYR  25           HD2      TYR  25  -3.890  -0.040   3.540
   28    HE1  TYR  25           HE1      TYR  25  -0.999  -0.440   7.570
   29    HE2  TYR  25           HE2      TYR  25  -4.406   1.271   5.569
   30    HH   TYR  25           HH       TYR  25  -2.413   1.089   8.535
   31    H    ASN  26           H        ASN  26  -5.297  -2.508   3.737
   32    HA   ASN  26           HA       ASN  26  -4.957  -4.355   6.087
   33   1HB   ASN  26          1HB       ASN  26  -4.447  -2.072   6.738
   34   2HB   ASN  26          2HB       ASN  26  -5.884  -1.450   5.934
   35   1HD2  ASN  26          1HD2      ASN  26  -7.943  -1.636   6.979
   36   2HD2  ASN  26          2HD2      ASN  26  -8.035  -2.166   8.653
   37    H    CYS  27           H        CYS  27  -7.377  -2.499   4.178
   38    HA   CYS  27           HA       CYS  27  -9.578  -3.748   5.506
   39   1HB   CYS  27          1HB       CYS  27  -9.517  -1.941   3.059
   40   2HB   CYS  27          2HB       CYS  27 -10.898  -2.240   4.119
   41    H    GLY  28           H        GLY  28  -7.788  -4.962   2.894
   42   1HA   GLY  28          2HA       GLY  28  -9.410  -7.201   2.382
   43   2HA   GLY  28          1HA       GLY  28  -8.120  -6.612   1.328
   44    H    LYS  29           H        LYS  29  -9.385  -4.090   0.701
   45    HA   LYS  29           HA       LYS  29 -11.870  -4.842  -0.793
   46   1HB   LYS  29          1HB       LYS  29 -12.261  -3.618   1.292
   47   2HB   LYS  29          2HB       LYS  29 -11.176  -2.351   0.785
   48   1HG   LYS  29          1HG       LYS  29 -13.446  -1.605   0.491
   49   2HG   LYS  29          2HG       LYS  29 -12.699  -1.758  -1.087
   50   1HD   LYS  29          1HD       LYS  29 -15.020  -2.575  -1.107
   51   2HD   LYS  29          2HD       LYS  29 -13.888  -3.852  -1.516
   52   1HE   LYS  29          1HE       LYS  29 -15.575  -4.776  -0.081
   53   2HE   LYS  29          2HE       LYS  29 -14.052  -4.756   0.804
   54   1HZ   LYS  29          3HZ       LYS  29 -16.235  -2.756   1.114
   55   2HZ   LYS  29          1HZ       LYS  29 -15.910  -3.959   2.162
   56   3HZ   LYS  29          2HZ       LYS  29 -14.838  -2.748   1.965
   57    HA   PRO  30           HA       PRO  30  -9.194  -3.695  -4.281
   58   1HB   PRO  30          2HB       PRO  30 -11.899  -3.784  -5.620
   59   2HB   PRO  30          1HB       PRO  30 -10.315  -4.363  -6.233
   60   1HG   PRO  30          1HG       PRO  30 -12.038  -6.124  -5.139
   61   2HG   PRO  30          2HG       PRO  30 -10.303  -6.190  -4.682
   62   1HD   PRO  30          1HD       PRO  30 -12.612  -4.994  -3.150
   63   2HD   PRO  30          2HD       PRO  30 -11.237  -5.974  -2.556
   64    H    GLY  31           H        GLY  31 -12.150  -1.846  -3.580
   65   1HA   GLY  31          2HA       GLY  31 -12.825   0.298  -4.057
   66   2HA   GLY  31          1HA       GLY  31 -11.607   0.368  -5.329
   67    H    HIS  32           H        HIS  32  -9.319  -0.056  -3.551
   68    HA   HIS  32           HA       HIS  32  -9.342   2.393  -1.860
   69   1HB   HIS  32          1HB       HIS  32  -7.946  -0.242  -1.669
   70   2HB   HIS  32          2HB       HIS  32  -7.078   1.176  -1.099
   71    HD1  HIS  32           HD1      HIS  32 -10.491  -0.535  -0.473
   72    HD2  HIS  32           HD2      HIS  32  -7.625   1.960   1.294
   73    HE1  HIS  32           HE1      HIS  32 -11.264  -0.153   1.948
   74    H    LEU  33           H        LEU  33  -7.486   3.610  -1.671
   75    HA   LEU  33           HA       LEU  33  -5.615   4.044  -3.873
   76   1HB   LEU  33          1HB       LEU  33  -7.887   5.969  -3.142
   77   2HB   LEU  33          2HB       LEU  33  -6.481   6.448  -4.079
   78    HG   LEU  33           HG       LEU  33  -8.559   4.420  -4.990
   79   1HD1  LEU  33          3HD1      LEU  33  -9.420   6.716  -4.875
   80   2HD1  LEU  33          1HD1      LEU  33  -8.043   7.294  -5.839
   81   3HD1  LEU  33          2HD1      LEU  33  -9.233   6.181  -6.553
   82   1HD2  LEU  33          1HD2      LEU  33  -6.196   5.683  -6.461
   83   2HD2  LEU  33          2HD2      LEU  33  -6.343   3.970  -6.009
   84   3HD2  LEU  33          3HD2      LEU  33  -7.451   4.662  -7.199
   85    H    SER  34           H        SER  34  -4.303   6.072  -3.260
   86    HA   SER  34           HA       SER  34  -3.373   6.165  -0.558
   87   1HB   SER  34          1HB       SER  34  -2.285   8.284  -1.338
   88   2HB   SER  34          2HB       SER  34  -1.989   6.886  -2.391
   89    HG   SER  34           HG       SER  34  -2.568   8.784  -3.577
   90    H    SER  35           H        SER  35  -6.171   7.649  -2.011
   91    HA   SER  35           HA       SER  35  -6.607   9.558   0.199
   92   1HB   SER  35          1HB       SER  35  -8.608  10.165  -1.144
   93   2HB   SER  35          2HB       SER  35  -7.092  10.294  -2.051
   94    HG   SER  35           HG       SER  35  -8.762   9.222  -3.238
   95    H    GLN  36           H        GLN  36  -7.196   6.259  -0.225
   96    HA   GLN  36           HA       GLN  36  -9.771   6.274   1.292
   97   1HB   GLN  36          1HB       GLN  36  -9.392   5.064  -1.004
   98   2HB   GLN  36          2HB       GLN  36  -8.494   3.890  -0.050
   99   1HG   GLN  36          1HG       GLN  36 -10.631   2.953  -0.118
  100   2HG   GLN  36          2HG       GLN  36 -10.679   3.782   1.429
  101   1HE2  GLN  36          2HE2      GLN  36 -11.984   3.627  -1.854
  102   2HE2  GLN  36          1HE2      GLN  36 -13.166   4.910  -1.618
  103    H    CYS  37           H        CYS  37  -6.497   4.853   1.285
  104    HA   CYS  37           HA       CYS  37  -6.421   4.882   4.210
  105   1HB   CYS  37          1HB       CYS  37  -6.035   2.353   2.562
  106   2HB   CYS  37          2HB       CYS  37  -5.145   2.585   4.042
  107    H    ARG  38           H        ARG  38  -4.071   4.320   4.897
  108    HA   ARG  38           HA       ARG  38  -2.265   6.230   3.895
  109   1HB   ARG  38          1HB       ARG  38  -1.696   3.650   5.433
  110   2HB   ARG  38          2HB       ARG  38  -0.506   4.889   5.077
  111   1HG   ARG  38          1HG       ARG  38  -0.992   5.575   7.126
  112   2HG   ARG  38          2HG       ARG  38  -2.208   6.528   6.295
  113   1HD   ARG  38          1HD       ARG  38  -2.797   3.778   7.462
  114   2HD   ARG  38          2HD       ARG  38  -2.786   5.212   8.474
  115    HE   ARG  38           HE       ARG  38  -4.539   6.172   6.920
  116   1HH1  ARG  38          1HH2      ARG  38  -4.427   2.694   7.551
  117   2HH1  ARG  38          2HH2      ARG  38  -6.137   2.540   7.234
  118   1HH2  ARG  38          2HH1      ARG  38  -6.715   5.846   6.637
  119   2HH2  ARG  38          1HH1      ARG  38  -7.345   4.226   6.645
  120    H    ALA  39           H        ALA  39  -2.576   2.848   2.848
  121    HA   ALA  39           HA       ALA  39  -1.379   3.537   0.302
  122   1HB   ALA  39          1HB       ALA  39   0.675   3.066   1.622
  123   2HB   ALA  39          2HB       ALA  39  -0.005   1.493   2.112
  124   3HB   ALA  39          3HB       ALA  39   0.415   1.791   0.419
  125    HA   PRO  40           HA       PRO  40  -3.670  -0.318  -0.795
  126   1HB   PRO  40          2HB       PRO  40  -2.599  -0.882  -3.225
  127   2HB   PRO  40          1HB       PRO  40  -3.708   0.499  -2.980
  128   1HG   PRO  40          1HG       PRO  40  -0.675   0.541  -3.053
  129   2HG   PRO  40          2HG       PRO  40  -1.815   1.600  -3.941
  130   1HD   PRO  40          1HD       PRO  40  -0.636   2.323  -1.570
  131   2HD   PRO  40          2HD       PRO  40  -2.280   2.864  -2.019
  132    H    LYS  41           H        LYS  41  -2.949  -2.580  -1.423
  133    HA   LYS  41           HA       LYS  41  -1.234  -3.722   0.446
  134   1HB   LYS  41          1HB       LYS  41  -3.170  -4.699  -0.913
  135   2HB   LYS  41          2HB       LYS  41  -2.006  -4.984  -2.209
  136   1HG   LYS  41          1HG       LYS  41  -0.735  -6.513  -0.743
  137   2HG   LYS  41          2HG       LYS  41  -1.740  -6.057   0.640
  138   1HD   LYS  41          1HD       LYS  41  -2.430  -8.221  -0.162
  139   2HD   LYS  41          2HD       LYS  41  -3.724  -7.056  -0.474
  140   1HE   LYS  41          1HE       LYS  41  -3.022  -6.888  -2.845
  141   2HE   LYS  41          2HE       LYS  41  -1.657  -7.968  -2.532
  142   1HZ   LYS  41          3HZ       LYS  41  -4.518  -8.740  -2.271
  143   2HZ   LYS  41          1HZ       LYS  41  -3.533  -9.168  -3.500
  144   3HZ   LYS  41          2HZ       LYS  41  -3.247  -9.730  -1.998
  145    H    VAL  42           H        VAL  42  -0.154  -2.215  -2.366
  146    HA   VAL  42           HA       VAL  42   2.380  -3.415  -2.892
  147    HB   VAL  42           HB       VAL  42   1.549  -0.482  -2.940
  148   1HG1  VAL  42          3HG1      VAL  42   3.811  -1.915  -4.375
  149   2HG1  VAL  42          1HG1      VAL  42   3.307  -0.237  -4.678
  150   3HG1  VAL  42          2HG1      VAL  42   3.983  -0.675  -3.110
  151   1HG2  VAL  42          3HG2      VAL  42   1.457  -2.592  -5.142
  152   2HG2  VAL  42          1HG2      VAL  42   0.051  -1.818  -4.379
  153   3HG2  VAL  42          2HG2      VAL  42   1.148  -0.857  -5.367
  154    H    CYS  43           H        CYS  43   1.331  -1.246  -0.262
  155    HA   CYS  43           HA       CYS  43   3.931  -1.493   1.140
  156   1HB   CYS  43          1HB       CYS  43   4.009   0.374  -0.569
  157   2HB   CYS  43          2HB       CYS  43   2.719   1.185   0.323
  158    H    PHE  44           H        PHE  44   3.399   0.572   2.915
  159    HA   PHE  44           HA       PHE  44   0.686   0.261   4.079
  160   1HB   PHE  44          1HB       PHE  44   1.455  -0.103   6.287
  161   2HB   PHE  44          2HB       PHE  44   2.257  -1.297   5.289
  162    HD1  PHE  44           HD1      PHE  44   2.677   1.484   7.589
  163    HD2  PHE  44           HD2      PHE  44   4.730  -0.914   4.648
  164    HE1  PHE  44           HE1      PHE  44   4.861   2.242   8.493
  165    HE2  PHE  44           HE2      PHE  44   6.911  -0.146   5.551
  166    HZ   PHE  44           HZ       PHE  44   6.982   1.427   7.474
  167    H    LYS  45           H        LYS  45   3.223   2.274   3.096
  168    HA   LYS  45           HA       LYS  45   2.060   4.745   4.226
  169   1HB   LYS  45          1HB       LYS  45   3.370   3.953   6.109
  170   2HB   LYS  45          2HB       LYS  45   4.749   3.586   5.077
  171   1HG   LYS  45          1HG       LYS  45   5.073   6.030   4.653
  172   2HG   LYS  45          2HG       LYS  45   3.659   6.377   5.648
  173   1HD   LYS  45          1HD       LYS  45   5.739   6.746   6.896
  174   2HD   LYS  45          2HD       LYS  45   4.769   5.473   7.624
  175   1HE   LYS  45          1HE       LYS  45   7.108   4.866   7.695
  176   2HE   LYS  45          2HE       LYS  45   6.236   3.741   6.656
  177   1HZ   LYS  45          1HZ       LYS  45   7.811   6.040   5.616
  178   2HZ   LYS  45          2HZ       LYS  45   8.398   4.524   5.745
  179   3HZ   LYS  45          3HZ       LYS  45   7.173   4.810   4.724
  180    H    CYS  46           H        CYS  46   5.175   3.608   2.887
  181    HA   CYS  46           HA       CYS  46   5.734   6.100   1.700
  182   1HB   CYS  46          1HB       CYS  46   7.465   4.011   0.692
  183   2HB   CYS  46          2HB       CYS  46   7.809   5.323   1.794
  184    H    LYS  47           H        LYS  47   4.596   3.094   0.270
  185    HA   LYS  47           HA       LYS  47   3.974   2.456  -1.842
  186   1HB   LYS  47          1HB       LYS  47   1.969   3.682  -2.538
  187   2HB   LYS  47          2HB       LYS  47   2.044   3.367  -0.811
  188   1HG   LYS  47          1HG       LYS  47   2.771   5.693  -0.394
  189   2HG   LYS  47          2HG       LYS  47   2.689   6.045  -2.123
  190   1HD   LYS  47          1HD       LYS  47   0.304   5.766  -2.133
  191   2HD   LYS  47          2HD       LYS  47   0.291   5.052  -0.511
  192   1HE   LYS  47          1HE       LYS  47   1.287   7.881  -1.065
  193   2HE   LYS  47          2HE       LYS  47  -0.402   7.524  -0.695
  194   1HZ   LYS  47          3HZ       LYS  47   1.852   6.847   1.129
  195   2HZ   LYS  47          1HZ       LYS  47   0.838   8.123   1.311
  196   3HZ   LYS  47          2HZ       LYS  47   0.272   6.588   1.422
  197    H    GLN  48           H        GLN  48   6.488   4.046  -2.137
  198    HA   GLN  48           HA       GLN  48   6.305   5.417  -4.654
  199   1HB   GLN  48          1HB       GLN  48   8.733   4.172  -3.297
  200   2HB   GLN  48          2HB       GLN  48   8.788   5.290  -4.653
  201   1HG   GLN  48          1HG       GLN  48   7.829   5.895  -1.829
  202   2HG   GLN  48          2HG       GLN  48   9.290   6.475  -2.605
  203   1HE2  GLN  48          2HE2      GLN  48   5.983   7.198  -2.011
  204   2HE2  GLN  48          1HE2      GLN  48   5.876   8.570  -3.118
  205    HA   PRO  49           HA       PRO  49   5.804   2.501  -7.708
  206   1HB   PRO  49          2HB       PRO  49   8.298   3.491  -9.108
  207   2HB   PRO  49          1HB       PRO  49   6.676   3.164  -9.799
  208   1HG   PRO  49          1HG       PRO  49   7.376   5.691  -9.177
  209   2HG   PRO  49          2HG       PRO  49   5.749   5.087  -8.721
  210   1HD   PRO  49          1HD       PRO  49   8.201   5.390  -6.988
  211   2HD   PRO  49          2HD       PRO  49   6.492   5.774  -6.636
  212    H    GLY  50           H        GLY  50   9.037   2.097  -6.365
  213   1HA   GLY  50          2HA       GLY  50  10.234   0.050  -7.635
  214   2HA   GLY  50          1HA       GLY  50   8.871  -0.816  -6.932
  215    H    HIS  51           H        HIS  51   9.463   1.397  -4.596
  216    HA   HIS  51           HA       HIS  51  11.921   0.523  -3.413
  217   1HB   HIS  51          1HB       HIS  51  11.350   1.922  -1.635
  218   2HB   HIS  51          2HB       HIS  51  10.596   2.698  -3.015
  219    HD1  HIS  51           HD1      HIS  51   7.711   1.785  -3.165
  220    HD2  HIS  51           HD2      HIS  51   9.898   1.602   0.437
  221    HE1  HIS  51           HE1      HIS  51   6.028   1.368  -1.313
  222    H    PHE  52           H        PHE  52   8.669  -0.739  -3.201
  223    HA   PHE  52           HA       PHE  52   8.644  -1.722  -0.607
  224   1HB   PHE  52          1HB       PHE  52   6.712  -3.141  -1.483
  225   2HB   PHE  52          2HB       PHE  52   6.605  -1.403  -1.645
  226    HD1  PHE  52           HD1      PHE  52   6.539  -0.309  -3.805
  227    HD2  PHE  52           HD2      PHE  52   7.080  -4.581  -3.526
  228    HE1  PHE  52           HE1      PHE  52   6.104  -0.523  -6.229
  229    HE2  PHE  52           HE2      PHE  52   6.666  -4.785  -5.963
  230    HZ   PHE  52           HZ       PHE  52   6.182  -2.755  -7.323
  231    H    SER  53           H        SER  53   9.543  -3.588  -3.543
  232    HA   SER  53           HA       SER  53   9.920  -6.086  -2.275
  233   1HB   SER  53          1HB       SER  53  11.360  -4.980  -4.715
  234   2HB   SER  53          2HB       SER  53  11.202  -6.690  -4.271
  235    HG   SER  53           HG       SER  53   9.629  -6.063  -5.810
  236    H    LYS  54           H        LYS  54  11.746  -3.343  -1.634
  237    HA   LYS  54           HA       LYS  54  14.028  -4.943  -0.553
  238   1HB   LYS  54          1HB       LYS  54  14.221  -2.199  -1.878
  239   2HB   LYS  54          2HB       LYS  54  15.530  -3.080  -1.104
  240   1HG   LYS  54          1HG       LYS  54  16.032  -3.728  -3.191
  241   2HG   LYS  54          2HG       LYS  54  14.868  -4.993  -2.848
  242   1HD   LYS  54          1HD       LYS  54  14.358  -4.191  -5.019
  243   2HD   LYS  54          2HD       LYS  54  13.101  -3.489  -3.992
  244   1HE   LYS  54          1HE       LYS  54  14.362  -1.352  -3.896
  245   2HE   LYS  54          2HE       LYS  54  15.658  -2.069  -4.864
  246   1HZ   LYS  54          1HZ       LYS  54  14.035  -2.355  -6.677
  247   2HZ   LYS  54          2HZ       LYS  54  12.860  -1.639  -5.779
  248   3HZ   LYS  54          3HZ       LYS  54  14.168  -0.784  -6.259
  249    H    GLN  55           H        GLN  55  11.410  -3.464   0.528
  250    HA   GLN  55           HA       GLN  55  12.704  -2.767   3.069
  251   1HB   GLN  55          1HB       GLN  55  12.814  -0.640   1.745
  252   2HB   GLN  55          2HB       GLN  55  11.053  -0.651   1.619
  253   1HG   GLN  55          1HG       GLN  55  10.929  -0.575   4.144
  254   2HG   GLN  55          2HG       GLN  55  12.694  -0.501   4.195
  255   1HE2  GLN  55          1HE2      GLN  55   9.736   1.258   3.369
  256   2HE2  GLN  55          2HE2      GLN  55  10.509   2.834   3.231
  257    H    CYS  56           H        CYS  56   9.523  -2.338   1.435
  258    HA   CYS  56           HA       CYS  56   8.179  -2.827   3.994
  259   1HB   CYS  56          1HB       CYS  56   7.166  -1.760   1.325
  260   2HB   CYS  56          2HB       CYS  56   6.289  -1.748   2.861
  261    H    ARG  57           H        ARG  57   8.679  -4.611   1.109
  262    HA   ARG  57           HA       ARG  57   6.681  -6.688   1.860
  263   1HB   ARG  57          1HB       ARG  57   6.102  -4.790  -0.065
  264   2HB   ARG  57          2HB       ARG  57   6.914  -5.980  -1.052
  265   1HG   ARG  57          1HG       ARG  57   4.869  -6.946  -1.207
  266   2HG   ARG  57          2HG       ARG  57   5.176  -7.592   0.402
  267   1HD   ARG  57          1HD       ARG  57   3.609  -5.106  -0.376
  268   2HD   ARG  57          2HD       ARG  57   2.985  -6.574   0.388
  269    HE   ARG  57           HE       ARG  57   4.971  -5.388   2.091
  270   1HH1  ARG  57          1HH1      ARG  57   1.752  -4.589   0.995
  271   2HH1  ARG  57          2HH1      ARG  57   1.530  -3.429   2.283
  272   1HH2  ARG  57          1HH2      ARG  57   4.576  -4.074   3.731
  273   2HH2  ARG  57          2HH2      ARG  57   2.991  -3.348   3.955
  274    H    SER  58           H        SER  58   9.728  -6.322   1.725
  275    HA   SER  58           HA       SER  58  11.084  -7.825  -0.127
  276   1HB   SER  58          1HB       SER  58  11.624  -7.821   2.860
  277   2HB   SER  58          2HB       SER  58  12.790  -8.137   1.562
  278    HG   SER  58           HG       SER  58  12.854  -5.945   2.337

  No H/Q in entry =         278
  Start of MODEL    8
    1    H1   GLN  22           H2       GLN  22  -7.108   0.613  -5.900
    2    H2   GLN  22           H1       GLN  22  -7.137  -0.012  -7.427
    3    H3   GLN  22           H3       GLN  22  -8.123  -0.618  -6.261
    4    HA   GLN  22           HA       GLN  22  -6.350  -2.142  -6.604
    5   1HB   GLN  22          1HB       GLN  22  -4.025  -1.472  -6.008
    6   2HB   GLN  22          2HB       GLN  22  -4.634  -0.829  -7.527
    7   1HG   GLN  22          1HG       GLN  22  -4.970   1.384  -6.545
    8   2HG   GLN  22          2HG       GLN  22  -4.497   0.804  -4.951
    9   1HE2  GLN  22          1HE2      GLN  22  -3.280   2.896  -6.877
   10   2HE2  GLN  22          2HE2      GLN  22  -1.599   2.388  -6.960
   11    H    THR  23           H        THR  23  -6.264  -3.552  -4.960
   12    HA   THR  23           HA       THR  23  -7.739  -3.150  -2.721
   13    HB   THR  23           HB       THR  23  -5.481  -5.170  -2.901
   14    HG1  THR  23           HG1      THR  23  -6.971  -6.399  -4.056
   15   1HG2  THR  23          3HG2      THR  23  -8.262  -5.328  -1.645
   16   2HG2  THR  23          1HG2      THR  23  -7.093  -6.659  -1.746
   17   3HG2  THR  23          2HG2      THR  23  -6.723  -5.251  -0.749
   18    H    CYS  24           H        CYS  24  -7.586  -2.579  -0.665
   19    HA   CYS  24           HA       CYS  24  -5.621  -0.917   0.392
   20   1HB   CYS  24          1HB       CYS  24  -8.055  -1.328   1.068
   21   2HB   CYS  24          2HB       CYS  24  -7.485  -2.741   1.955
   22    H    TYR  25           H        TYR  25  -4.035  -1.125   1.988
   23    HA   TYR  25           HA       TYR  25  -2.619  -3.636   2.373
   24   1HB   TYR  25          1HB       TYR  25  -1.096  -2.450   3.583
   25   2HB   TYR  25          2HB       TYR  25  -1.669  -1.221   2.477
   26    HD1  TYR  25           HD1      TYR  25  -0.609  -1.675   5.700
   27    HD2  TYR  25           HD2      TYR  25  -3.998   0.010   3.622
   28    HE1  TYR  25           HE1      TYR  25  -1.096  -0.221   7.658
   29    HE2  TYR  25           HE2      TYR  25  -4.505   1.407   5.591
   30    HH   TYR  25           HH       TYR  25  -2.507   1.347   8.560
   31    H    ASN  26           H        ASN  26  -5.445  -2.385   3.808
   32    HA   ASN  26           HA       ASN  26  -5.194  -4.157   6.228
   33   1HB   ASN  26          1HB       ASN  26  -4.692  -1.858   6.823
   34   2HB   ASN  26          2HB       ASN  26  -6.098  -1.254   5.951
   35   1HD2  ASN  26          1HD2      ASN  26  -8.194  -1.400   6.933
   36   2HD2  ASN  26          2HD2      ASN  26  -8.345  -1.876   8.617
   37    H    CYS  27           H        CYS  27  -7.545  -2.345   4.192
   38    HA   CYS  27           HA       CYS  27  -9.789  -3.531   5.498
   39   1HB   CYS  27          1HB       CYS  27  -9.639  -1.833   2.977
   40   2HB   CYS  27          2HB       CYS  27 -11.060  -2.085   3.997
   41    H    GLY  28           H        GLY  28  -7.937  -4.853   2.974
   42   1HA   GLY  28          2HA       GLY  28  -9.558  -7.106   2.491
   43   2HA   GLY  28          1HA       GLY  28  -8.244  -6.549   1.449
   44    H    LYS  29           H        LYS  29  -9.480  -4.033   0.745
   45    HA   LYS  29           HA       LYS  29 -11.953  -4.791  -0.763
   46   1HB   LYS  29          1HB       LYS  29 -12.332  -3.493   1.292
   47   2HB   LYS  29          2HB       LYS  29 -11.237  -2.255   0.732
   48   1HG   LYS  29          1HG       LYS  29 -13.493  -1.495   0.401
   49   2HG   LYS  29          2HG       LYS  29 -12.758  -1.741  -1.171
   50   1HD   LYS  29          1HD       LYS  29 -15.087  -2.528  -1.138
   51   2HD   LYS  29          2HD       LYS  29 -13.977  -3.844  -1.475
   52   1HE   LYS  29          1HE       LYS  29 -15.672  -4.653   0.018
   53   2HE   LYS  29          2HE       LYS  29 -14.147  -4.607   0.896
   54   1HZ   LYS  29          2HZ       LYS  29 -16.297  -2.557   1.092
   55   2HZ   LYS  29          3HZ       LYS  29 -15.986  -3.700   2.209
   56   3HZ   LYS  29          1HZ       LYS  29 -14.897  -2.519   1.937
   57    HA   PRO  30           HA       PRO  30  -9.225  -3.752  -4.242
   58   1HB   PRO  30          2HB       PRO  30 -11.911  -3.832  -5.625
   59   2HB   PRO  30          1HB       PRO  30 -10.330  -4.458  -6.193
   60   1HG   PRO  30          1HG       PRO  30 -12.117  -6.151  -5.090
   61   2HG   PRO  30          2HG       PRO  30 -10.391  -6.250  -4.605
   62   1HD   PRO  30          1HD       PRO  30 -12.691  -4.960  -3.136
   63   2HD   PRO  30          2HD       PRO  30 -11.353  -5.965  -2.500
   64    H    GLY  31           H        GLY  31 -12.163  -1.861  -3.592
   65   1HA   GLY  31          2HA       GLY  31 -12.822   0.277  -4.108
   66   2HA   GLY  31          1HA       GLY  31 -11.611   0.309  -5.387
   67    H    HIS  32           H        HIS  32  -9.275  -0.012  -3.780
   68    HA   HIS  32           HA       HIS  32  -9.262   2.425  -2.059
   69   1HB   HIS  32          1HB       HIS  32  -7.960  -0.255  -1.815
   70   2HB   HIS  32          2HB       HIS  32  -7.048   1.141  -1.254
   71    HD1  HIS  32           HD1      HIS  32 -10.499  -0.482  -0.610
   72    HD2  HIS  32           HD2      HIS  32  -7.602   2.013   1.105
   73    HE1  HIS  32           HE1      HIS  32 -11.284  -0.013   1.791
   74    H    LEU  33           H        LEU  33  -7.403   3.609  -1.878
   75    HA   LEU  33           HA       LEU  33  -5.461   3.943  -4.031
   76   1HB   LEU  33          1HB       LEU  33  -7.734   5.920  -3.463
   77   2HB   LEU  33          2HB       LEU  33  -6.291   6.345  -4.368
   78    HG   LEU  33           HG       LEU  33  -8.369   4.314  -5.269
   79   1HD1  LEU  33          1HD1      LEU  33  -9.182   6.631  -5.286
   80   2HD1  LEU  33          2HD1      LEU  33  -7.758   7.136  -6.222
   81   3HD1  LEU  33          3HD1      LEU  33  -8.947   6.018  -6.930
   82   1HD2  LEU  33          1HD2      LEU  33  -5.923   5.463  -6.701
   83   2HD2  LEU  33          2HD2      LEU  33  -6.129   3.774  -6.182
   84   3HD2  LEU  33          3HD2      LEU  33  -7.172   4.437  -7.442
   85    H    SER  34           H        SER  34  -4.105   5.930  -3.454
   86    HA   SER  34           HA       SER  34  -3.208   6.166  -0.804
   87   1HB   SER  34          1HB       SER  34  -3.197   8.260  -3.015
   88   2HB   SER  34          2HB       SER  34  -2.134   8.240  -1.598
   89    HG   SER  34           HG       SER  34  -1.228   7.313  -3.575
   90    H    SER  35           H        SER  35  -6.096   7.566  -2.161
   91    HA   SER  35           HA       SER  35  -6.460   9.532   0.023
   92   1HB   SER  35          1HB       SER  35  -8.438  10.189  -1.349
   93   2HB   SER  35          2HB       SER  35  -6.902  10.294  -2.223
   94    HG   SER  35           HG       SER  35  -8.561   9.257  -3.453
   95    H    GLN  36           H        GLN  36  -7.160   6.252  -0.424
   96    HA   GLN  36           HA       GLN  36  -9.764   6.351   1.032
   97   1HB   GLN  36          1HB       GLN  36  -9.362   5.092  -1.215
   98   2HB   GLN  36          2HB       GLN  36  -8.469   3.933  -0.239
   99   1HG   GLN  36          1HG       GLN  36 -10.612   2.998  -0.338
  100   2HG   GLN  36          2HG       GLN  36 -10.660   3.810   1.217
  101   1HE2  GLN  36          2HE2      GLN  36 -12.020   3.623  -2.011
  102   2HE2  GLN  36          1HE2      GLN  36 -13.181   4.932  -1.791
  103    H    CYS  37           H        CYS  37  -6.508   4.903   1.190
  104    HA   CYS  37           HA       CYS  37  -6.562   4.992   4.110
  105   1HB   CYS  37          1HB       CYS  37  -6.180   2.414   2.548
  106   2HB   CYS  37          2HB       CYS  37  -5.299   2.661   4.029
  107    H    ARG  38           H        ARG  38  -4.265   4.405   4.924
  108    HA   ARG  38           HA       ARG  38  -2.370   6.254   3.965
  109   1HB   ARG  38          1HB       ARG  38  -1.983   3.730   5.643
  110   2HB   ARG  38          2HB       ARG  38  -0.705   4.871   5.272
  111   1HG   ARG  38          1HG       ARG  38  -1.224   5.766   7.220
  112   2HG   ARG  38          2HG       ARG  38  -2.412   6.668   6.299
  113   1HD   ARG  38          1HD       ARG  38  -3.031   4.036   7.714
  114   2HD   ARG  38          2HD       ARG  38  -3.073   5.577   8.549
  115    HE   ARG  38           HE       ARG  38  -4.811   6.347   6.952
  116   1HH1  ARG  38          2HH1      ARG  38  -4.574   2.868   7.536
  117   2HH1  ARG  38          1HH1      ARG  38  -6.255   2.643   7.117
  118   1HH2  ARG  38          2HH2      ARG  38  -6.947   5.922   6.520
  119   2HH2  ARG  38          1HH2      ARG  38  -7.477   4.268   6.417
  120    H    ALA  39           H        ALA  39  -2.710   2.854   2.970
  121    HA   ALA  39           HA       ALA  39  -1.381   3.502   0.484
  122   1HB   ALA  39          3HB       ALA  39   0.605   3.000   1.899
  123   2HB   ALA  39          1HB       ALA  39  -0.126   1.441   2.360
  124   3HB   ALA  39          2HB       ALA  39   0.383   1.726   0.692
  125    HA   PRO  40           HA       PRO  40  -3.627  -0.323  -0.750
  126   1HB   PRO  40          2HB       PRO  40  -2.429  -0.888  -3.113
  127   2HB   PRO  40          1HB       PRO  40  -3.521   0.517  -2.916
  128   1HG   PRO  40          1HG       PRO  40  -0.484   0.501  -2.803
  129   2HG   PRO  40          2HG       PRO  40  -1.543   1.583  -3.762
  130   1HD   PRO  40          1HD       PRO  40  -0.522   2.286  -1.324
  131   2HD   PRO  40          2HD       PRO  40  -2.125   2.845  -1.878
  132    H    LYS  41           H        LYS  41  -2.949  -2.594  -1.253
  133    HA   LYS  41           HA       LYS  41  -1.341  -3.712   0.715
  134   1HB   LYS  41          1HB       LYS  41  -3.212  -4.728  -0.674
  135   2HB   LYS  41          2HB       LYS  41  -2.026  -5.021  -1.946
  136   1HG   LYS  41          1HG       LYS  41  -0.752  -6.501  -0.433
  137   2HG   LYS  41          2HG       LYS  41  -1.844  -6.097   0.909
  138   1HD   LYS  41          1HD       LYS  41  -3.737  -7.117  -0.325
  139   2HD   LYS  41          2HD       LYS  41  -2.650  -7.500  -1.680
  140   1HE   LYS  41          1HE       LYS  41  -1.258  -8.893  -0.154
  141   2HE   LYS  41          2HE       LYS  41  -2.352  -8.523   1.183
  142   1HZ   LYS  41          2HZ       LYS  41  -3.122  -9.976  -1.295
  143   2HZ   LYS  41          3HZ       LYS  41  -2.888 -10.662   0.166
  144   3HZ   LYS  41          1HZ       LYS  41  -4.136  -9.637  -0.056
  145    H    VAL  42           H        VAL  42  -0.146  -2.485  -2.249
  146    HA   VAL  42           HA       VAL  42   2.356  -3.753  -2.593
  147    HB   VAL  42           HB       VAL  42   1.651  -0.802  -2.900
  148   1HG1  VAL  42          3HG1      VAL  42   3.848  -2.459  -4.202
  149   2HG1  VAL  42          1HG1      VAL  42   3.407  -0.801  -4.666
  150   3HG1  VAL  42          2HG1      VAL  42   4.073  -1.109  -3.065
  151   1HG2  VAL  42          1HG2      VAL  42   1.439  -3.095  -4.902
  152   2HG2  VAL  42          2HG2      VAL  42   0.083  -2.174  -4.212
  153   3HG2  VAL  42          3HG2      VAL  42   1.223  -1.373  -5.285
  154    H    CYS  43           H        CYS  43   1.340  -1.456  -0.104
  155    HA   CYS  43           HA       CYS  43   3.938  -1.613   1.310
  156   1HB   CYS  43          1HB       CYS  43   3.962   0.204  -0.460
  157   2HB   CYS  43          2HB       CYS  43   2.651   1.004   0.417
  158    H    PHE  44           H        PHE  44   3.332   0.514   2.992
  159    HA   PHE  44           HA       PHE  44   0.668   0.119   4.231
  160   1HB   PHE  44          1HB       PHE  44   1.489  -0.139   6.421
  161   2HB   PHE  44          2HB       PHE  44   2.383  -1.297   5.454
  162    HD1  PHE  44           HD1      PHE  44   2.579   1.589   7.656
  163    HD2  PHE  44           HD2      PHE  44   4.808  -0.715   4.768
  164    HE1  PHE  44           HE1      PHE  44   4.689   2.616   8.462
  165    HE2  PHE  44           HE2      PHE  44   6.914   0.320   5.575
  166    HZ   PHE  44           HZ       PHE  44   6.860   1.991   7.417
  167    H    LYS  45           H        LYS  45   3.322   2.238   3.395
  168    HA   LYS  45           HA       LYS  45   1.716   4.615   4.067
  169   1HB   LYS  45          1HB       LYS  45   2.855   4.023   6.203
  170   2HB   LYS  45          2HB       LYS  45   4.423   4.141   5.402
  171   1HG   LYS  45          1HG       LYS  45   4.006   6.555   4.961
  172   2HG   LYS  45          2HG       LYS  45   2.401   6.411   5.707
  173   1HD   LYS  45          1HD       LYS  45   3.472   5.750   7.857
  174   2HD   LYS  45          2HD       LYS  45   5.074   5.909   7.100
  175   1HE   LYS  45          1HE       LYS  45   4.611   8.307   6.635
  176   2HE   LYS  45          2HE       LYS  45   3.016   8.148   7.382
  177   1HZ   LYS  45          2HZ       LYS  45   4.130   7.595   9.482
  178   2HZ   LYS  45          3HZ       LYS  45   5.604   7.749   8.791
  179   3HZ   LYS  45          1HZ       LYS  45   4.634   9.052   8.948
  180    H    CYS  46           H        CYS  46   5.127   3.748   3.185
  181    HA   CYS  46           HA       CYS  46   5.513   6.219   1.834
  182   1HB   CYS  46          1HB       CYS  46   7.706   4.933   1.146
  183   2HB   CYS  46          2HB       CYS  46   7.415   5.489   2.790
  184    H    LYS  47           H        LYS  47   4.680   3.051   0.561
  185    HA   LYS  47           HA       LYS  47   4.113   2.299  -1.530
  186   1HB   LYS  47          1HB       LYS  47   2.016   3.299  -2.191
  187   2HB   LYS  47          2HB       LYS  47   2.168   3.182  -0.444
  188   1HG   LYS  47          1HG       LYS  47   2.764   5.601  -0.334
  189   2HG   LYS  47          2HG       LYS  47   2.546   5.731  -2.082
  190   1HD   LYS  47          1HD       LYS  47   0.203   5.223  -1.901
  191   2HD   LYS  47          2HD       LYS  47   0.354   4.741  -0.205
  192   1HE   LYS  47          1HE       LYS  47   1.023   7.548  -1.161
  193   2HE   LYS  47          2HE       LYS  47  -0.611   7.074  -0.684
  194   1HZ   LYS  47          2HZ       LYS  47   1.735   6.804   1.126
  195   2HZ   LYS  47          3HZ       LYS  47   0.662   8.048   1.178
  196   3HZ   LYS  47          1HZ       LYS  47   0.183   6.511   1.499
  197    H    GLN  48           H        GLN  48   6.517   4.012  -1.975
  198    HA   GLN  48           HA       GLN  48   6.163   5.344  -4.486
  199   1HB   GLN  48          1HB       GLN  48   8.685   4.170  -3.248
  200   2HB   GLN  48          2HB       GLN  48   8.654   5.277  -4.614
  201   1HG   GLN  48          1HG       GLN  48   7.805   5.883  -1.755
  202   2HG   GLN  48          2HG       GLN  48   9.215   6.493  -2.601
  203   1HE2  GLN  48          2HE2      GLN  48   5.908   7.117  -1.880
  204   2HE2  GLN  48          1HE2      GLN  48   5.716   8.484  -2.986
  205    HA   PRO  49           HA       PRO  49   5.637   2.444  -7.558
  206   1HB   PRO  49          2HB       PRO  49   8.066   3.498  -9.022
  207   2HB   PRO  49          1HB       PRO  49   6.433   3.137  -9.669
  208   1HG   PRO  49          1HG       PRO  49   7.094   5.677  -9.054
  209   2HG   PRO  49          2HG       PRO  49   5.495   5.032  -8.553
  210   1HD   PRO  49          1HD       PRO  49   7.990   5.382  -6.892
  211   2HD   PRO  49          2HD       PRO  49   6.285   5.727  -6.484
  212    H    GLY  50           H        GLY  50   8.936   2.141  -6.344
  213   1HA   GLY  50          2HA       GLY  50  10.183   0.151  -7.597
  214   2HA   GLY  50          1HA       GLY  50   8.845  -0.782  -6.932
  215    H    HIS  51           H        HIS  51   9.469   1.506  -4.601
  216    HA   HIS  51           HA       HIS  51  11.891   0.657  -3.399
  217   1HB   HIS  51          1HB       HIS  51  11.271   2.004  -1.594
  218   2HB   HIS  51          2HB       HIS  51  10.482   2.773  -2.960
  219    HD1  HIS  51           HD1      HIS  51   7.643   1.727  -3.130
  220    HD2  HIS  51           HD2      HIS  51   9.844   1.490   0.458
  221    HE1  HIS  51           HE1      HIS  51   5.999   1.077  -1.313
  222    H    PHE  52           H        PHE  52   8.679  -0.755  -3.191
  223    HA   PHE  52           HA       PHE  52   8.824  -1.915  -0.652
  224   1HB   PHE  52          1HB       PHE  52   6.933  -3.341  -1.433
  225   2HB   PHE  52          2HB       PHE  52   6.726  -1.622  -1.677
  226    HD1  PHE  52           HD1      PHE  52   7.169  -4.876  -3.372
  227    HD2  PHE  52           HD2      PHE  52   6.666  -0.624  -3.931
  228    HE1  PHE  52           HE1      PHE  52   6.651  -5.246  -5.768
  229    HE2  PHE  52           HE2      PHE  52   6.142  -1.006  -6.320
  230    HZ   PHE  52           HZ       PHE  52   6.141  -3.311  -7.249
  231    H    SER  53           H        SER  53   9.767  -3.399  -3.775
  232    HA   SER  53           HA       SER  53  10.437  -5.967  -2.880
  233   1HB   SER  53          1HB       SER  53  11.778  -4.336  -5.067
  234   2HB   SER  53          2HB       SER  53  11.818  -6.104  -4.901
  235    HG   SER  53           HG       SER  53  10.200  -5.415  -6.377
  236    H    LYS  54           H        LYS  54  12.012  -3.142  -1.861
  237    HA   LYS  54           HA       LYS  54  14.247  -4.730  -0.717
  238   1HB   LYS  54          1HB       LYS  54  15.860  -2.977  -1.235
  239   2HB   LYS  54          2HB       LYS  54  15.140  -3.637  -2.699
  240   1HG   LYS  54          1HG       LYS  54  13.693  -1.660  -2.943
  241   2HG   LYS  54          2HG       LYS  54  14.247  -1.027  -1.387
  242   1HD   LYS  54          1HD       LYS  54  15.363   0.166  -3.148
  243   2HD   LYS  54          2HD       LYS  54  16.553  -0.827  -2.293
  244   1HE   LYS  54          1HE       LYS  54  16.398  -2.544  -4.104
  245   2HE   LYS  54          2HE       LYS  54  15.206  -1.544  -4.942
  246   1HZ   LYS  54          3HZ       LYS  54  16.917   0.187  -5.155
  247   2HZ   LYS  54          1HZ       LYS  54  18.015  -0.745  -4.382
  248   3HZ   LYS  54          2HZ       LYS  54  17.438  -1.201  -5.837
  249    H    GLN  55           H        GLN  55  11.615  -3.404   0.276
  250    HA   GLN  55           HA       GLN  55  12.804  -2.633   2.846
  251   1HB   GLN  55          1HB       GLN  55  12.686  -0.484   1.495
  252   2HB   GLN  55          2HB       GLN  55  10.930  -0.662   1.475
  253   1HG   GLN  55          1HG       GLN  55  11.025  -0.707   4.040
  254   2HG   GLN  55          2HG       GLN  55  12.743  -0.323   3.912
  255   1HE2  GLN  55          1HE2      GLN  55   9.455   0.865   3.474
  256   2HE2  GLN  55          2HE2      GLN  55   9.885   2.560   3.292
  257    H    CYS  56           H        CYS  56   9.637  -2.598   1.132
  258    HA   CYS  56           HA       CYS  56   8.280  -3.383   3.643
  259   1HB   CYS  56          1HB       CYS  56   7.208  -2.156   1.069
  260   2HB   CYS  56          2HB       CYS  56   6.301  -2.423   2.560
  261    H    ARG  57           H        ARG  57   9.305  -4.939   0.885
  262    HA   ARG  57           HA       ARG  57   7.631  -7.318   1.334
  263   1HB   ARG  57          1HB       ARG  57   6.698  -5.531  -0.463
  264   2HB   ARG  57          2HB       ARG  57   7.905  -6.255  -1.501
  265   1HG   ARG  57          1HG       ARG  57   5.636  -7.203  -1.790
  266   2HG   ARG  57          2HG       ARG  57   6.798  -8.441  -1.325
  267   1HD   ARG  57          1HD       ARG  57   4.556  -8.611  -0.177
  268   2HD   ARG  57          2HD       ARG  57   5.932  -8.567   0.904
  269    HE   ARG  57           HE       ARG  57   5.388  -6.373   1.618
  270   1HH1  ARG  57          2HH1      ARG  57   3.026  -7.373  -0.802
  271   2HH1  ARG  57          1HH1      ARG  57   1.979  -6.022  -0.380
  272   1HH2  ARG  57          1HH2      ARG  57   3.962  -4.755   2.049
  273   2HH2  ARG  57          2HH2      ARG  57   2.472  -4.644   1.123
  274    H    SER  58           H        SER  58  10.520  -6.489   1.548
  275    HA   SER  58           HA       SER  58  12.280  -7.552  -0.299
  276   1HB   SER  58          1HB       SER  58  12.545  -7.707   2.721
  277   2HB   SER  58          2HB       SER  58  13.863  -7.757   1.535
  278    HG   SER  58           HG       SER  58  13.521  -5.637   2.428

  No H/Q in entry =         278
  Start of MODEL    9
    1    H1   GLN  22           H2       GLN  22  -8.076  -0.576  -6.236
    2    H2   GLN  22           H1       GLN  22  -7.141   0.674  -5.749
    3    H3   GLN  22           H3       GLN  22  -7.049   0.134  -7.304
    4    HA   GLN  22           HA       GLN  22  -6.150  -1.985  -6.573
    5   1HB   GLN  22          1HB       GLN  22  -4.651   0.444  -5.488
    6   2HB   GLN  22          2HB       GLN  22  -3.981  -1.190  -5.577
    7   1HG   GLN  22          1HG       GLN  22  -4.335  -1.189  -8.048
    8   2HG   GLN  22          2HG       GLN  22  -4.853   0.500  -7.962
    9   1HE2  GLN  22          2HE2      GLN  22  -2.461  -0.705  -9.353
   10   2HE2  GLN  22          1HE2      GLN  22  -1.095   0.161  -8.659
   11    H    THR  23           H        THR  23  -6.280  -3.523  -4.992
   12    HA   THR  23           HA       THR  23  -7.793  -3.234  -2.725
   13    HB   THR  23           HB       THR  23  -5.516  -5.223  -3.008
   14    HG1  THR  23           HG1      THR  23  -7.020  -6.434  -4.168
   15   1HG2  THR  23          3HG2      THR  23  -8.268  -5.446  -1.696
   16   2HG2  THR  23          1HG2      THR  23  -7.087  -6.761  -1.860
   17   3HG2  THR  23          2HG2      THR  23  -6.710  -5.375  -0.834
   18    H    CYS  24           H        CYS  24  -7.605  -2.691  -0.651
   19    HA   CYS  24           HA       CYS  24  -5.626  -1.017   0.349
   20   1HB   CYS  24          1HB       CYS  24  -8.026  -1.443   1.105
   21   2HB   CYS  24          2HB       CYS  24  -7.421  -2.860   1.967
   22    H    TYR  25           H        TYR  25  -3.981  -1.205   1.884
   23    HA   TYR  25           HA       TYR  25  -2.491  -3.677   2.196
   24   1HB   TYR  25          1HB       TYR  25  -0.981  -2.468   3.414
   25   2HB   TYR  25          2HB       TYR  25  -1.595  -1.253   2.315
   26    HD1  TYR  25           HD1      TYR  25  -0.481  -1.666   5.524
   27    HD2  TYR  25           HD2      TYR  25  -3.948  -0.093   3.493
   28    HE1  TYR  25           HE1      TYR  25  -0.974  -0.209   7.478
   29    HE2  TYR  25           HE2      TYR  25  -4.482   1.272   5.474
   30    HH   TYR  25           HH       TYR  25  -2.422   1.334   8.391
   31    H    ASN  26           H        ASN  26  -5.302  -2.504   3.742
   32    HA   ASN  26           HA       ASN  26  -4.951  -4.312   6.120
   33   1HB   ASN  26          1HB       ASN  26  -4.430  -2.019   6.731
   34   2HB   ASN  26          2HB       ASN  26  -5.874  -1.408   5.931
   35   1HD2  ASN  26          2HD2      ASN  26  -7.922  -1.569   6.999
   36   2HD2  ASN  26          1HD2      ASN  26  -8.000  -2.078   8.680
   37    H    CYS  27           H        CYS  27  -7.378  -2.472   4.206
   38    HA   CYS  27           HA       CYS  27  -9.574  -3.689   5.571
   39   1HB   CYS  27          1HB       CYS  27  -9.522  -1.919   3.098
   40   2HB   CYS  27          2HB       CYS  27 -10.899  -2.196   4.173
   41    H    GLY  28           H        GLY  28  -7.816  -4.950   2.959
   42   1HA   GLY  28          2HA       GLY  28  -9.465  -7.182   2.483
   43   2HA   GLY  28          1HA       GLY  28  -8.173  -6.620   1.418
   44    H    LYS  29           H        LYS  29  -9.417  -4.085   0.779
   45    HA   LYS  29           HA       LYS  29 -11.920  -4.822  -0.691
   46   1HB   LYS  29          1HB       LYS  29 -12.270  -3.546   1.376
   47   2HB   LYS  29          2HB       LYS  29 -11.164  -2.314   0.830
   48   1HG   LYS  29          1HG       LYS  29 -13.395  -1.501   0.522
   49   2HG   LYS  29          2HG       LYS  29 -12.699  -1.765  -1.068
   50   1HD   LYS  29          1HD       LYS  29 -15.016  -2.487  -1.030
   51   2HD   LYS  29          2HD       LYS  29 -13.981  -3.897  -1.275
   52   1HE   LYS  29          1HE       LYS  29 -14.192  -4.483   1.129
   53   2HE   LYS  29          2HE       LYS  29 -15.151  -3.025   1.410
   54   1HZ   LYS  29          1HZ       LYS  29 -16.849  -3.932  -0.083
   55   2HZ   LYS  29          2HZ       LYS  29 -15.961  -5.280  -0.353
   56   3HZ   LYS  29          3HZ       LYS  29 -16.563  -4.980   1.133
   57    HA   PRO  30           HA       PRO  30  -9.267  -3.766  -4.226
   58   1HB   PRO  30          2HB       PRO  30 -11.984  -3.804  -5.542
   59   2HB   PRO  30          1HB       PRO  30 -10.424  -4.441  -6.154
   60   1HG   PRO  30          1HG       PRO  30 -12.199  -6.126  -5.025
   61   2HG   PRO  30          2HG       PRO  30 -10.463  -6.246  -4.582
   62   1HD   PRO  30          1HD       PRO  30 -12.717  -4.948  -3.046
   63   2HD   PRO  30          2HD       PRO  30 -11.374  -5.973  -2.453
   64    H    GLY  31           H        GLY  31 -12.184  -1.861  -3.517
   65   1HA   GLY  31          2HA       GLY  31 -12.842   0.281  -4.028
   66   2HA   GLY  31          1HA       GLY  31 -11.626   0.320  -5.302
   67    H    HIS  32           H        HIS  32  -9.340  -0.105  -3.512
   68    HA   HIS  32           HA       HIS  32  -9.339   2.370  -1.862
   69   1HB   HIS  32          1HB       HIS  32  -7.961  -0.269  -1.638
   70   2HB   HIS  32          2HB       HIS  32  -7.075   1.152  -1.099
   71    HD1  HIS  32           HD1      HIS  32 -10.504  -0.513  -0.416
   72    HD2  HIS  32           HD2      HIS  32  -7.592   1.973   1.279
   73    HE1  HIS  32           HE1      HIS  32 -11.240  -0.095   2.011
   74    H    LEU  33           H        LEU  33  -7.476   3.596  -1.713
   75    HA   LEU  33           HA       LEU  33  -5.680   4.021  -3.984
   76   1HB   LEU  33          1HB       LEU  33  -7.951   5.929  -3.204
   77   2HB   LEU  33          2HB       LEU  33  -6.591   6.403  -4.208
   78    HG   LEU  33           HG       LEU  33  -8.672   4.324  -4.990
   79   1HD1  LEU  33          3HD1      LEU  33  -9.573   6.606  -4.882
   80   2HD1  LEU  33          1HD1      LEU  33  -8.248   7.191  -5.912
   81   3HD1  LEU  33          2HD1      LEU  33  -9.443   6.041  -6.555
   82   1HD2  LEU  33          3HD2      LEU  33  -6.400   5.604  -6.586
   83   2HD2  LEU  33          1HD2      LEU  33  -6.489   3.898  -6.092
   84   3HD2  LEU  33          2HD2      LEU  33  -7.662   4.540  -7.247
   85    H    SER  34           H        SER  34  -4.327   6.002  -3.470
   86    HA   SER  34           HA       SER  34  -3.201   6.169  -0.912
   87   1HB   SER  34          1HB       SER  34  -3.377   8.297  -3.083
   88   2HB   SER  34          2HB       SER  34  -2.206   8.279  -1.754
   89    HG   SER  34           HG       SER  34  -1.450   7.360  -3.795
   90    H    SER  35           H        SER  35  -6.239   7.517  -1.847
   91    HA   SER  35           HA       SER  35  -6.349   9.366   0.490
   92   1HB   SER  35          1HB       SER  35  -8.325  10.292  -0.702
   93   2HB   SER  35          2HB       SER  35  -6.828  10.394  -1.646
   94    HG   SER  35           HG       SER  35  -8.612   9.603  -2.888
   95    H    GLN  36           H        GLN  36  -7.287   6.210  -0.337
   96    HA   GLN  36           HA       GLN  36  -9.795   6.235   1.263
   97   1HB   GLN  36          1HB       GLN  36  -9.422   5.024  -1.033
   98   2HB   GLN  36          2HB       GLN  36  -8.520   3.849  -0.085
   99   1HG   GLN  36          1HG       GLN  36 -10.663   2.913  -0.155
  100   2HG   GLN  36          2HG       GLN  36 -10.704   3.731   1.398
  101   1HE2  GLN  36          2HE2      GLN  36 -12.020   3.603  -1.879
  102   2HE2  GLN  36          1HE2      GLN  36 -13.199   4.885  -1.630
  103    H    CYS  37           H        CYS  37  -6.507   4.886   1.267
  104    HA   CYS  37           HA       CYS  37  -6.448   4.885   4.184
  105   1HB   CYS  37          1HB       CYS  37  -6.044   2.372   2.531
  106   2HB   CYS  37          2HB       CYS  37  -5.058   2.621   3.937
  107    H    ARG  38           H        ARG  38  -4.076   4.363   4.866
  108    HA   ARG  38           HA       ARG  38  -2.287   6.297   3.825
  109   1HB   ARG  38          1HB       ARG  38  -1.742   3.773   5.456
  110   2HB   ARG  38          2HB       ARG  38  -0.521   4.957   5.026
  111   1HG   ARG  38          1HG       ARG  38  -0.945   5.777   7.027
  112   2HG   ARG  38          2HG       ARG  38  -2.179   6.695   6.186
  113   1HD   ARG  38          1HD       ARG  38  -2.781   4.014   7.508
  114   2HD   ARG  38          2HD       ARG  38  -2.667   5.481   8.459
  115    HE   ARG  38           HE       ARG  38  -4.497   6.471   7.173
  116   1HH1  ARG  38          2HH1      ARG  38  -4.376   2.937   7.181
  117   2HH1  ARG  38          1HH1      ARG  38  -6.029   2.848   6.603
  118   1HH2  ARG  38          1HH2      ARG  38  -6.655   6.190   6.747
  119   2HH2  ARG  38          2HH2      ARG  38  -7.276   4.585   6.474
  120    H    ALA  39           H        ALA  39  -2.610   2.888   2.838
  121    HA   ALA  39           HA       ALA  39  -1.422   3.552   0.281
  122   1HB   ALA  39          3HB       ALA  39   0.638   3.097   1.606
  123   2HB   ALA  39          1HB       ALA  39  -0.038   1.522   2.099
  124   3HB   ALA  39          2HB       ALA  39   0.383   1.817   0.408
  125    HA   PRO  40           HA       PRO  40  -3.679  -0.319  -0.803
  126   1HB   PRO  40          2HB       PRO  40  -2.609  -0.885  -3.232
  127   2HB   PRO  40          1HB       PRO  40  -3.711   0.501  -2.986
  128   1HG   PRO  40          1HG       PRO  40  -0.676   0.530  -3.050
  129   2HG   PRO  40          2HG       PRO  40  -1.808   1.594  -3.944
  130   1HD   PRO  40          1HD       PRO  40  -0.639   2.316  -1.575
  131   2HD   PRO  40          2HD       PRO  40  -2.281   2.857  -2.028
  132    H    LYS  41           H        LYS  41  -2.977  -2.574  -1.441
  133    HA   LYS  41           HA       LYS  41  -1.282  -3.771   0.410
  134   1HB   LYS  41          1HB       LYS  41  -3.219  -4.703  -0.928
  135   2HB   LYS  41          2HB       LYS  41  -2.112  -4.922  -2.285
  136   1HG   LYS  41          1HG       LYS  41  -0.792  -6.525  -0.970
  137   2HG   LYS  41          2HG       LYS  41  -1.767  -6.183   0.477
  138   1HD   LYS  41          1HD       LYS  41  -3.787  -7.026  -0.699
  139   2HD   LYS  41          2HD       LYS  41  -2.814  -7.406  -2.125
  140   1HE   LYS  41          1HE       LYS  41  -2.387  -8.594   0.660
  141   2HE   LYS  41          2HE       LYS  41  -3.336  -9.361  -0.615
  142   1HZ   LYS  41          3HZ       LYS  41  -1.326  -9.435  -1.993
  143   2HZ   LYS  41          1HZ       LYS  41  -0.433  -8.757  -0.799
  144   3HZ   LYS  41          2HZ       LYS  41  -1.091 -10.234  -0.592
  145    H    VAL  42           H        VAL  42  -0.167  -2.243  -2.399
  146    HA   VAL  42           HA       VAL  42   2.347  -3.499  -2.905
  147    HB   VAL  42           HB       VAL  42   1.571  -0.551  -3.000
  148   1HG1  VAL  42          2HG1      VAL  42   3.826  -2.045  -4.393
  149   2HG1  VAL  42          3HG1      VAL  42   3.346  -0.369  -4.735
  150   3HG1  VAL  42          1HG1      VAL  42   4.003  -0.782  -3.154
  151   1HG2  VAL  42          2HG2      VAL  42   1.456  -2.693  -5.171
  152   2HG2  VAL  42          3HG2      VAL  42   0.060  -1.883  -4.428
  153   3HG2  VAL  42          1HG2      VAL  42   1.179  -0.956  -5.424
  154    H    CYS  43           H        CYS  43   1.311  -1.320  -0.287
  155    HA   CYS  43           HA       CYS  43   3.932  -1.523   1.090
  156   1HB   CYS  43          1HB       CYS  43   3.952   0.313  -0.650
  157   2HB   CYS  43          2HB       CYS  43   2.658   1.117   0.246
  158    H    PHE  44           H        PHE  44   3.320   0.654   2.780
  159    HA   PHE  44           HA       PHE  44   0.696   0.166   4.063
  160   1HB   PHE  44          1HB       PHE  44   1.530  -0.093   6.237
  161   2HB   PHE  44          2HB       PHE  44   2.485  -1.193   5.263
  162    HD1  PHE  44           HD1      PHE  44   2.513   1.692   7.478
  163    HD2  PHE  44           HD2      PHE  44   4.889  -0.496   4.616
  164    HE1  PHE  44           HE1      PHE  44   4.561   2.818   8.315
  165    HE2  PHE  44           HE2      PHE  44   6.933   0.632   5.461
  166    HZ   PHE  44           HZ       PHE  44   6.773   2.294   7.302
  167    H    LYS  45           H        LYS  45   3.298   2.362   3.241
  168    HA   LYS  45           HA       LYS  45   1.582   4.679   3.816
  169   1HB   LYS  45          1HB       LYS  45   2.686   4.161   6.010
  170   2HB   LYS  45          2HB       LYS  45   4.263   4.387   5.253
  171   1HG   LYS  45          1HG       LYS  45   3.659   6.761   4.757
  172   2HG   LYS  45          2HG       LYS  45   2.063   6.494   5.488
  173   1HD   LYS  45          1HD       LYS  45   3.167   5.941   7.655
  174   2HD   LYS  45          2HD       LYS  45   4.753   6.239   6.910
  175   1HE   LYS  45          1HE       LYS  45   4.063   8.581   6.410
  176   2HE   LYS  45          2HE       LYS  45   2.496   8.279   7.172
  177   1HZ   LYS  45          1HZ       LYS  45   3.678   7.853   9.268
  178   2HZ   LYS  45          2HZ       LYS  45   5.123   8.146   8.560
  179   3HZ   LYS  45          3HZ       LYS  45   4.032   9.348   8.718
  180    H    CYS  46           H        CYS  46   5.045   3.914   3.065
  181    HA   CYS  46           HA       CYS  46   5.403   6.375   1.695
  182   1HB   CYS  46          1HB       CYS  46   7.648   5.146   1.081
  183   2HB   CYS  46          2HB       CYS  46   7.296   5.701   2.713
  184    H    LYS  47           H        LYS  47   4.652   3.186   0.421
  185    HA   LYS  47           HA       LYS  47   4.191   2.414  -1.692
  186   1HB   LYS  47          1HB       LYS  47   2.126   3.405  -2.477
  187   2HB   LYS  47          2HB       LYS  47   2.183   3.265  -0.726
  188   1HG   LYS  47          1HG       LYS  47   2.749   5.688  -0.553
  189   2HG   LYS  47          2HG       LYS  47   2.613   5.839  -2.306
  190   1HD   LYS  47          1HD       LYS  47   0.266   5.311  -2.241
  191   2HD   LYS  47          2HD       LYS  47   0.341   4.806  -0.546
  192   1HE   LYS  47          1HE       LYS  47   1.024   7.631  -1.453
  193   2HE   LYS  47          2HE       LYS  47  -0.618   7.136  -1.026
  194   1HZ   LYS  47          3HZ       LYS  47   1.677   6.885   0.851
  195   2HZ   LYS  47          1HZ       LYS  47   0.587   8.116   0.876
  196   3HZ   LYS  47          2HZ       LYS  47   0.122   6.573   1.181
  197    H    GLN  48           H        GLN  48   6.612   4.079  -2.017
  198    HA   GLN  48           HA       GLN  48   6.423   5.454  -4.516
  199   1HB   GLN  48          1HB       GLN  48   8.850   4.197  -3.170
  200   2HB   GLN  48          2HB       GLN  48   8.915   5.322  -4.519
  201   1HG   GLN  48          1HG       GLN  48   7.908   5.923  -1.709
  202   2HG   GLN  48          2HG       GLN  48   9.396   6.485  -2.444
  203   1HE2  GLN  48          2HE2      GLN  48   6.065   7.227  -1.963
  204   2HE2  GLN  48          1HE2      GLN  48   6.014   8.612  -3.059
  205    HA   PRO  49           HA       PRO  49   5.931   2.655  -7.662
  206   1HB   PRO  49          2HB       PRO  49   8.466   3.631  -8.997
  207   2HB   PRO  49          1HB       PRO  49   6.850   3.350  -9.723
  208   1HG   PRO  49          1HG       PRO  49   7.581   5.848  -9.024
  209   2HG   PRO  49          2HG       PRO  49   5.938   5.257  -8.608
  210   1HD   PRO  49          1HD       PRO  49   8.365   5.481  -6.832
  211   2HD   PRO  49          2HD       PRO  49   6.656   5.876  -6.492
  212    H    GLY  50           H        GLY  50   9.172   2.170  -6.337
  213   1HA   GLY  50          2HA       GLY  50  10.317   0.115  -7.631
  214   2HA   GLY  50          1HA       GLY  50   8.941  -0.733  -6.928
  215    H    HIS  51           H        HIS  51   9.543   1.411  -4.561
  216    HA   HIS  51           HA       HIS  51  11.996   0.508  -3.385
  217   1HB   HIS  51          1HB       HIS  51  11.419   1.878  -1.581
  218   2HB   HIS  51          2HB       HIS  51  10.686   2.684  -2.956
  219    HD1  HIS  51           HD1      HIS  51   7.801   1.799  -3.165
  220    HD2  HIS  51           HD2      HIS  51   9.936   1.491   0.460
  221    HE1  HIS  51           HE1      HIS  51   6.096   1.295  -1.358
  222    H    PHE  52           H        PHE  52   8.723  -0.725  -3.197
  223    HA   PHE  52           HA       PHE  52   8.702  -1.770  -0.626
  224   1HB   PHE  52          1HB       PHE  52   6.741  -3.125  -1.489
  225   2HB   PHE  52          2HB       PHE  52   6.662  -1.390  -1.672
  226    HD1  PHE  52           HD1      PHE  52   6.621  -0.321  -3.856
  227    HD2  PHE  52           HD2      PHE  52   7.062  -4.600  -3.505
  228    HE1  PHE  52           HE1      PHE  52   6.180  -0.567  -6.277
  229    HE2  PHE  52           HE2      PHE  52   6.635  -4.836  -5.936
  230    HZ   PHE  52           HZ       PHE  52   6.200  -2.820  -7.330
  231    H    SER  53           H        SER  53   9.599  -3.543  -3.610
  232    HA   SER  53           HA       SER  53   9.969  -6.090  -2.447
  233   1HB   SER  53          1HB       SER  53  11.449  -4.868  -4.806
  234   2HB   SER  53          2HB       SER  53  11.290  -6.598  -4.444
  235    HG   SER  53           HG       SER  53   9.744  -5.898  -5.986
  236    H    LYS  54           H        LYS  54  11.796  -3.354  -1.703
  237    HA   LYS  54           HA       LYS  54  14.049  -4.994  -0.619
  238   1HB   LYS  54          1HB       LYS  54  14.285  -2.207  -1.844
  239   2HB   LYS  54          2HB       LYS  54  15.573  -3.138  -1.095
  240   1HG   LYS  54          1HG       LYS  54  16.089  -3.710  -3.199
  241   2HG   LYS  54          2HG       LYS  54  14.895  -4.965  -2.929
  242   1HD   LYS  54          1HD       LYS  54  14.441  -4.046  -5.070
  243   2HD   LYS  54          2HD       LYS  54  13.173  -3.385  -4.028
  244   1HE   LYS  54          1HE       LYS  54  14.443  -1.269  -3.803
  245   2HE   LYS  54          2HE       LYS  54  15.762  -1.946  -4.767
  246   1HZ   LYS  54          1HZ       LYS  54  14.206  -2.120  -6.643
  247   2HZ   LYS  54          2HZ       LYS  54  12.993  -1.471  -5.749
  248   3HZ   LYS  54          3HZ       LYS  54  14.308  -0.574  -6.131
  249    H    GLN  55           H        GLN  55  11.417  -3.525   0.444
  250    HA   GLN  55           HA       GLN  55  12.658  -2.904   3.031
  251   1HB   GLN  55          1HB       GLN  55  12.793  -0.739   1.787
  252   2HB   GLN  55          2HB       GLN  55  11.041  -0.751   1.593
  253   1HG   GLN  55          1HG       GLN  55  10.824  -0.756   4.115
  254   2HG   GLN  55          2HG       GLN  55  12.583  -0.664   4.230
  255   1HE2  GLN  55          1HE2      GLN  55   9.632   1.094   3.403
  256   2HE2  GLN  55          2HE2      GLN  55  10.395   2.681   3.325
  257    H    CYS  56           H        CYS  56   9.481  -2.219   1.482
  258    HA   CYS  56           HA       CYS  56   8.143  -2.909   3.951
  259   1HB   CYS  56          1HB       CYS  56   7.101  -1.857   1.285
  260   2HB   CYS  56          2HB       CYS  56   6.203  -1.903   2.810
  261    H    ARG  57           H        ARG  57   8.688  -4.655   1.036
  262    HA   ARG  57           HA       ARG  57   6.724  -6.776   1.761
  263   1HB   ARG  57          1HB       ARG  57   6.136  -4.850  -0.143
  264   2HB   ARG  57          2HB       ARG  57   6.950  -6.031  -1.140
  265   1HG   ARG  57          1HG       ARG  57   4.904  -6.997  -1.301
  266   2HG   ARG  57          2HG       ARG  57   5.217  -7.660   0.297
  267   1HD   ARG  57          1HD       ARG  57   3.638  -5.172  -0.446
  268   2HD   ARG  57          2HD       ARG  57   3.023  -6.652   0.303
  269    HE   ARG  57           HE       ARG  57   5.003  -5.494   2.023
  270   1HH1  ARG  57          1HH2      ARG  57   1.787  -4.647   0.928
  271   2HH1  ARG  57          2HH2      ARG  57   1.586  -3.498   2.226
  272   1HH2  ARG  57          1HH1      ARG  57   4.621  -4.181   3.668
  273   2HH2  ARG  57          2HH1      ARG  57   3.051  -3.422   3.881
  274    H    SER  58           H        SER  58   9.769  -6.393   1.643
  275    HA   SER  58           HA       SER  58  11.131  -7.891  -0.217
  276   1HB   SER  58          1HB       SER  58  11.647  -7.893   2.775
  277   2HB   SER  58          2HB       SER  58  12.821  -8.240   1.492
  278    HG   SER  58           HG       SER  58  12.913  -6.044   2.255

  No H/Q in entry =         278
  Start of MODEL   10
    1    H1   GLN  22           H1       GLN  22  -8.161  -0.538  -6.162
    2    H2   GLN  22           H3       GLN  22  -7.268   0.757  -5.712
    3    H3   GLN  22           H2       GLN  22  -7.208   0.216  -7.267
    4    HA   GLN  22           HA       GLN  22  -6.179  -1.844  -6.578
    5   1HB   GLN  22          1HB       GLN  22  -4.750   0.603  -5.437
    6   2HB   GLN  22          2HB       GLN  22  -4.007  -0.969  -5.709
    7   1HG   GLN  22          1HG       GLN  22  -5.109   0.855  -7.897
    8   2HG   GLN  22          2HG       GLN  22  -3.427   0.672  -7.439
    9   1HE2  GLN  22          2HE2      GLN  22  -2.354  -0.534  -9.014
   10   2HE2  GLN  22          1HE2      GLN  22  -3.050  -1.958  -9.778
   11    H    THR  23           H        THR  23  -6.295  -3.408  -5.055
   12    HA   THR  23           HA       THR  23  -7.773  -3.196  -2.767
   13    HB   THR  23           HB       THR  23  -5.494  -5.167  -3.128
   14    HG1  THR  23           HG1      THR  23  -7.001  -6.346  -4.314
   15   1HG2  THR  23          1HG2      THR  23  -8.234  -5.435  -1.799
   16   2HG2  THR  23          2HG2      THR  23  -7.054  -6.742  -2.013
   17   3HG2  THR  23          3HG2      THR  23  -6.669  -5.387  -0.949
   18    H    CYS  24           H        CYS  24  -7.588  -2.678  -0.702
   19    HA   CYS  24           HA       CYS  24  -5.640  -1.005   0.321
   20   1HB   CYS  24          1HB       CYS  24  -8.028  -1.474   1.070
   21   2HB   CYS  24          2HB       CYS  24  -7.406  -2.893   1.920
   22    H    TYR  25           H        TYR  25  -4.009  -1.160   1.866
   23    HA   TYR  25           HA       TYR  25  -2.443  -3.585   2.162
   24   1HB   TYR  25          1HB       TYR  25  -0.978  -2.340   3.390
   25   2HB   TYR  25          2HB       TYR  25  -1.628  -1.132   2.306
   26    HD1  TYR  25           HD1      TYR  25  -0.565  -1.646   5.545
   27    HD2  TYR  25           HD2      TYR  25  -3.957   0.028   3.463
   28    HE1  TYR  25           HE1      TYR  25  -1.102  -0.250   7.529
   29    HE2  TYR  25           HE2      TYR  25  -4.524   1.357   5.476
   30    HH   TYR  25           HH       TYR  25  -2.560   1.276   8.453
   31    H    ASN  26           H        ASN  26  -5.275  -2.483   3.738
   32    HA   ASN  26           HA       ASN  26  -4.867  -4.302   6.099
   33   1HB   ASN  26          1HB       ASN  26  -4.371  -2.009   6.721
   34   2HB   ASN  26          2HB       ASN  26  -5.828  -1.408   5.935
   35   1HD2  ASN  26          2HD2      ASN  26  -7.865  -1.597   7.016
   36   2HD2  ASN  26          1HD2      ASN  26  -7.928  -2.112   8.694
   37    H    CYS  27           H        CYS  27  -7.338  -2.489   4.218
   38    HA   CYS  27           HA       CYS  27  -9.512  -3.756   5.578
   39   1HB   CYS  27          1HB       CYS  27  -9.498  -1.977   3.110
   40   2HB   CYS  27          2HB       CYS  27 -10.863  -2.277   4.191
   41    H    GLY  28           H        GLY  28  -7.712  -4.930   2.951
   42   1HA   GLY  28          2HA       GLY  28  -9.275  -7.220   2.465
   43   2HA   GLY  28          1HA       GLY  28  -8.002  -6.606   1.406
   44    H    LYS  29           H        LYS  29  -9.394  -4.100   0.809
   45    HA   LYS  29           HA       LYS  29 -11.820  -4.980  -0.707
   46   1HB   LYS  29          1HB       LYS  29 -12.263  -3.737   1.367
   47   2HB   LYS  29          2HB       LYS  29 -11.259  -2.418   0.808
   48   1HG   LYS  29          1HG       LYS  29 -13.518  -1.769   0.485
   49   2HG   LYS  29          2HG       LYS  29 -12.873  -2.085  -1.127
   50   1HD   LYS  29          1HD       LYS  29 -13.992  -4.308  -1.140
   51   2HD   LYS  29          2HD       LYS  29 -14.556  -4.034   0.522
   52   1HE   LYS  29          1HE       LYS  29 -15.810  -2.023  -0.257
   53   2HE   LYS  29          2HE       LYS  29 -15.283  -2.340  -1.913
   54   1HZ   LYS  29          2HZ       LYS  29 -16.471  -4.476  -1.802
   55   2HZ   LYS  29          3HZ       LYS  29 -16.954  -4.172  -0.270
   56   3HZ   LYS  29          1HZ       LYS  29 -17.498  -3.247  -1.496
   57    HA   PRO  30           HA       PRO  30  -9.271  -3.734  -4.236
   58   1HB   PRO  30          2HB       PRO  30 -11.997  -3.768  -5.532
   59   2HB   PRO  30          1HB       PRO  30 -10.435  -4.368  -6.175
   60   1HG   PRO  30          1HG       PRO  30 -12.185  -6.106  -5.084
   61   2HG   PRO  30          2HG       PRO  30 -10.445  -6.221  -4.659
   62   1HD   PRO  30          1HD       PRO  30 -12.696  -4.994  -3.064
   63   2HD   PRO  30          2HD       PRO  30 -11.339  -6.025  -2.516
   64    H    GLY  31           H        GLY  31 -12.211  -1.905  -3.447
   65   1HA   GLY  31          2HA       GLY  31 -12.926   0.231  -3.893
   66   2HA   GLY  31          1HA       GLY  31 -11.727   0.331  -5.181
   67    H    HIS  32           H        HIS  32  -9.384  -0.021  -3.543
   68    HA   HIS  32           HA       HIS  32  -9.411   2.400  -1.804
   69   1HB   HIS  32          1HB       HIS  32  -7.994  -0.231  -1.630
   70   2HB   HIS  32          2HB       HIS  32  -7.148   1.197  -1.049
   71    HD1  HIS  32           HD1      HIS  32 -10.500  -0.620  -0.405
   72    HD2  HIS  32           HD2      HIS  32  -7.730   2.004   1.330
   73    HE1  HIS  32           HE1      HIS  32 -11.267  -0.261   2.021
   74    H    LEU  33           H        LEU  33  -7.608   3.661  -1.663
   75    HA   LEU  33           HA       LEU  33  -5.707   4.074  -3.837
   76   1HB   LEU  33          1HB       LEU  33  -8.058   5.945  -3.243
   77   2HB   LEU  33          2HB       LEU  33  -6.637   6.451  -4.143
   78    HG   LEU  33           HG       LEU  33  -8.619   4.335  -5.066
   79   1HD1  LEU  33          1HD1      LEU  33  -9.537   6.609  -5.061
   80   2HD1  LEU  33          2HD1      LEU  33  -8.138   7.191  -5.990
   81   3HD1  LEU  33          3HD1      LEU  33  -9.272   6.025  -6.712
   82   1HD2  LEU  33          1HD2      LEU  33  -6.228   5.606  -6.485
   83   2HD2  LEU  33          2HD2      LEU  33  -6.357   3.903  -5.986
   84   3HD2  LEU  33          3HD2      LEU  33  -7.430   4.535  -7.239
   85    H    SER  34           H        SER  34  -4.497   6.210  -3.256
   86    HA   SER  34           HA       SER  34  -3.636   6.374  -0.533
   87   1HB   SER  34          1HB       SER  34  -2.597   8.510  -1.290
   88   2HB   SER  34          2HB       SER  34  -2.246   7.132  -2.351
   89    HG   SER  34           HG       SER  34  -2.862   9.024  -3.529
   90    H    SER  35           H        SER  35  -6.444   7.744  -2.091
   91    HA   SER  35           HA       SER  35  -7.042   9.664   0.055
   92   1HB   SER  35          1HB       SER  35  -9.085  10.062  -1.302
   93   2HB   SER  35          2HB       SER  35  -7.586  10.256  -2.226
   94    HG   SER  35           HG       SER  35  -9.186   9.012  -3.343
   95    H    GLN  36           H        GLN  36  -7.336   6.329  -0.147
   96    HA   GLN  36           HA       GLN  36  -9.885   6.222   1.424
   97   1HB   GLN  36          1HB       GLN  36  -9.583   5.088  -0.931
   98   2HB   GLN  36          2HB       GLN  36  -8.618   3.914  -0.047
   99   1HG   GLN  36          1HG       GLN  36 -10.719   2.917  -0.034
  100   2HG   GLN  36          2HG       GLN  36 -10.736   3.725   1.525
  101   1HE2  GLN  36          2HE2      GLN  36 -12.168   3.544  -1.689
  102   2HE2  GLN  36          1HE2      GLN  36 -13.375   4.797  -1.409
  103    H    CYS  37           H        CYS  37  -6.564   4.928   1.218
  104    HA   CYS  37           HA       CYS  37  -6.363   4.850   4.145
  105   1HB   CYS  37          1HB       CYS  37  -6.005   2.410   2.367
  106   2HB   CYS  37          2HB       CYS  37  -4.983   2.606   3.759
  107    H    ARG  38           H        ARG  38  -4.030   4.434   4.749
  108    HA   ARG  38           HA       ARG  38  -2.254   6.341   3.661
  109   1HB   ARG  38          1HB       ARG  38  -1.699   3.833   5.306
  110   2HB   ARG  38          2HB       ARG  38  -0.516   5.095   4.979
  111   1HG   ARG  38          1HG       ARG  38  -1.203   6.256   6.726
  112   2HG   ARG  38          2HG       ARG  38  -2.787   6.477   6.007
  113   1HD   ARG  38          1HD       ARG  38  -1.960   4.069   7.692
  114   2HD   ARG  38          2HD       ARG  38  -2.755   5.490   8.348
  115    HE   ARG  38           HE       ARG  38  -3.992   3.282   6.986
  116   1HH1  ARG  38          1HH1      ARG  38  -4.465   6.654   7.805
  117   2HH1  ARG  38          2HH1      ARG  38  -6.188   6.567   7.574
  118   1HH2  ARG  38          2HH2      ARG  38  -6.216   3.330   6.442
  119   2HH2  ARG  38          1HH2      ARG  38  -7.129   4.730   6.879
  120    H    ALA  39           H        ALA  39  -2.571   2.924   2.731
  121    HA   ALA  39           HA       ALA  39  -1.372   3.538   0.166
  122   1HB   ALA  39          3HB       ALA  39  -0.002   1.528   2.016
  123   2HB   ALA  39          1HB       ALA  39   0.422   1.801   0.321
  124   3HB   ALA  39          2HB       ALA  39   0.683   3.092   1.506
  125    HA   PRO  40           HA       PRO  40  -3.661  -0.349  -0.818
  126   1HB   PRO  40          2HB       PRO  40  -2.626  -0.968  -3.247
  127   2HB   PRO  40          1HB       PRO  40  -3.712   0.435  -3.017
  128   1HG   PRO  40          1HG       PRO  40  -0.677   0.431  -3.112
  129   2HG   PRO  40          2HG       PRO  40  -1.807   1.483  -4.020
  130   1HD   PRO  40          1HD       PRO  40  -0.609   2.246  -1.671
  131   2HD   PRO  40          2HD       PRO  40  -2.248   2.796  -2.126
  132    H    LYS  41           H        LYS  41  -2.949  -2.624  -1.449
  133    HA   LYS  41           HA       LYS  41  -1.238  -3.795   0.403
  134   1HB   LYS  41          1HB       LYS  41  -3.148  -4.790  -0.899
  135   2HB   LYS  41          2HB       LYS  41  -2.073  -4.948  -2.290
  136   1HG   LYS  41          1HG       LYS  41  -0.654  -6.523  -1.051
  137   2HG   LYS  41          2HG       LYS  41  -1.580  -6.233   0.437
  138   1HD   LYS  41          1HD       LYS  41  -3.594  -7.204  -0.619
  139   2HD   LYS  41          2HD       LYS  41  -2.692  -7.446  -2.135
  140   1HE   LYS  41          1HE       LYS  41  -1.092  -8.928  -0.941
  141   2HE   LYS  41          2HE       LYS  41  -1.989  -8.694   0.564
  142   1HZ   LYS  41          3HZ       LYS  41  -3.090  -9.957  -1.892
  143   2HZ   LYS  41          1HZ       LYS  41  -2.638 -10.755  -0.544
  144   3HZ   LYS  41          2HZ       LYS  41  -3.917  -9.745  -0.496
  145    H    VAL  42           H        VAL  42  -0.144  -2.273  -2.431
  146    HA   VAL  42           HA       VAL  42   2.390  -3.489  -2.907
  147    HB   VAL  42           HB       VAL  42   1.586  -0.551  -3.028
  148   1HG1  VAL  42          2HG1      VAL  42   3.860  -2.033  -4.402
  149   2HG1  VAL  42          3HG1      VAL  42   3.366  -0.363  -4.753
  150   3HG1  VAL  42          1HG1      VAL  42   4.019  -0.762  -3.167
  151   1HG2  VAL  42          2HG2      VAL  42   1.504  -2.713  -5.182
  152   2HG2  VAL  42          3HG2      VAL  42   0.095  -1.912  -4.453
  153   3HG2  VAL  42          1HG2      VAL  42   1.209  -0.982  -5.450
  154    H    CYS  43           H        CYS  43   1.323  -1.298  -0.309
  155    HA   CYS  43           HA       CYS  43   3.927  -1.503   1.098
  156   1HB   CYS  43          1HB       CYS  43   3.993   0.334  -0.637
  157   2HB   CYS  43          2HB       CYS  43   2.681   1.144   0.227
  158    H    PHE  44           H        PHE  44   3.296   0.676   2.779
  159    HA   PHE  44           HA       PHE  44   0.639   0.237   4.006
  160   1HB   PHE  44          1HB       PHE  44   1.425  -0.059   6.200
  161   2HB   PHE  44          2HB       PHE  44   2.343  -1.195   5.232
  162    HD1  PHE  44           HD1      PHE  44   2.473   1.663   7.475
  163    HD2  PHE  44           HD2      PHE  44   4.783  -0.602   4.617
  164    HE1  PHE  44           HE1      PHE  44   4.561   2.681   8.353
  165    HE2  PHE  44           HE2      PHE  44   6.865   0.420   5.503
  166    HZ   PHE  44           HZ       PHE  44   6.760   2.066   7.362
  167    H    LYS  45           H        LYS  45   3.277   2.363   3.195
  168    HA   LYS  45           HA       LYS  45   1.701   4.745   3.922
  169   1HB   LYS  45          1HB       LYS  45   2.837   4.128   6.041
  170   2HB   LYS  45          2HB       LYS  45   4.403   4.167   5.229
  171   1HG   LYS  45          1HG       LYS  45   4.086   6.607   4.781
  172   2HG   LYS  45          2HG       LYS  45   2.507   6.534   5.594
  173   1HD   LYS  45          1HD       LYS  45   3.634   5.820   7.694
  174   2HD   LYS  45          2HD       LYS  45   5.208   5.878   6.868
  175   1HE   LYS  45          1HE       LYS  45   4.860   8.302   6.404
  176   2HE   LYS  45          2HE       LYS  45   3.311   8.240   7.254
  177   1HZ   LYS  45          2HZ       LYS  45   4.528   7.621   9.279
  178   2HZ   LYS  45          3HZ       LYS  45   5.959   7.686   8.490
  179   3HZ   LYS  45          1HZ       LYS  45   5.082   9.044   8.706
  180    H    CYS  46           H        CYS  46   5.111   3.891   3.061
  181    HA   CYS  46           HA       CYS  46   5.481   6.367   1.721
  182   1HB   CYS  46          1HB       CYS  46   7.730   5.143   1.122
  183   2HB   CYS  46          2HB       CYS  46   7.359   5.680   2.757
  184    H    LYS  47           H        LYS  47   4.699   3.201   0.417
  185    HA   LYS  47           HA       LYS  47   4.240   2.454  -1.706
  186   1HB   LYS  47          1HB       LYS  47   2.216   3.522  -2.522
  187   2HB   LYS  47          2HB       LYS  47   2.237   3.346  -0.774
  188   1HG   LYS  47          1HG       LYS  47   2.852   5.736  -0.528
  189   2HG   LYS  47          2HG       LYS  47   2.798   5.940  -2.279
  190   1HD   LYS  47          1HD       LYS  47   0.432   5.527  -2.331
  191   2HD   LYS  47          2HD       LYS  47   0.407   4.945  -0.659
  192   1HE   LYS  47          1HE       LYS  47   1.261   7.774  -1.406
  193   2HE   LYS  47          2HE       LYS  47  -0.420   7.348  -1.070
  194   1HZ   LYS  47          2HZ       LYS  47   1.788   6.917   0.880
  195   2HZ   LYS  47          3HZ       LYS  47   0.732   8.173   0.926
  196   3HZ   LYS  47          1HZ       LYS  47   0.216   6.630   1.139
  197    H    GLN  48           H        GLN  48   6.710   4.056  -1.983
  198    HA   GLN  48           HA       GLN  48   6.592   5.456  -4.477
  199   1HB   GLN  48          1HB       GLN  48   8.971   4.156  -3.082
  200   2HB   GLN  48          2HB       GLN  48   9.084   5.283  -4.424
  201   1HG   GLN  48          1HG       GLN  48   8.027   5.891  -1.637
  202   2HG   GLN  48          2HG       GLN  48   9.538   6.431  -2.338
  203   1HE2  GLN  48          2HE2      GLN  48   6.214   7.229  -1.924
  204   2HE2  GLN  48          1HE2      GLN  48   6.208   8.619  -3.017
  205    HA   PRO  49           HA       PRO  49   6.168   2.683  -7.660
  206   1HB   PRO  49          2HB       PRO  49   8.755   3.631  -8.908
  207   2HB   PRO  49          1HB       PRO  49   7.158   3.383  -9.685
  208   1HG   PRO  49          1HG       PRO  49   7.906   5.864  -8.943
  209   2HG   PRO  49          2HG       PRO  49   6.242   5.297  -8.579
  210   1HD   PRO  49          1HD       PRO  49   8.627   5.458  -6.736
  211   2HD   PRO  49          2HD       PRO  49   6.918   5.889  -6.438
  212    H    GLY  50           H        GLY  50   9.337   2.123  -6.211
  213   1HA   GLY  50          2HA       GLY  50  10.523   0.076  -7.466
  214   2HA   GLY  50          1HA       GLY  50   9.086  -0.767  -6.889
  215    H    HIS  51           H        HIS  51   9.764   1.432  -4.491
  216    HA   HIS  51           HA       HIS  51  12.045   0.375  -3.180
  217   1HB   HIS  51          1HB       HIS  51  11.455   1.792  -1.417
  218   2HB   HIS  51          2HB       HIS  51  10.795   2.612  -2.822
  219    HD1  HIS  51           HD1      HIS  51   7.897   1.764  -3.133
  220    HD2  HIS  51           HD2      HIS  51   9.895   1.446   0.567
  221    HE1  HIS  51           HE1      HIS  51   6.122   1.270  -1.389
  222    H    PHE  52           H        PHE  52   8.746  -0.800  -3.192
  223    HA   PHE  52           HA       PHE  52   8.606  -1.906  -0.614
  224   1HB   PHE  52          1HB       PHE  52   6.679  -3.225  -1.613
  225   2HB   PHE  52          2HB       PHE  52   6.603  -1.480  -1.697
  226    HD1  PHE  52           HD1      PHE  52   7.047  -4.580  -3.701
  227    HD2  PHE  52           HD2      PHE  52   6.632  -0.285  -3.812
  228    HE1  PHE  52           HE1      PHE  52   6.671  -4.672  -6.150
  229    HE2  PHE  52           HE2      PHE  52   6.240  -0.387  -6.251
  230    HZ   PHE  52           HZ       PHE  52   6.272  -2.575  -7.434
  231    H    SER  53           H        SER  53   9.568  -3.547  -3.654
  232    HA   SER  53           HA       SER  53   9.934  -6.141  -2.594
  233   1HB   SER  53          1HB       SER  53  11.401  -4.804  -4.900
  234   2HB   SER  53          2HB       SER  53  11.274  -6.551  -4.609
  235    HG   SER  53           HG       SER  53   9.711  -5.826  -6.119
  236    H    LYS  54           H        LYS  54  11.736  -3.449  -1.706
  237    HA   LYS  54           HA       LYS  54  13.936  -5.135  -0.624
  238   1HB   LYS  54          1HB       LYS  54  15.595  -3.459  -1.231
  239   2HB   LYS  54          2HB       LYS  54  14.775  -4.083  -2.657
  240   1HG   LYS  54          1HG       LYS  54  13.389  -2.039  -2.799
  241   2HG   LYS  54          2HG       LYS  54  14.101  -1.431  -1.296
  242   1HD   LYS  54          1HD       LYS  54  15.141  -0.296  -3.125
  243   2HD   LYS  54          2HD       LYS  54  16.340  -1.388  -2.414
  244   1HE   LYS  54          1HE       LYS  54  15.880  -3.048  -4.224
  245   2HE   LYS  54          2HE       LYS  54  14.671  -1.954  -4.913
  246   1HZ   LYS  54          1HZ       LYS  54  16.459  -0.333  -5.289
  247   2HZ   LYS  54          2HZ       LYS  54  17.571  -1.348  -4.655
  248   3HZ   LYS  54          3HZ       LYS  54  16.808  -1.735  -6.044
  249    H    GLN  55           H        GLN  55  11.400  -3.592   0.410
  250    HA   GLN  55           HA       GLN  55  12.672  -2.959   2.975
  251   1HB   GLN  55          1HB       GLN  55  12.803  -0.797   1.722
  252   2HB   GLN  55          2HB       GLN  55  11.048  -0.801   1.550
  253   1HG   GLN  55          1HG       GLN  55  10.864  -0.813   4.078
  254   2HG   GLN  55          2HG       GLN  55  12.625  -0.715   4.166
  255   1HE2  GLN  55          1HE2      GLN  55   9.656   1.039   3.426
  256   2HE2  GLN  55          2HE2      GLN  55  10.413   2.626   3.323
  257    H    CYS  56           H        CYS  56   9.480  -2.235   1.475
  258    HA   CYS  56           HA       CYS  56   8.171  -2.947   3.948
  259   1HB   CYS  56          1HB       CYS  56   7.096  -1.886   1.299
  260   2HB   CYS  56          2HB       CYS  56   6.212  -1.947   2.833
  261    H    ARG  57           H        ARG  57   8.683  -4.693   1.031
  262    HA   ARG  57           HA       ARG  57   6.711  -6.807   1.757
  263   1HB   ARG  57          1HB       ARG  57   6.128  -4.856  -0.124
  264   2HB   ARG  57          2HB       ARG  57   6.922  -6.035  -1.139
  265   1HG   ARG  57          1HG       ARG  57   4.868  -6.981  -1.294
  266   2HG   ARG  57          2HG       ARG  57   5.183  -7.660   0.299
  267   1HD   ARG  57          1HD       ARG  57   3.631  -5.146  -0.416
  268   2HD   ARG  57          2HD       ARG  57   2.999  -6.624   0.320
  269    HE   ARG  57           HE       ARG  57   5.000  -5.509   2.044
  270   1HH1  ARG  57          2HH2      ARG  57   1.799  -4.613   0.962
  271   2HH1  ARG  57          1HH2      ARG  57   1.606  -3.472   2.268
  272   1HH2  ARG  57          2HH1      ARG  57   4.639  -4.204   3.702
  273   2HH2  ARG  57          1HH1      ARG  57   3.077  -3.433   3.930
  274    H    SER  58           H        SER  58   9.763  -6.442   1.607
  275    HA   SER  58           HA       SER  58  11.096  -7.912  -0.288
  276   1HB   SER  58          1HB       SER  58  11.641  -7.973   2.698
  277   2HB   SER  58          2HB       SER  58  12.801  -8.305   1.396
  278    HG   SER  58           HG       SER  58  12.904  -6.120   2.206

  No H/Q in entry =         278
  Start of MODEL   11
    1    H1   GLN  22           H2       GLN  22  -8.054  -0.172  -7.100
    2    H2   GLN  22           H1       GLN  22  -7.304   0.935  -6.147
    3    H3   GLN  22           H3       GLN  22  -6.737   0.641  -7.661
    4    HA   GLN  22           HA       GLN  22  -6.151  -1.619  -7.046
    5   1HB   GLN  22          1HB       GLN  22  -4.934   0.583  -5.304
    6   2HB   GLN  22          2HB       GLN  22  -4.325  -1.058  -5.371
    7   1HG   GLN  22          1HG       GLN  22  -2.908   0.006  -6.783
    8   2HG   GLN  22          2HG       GLN  22  -4.029  -0.766  -7.893
    9   1HE2  GLN  22          1HE2      GLN  22  -2.364   2.104  -7.367
   10   2HE2  GLN  22          2HE2      GLN  22  -3.459   3.174  -8.232
   11    H    THR  23           H        THR  23  -5.282  -2.477  -4.544
   12    HA   THR  23           HA       THR  23  -7.826  -2.913  -3.012
   13    HB   THR  23           HB       THR  23  -5.532  -4.832  -3.578
   14    HG1  THR  23           HG1      THR  23  -7.051  -5.876  -4.845
   15   1HG2  THR  23          3HG2      THR  23  -8.190  -5.361  -2.177
   16   2HG2  THR  23          1HG2      THR  23  -6.977  -6.579  -2.618
   17   3HG2  THR  23          2HG2      THR  23  -6.587  -5.364  -1.398
   18    H    CYS  24           H        CYS  24  -7.666  -2.931  -0.760
   19    HA   CYS  24           HA       CYS  24  -5.816  -1.129   0.343
   20   1HB   CYS  24          1HB       CYS  24  -8.190  -1.765   1.074
   21   2HB   CYS  24          2HB       CYS  24  -7.464  -3.155   1.887
   22    H    TYR  25           H        TYR  25  -4.189  -1.273   1.856
   23    HA   TYR  25           HA       TYR  25  -2.528  -3.658   2.066
   24   1HB   TYR  25          1HB       TYR  25  -1.050  -2.369   3.233
   25   2HB   TYR  25          2HB       TYR  25  -1.765  -1.183   2.163
   26    HD1  TYR  25           HD1      TYR  25  -0.656  -1.752   5.413
   27    HD2  TYR  25           HD2      TYR  25  -4.008   0.022   3.349
   28    HE1  TYR  25           HE1      TYR  25  -1.167  -0.376   7.418
   29    HE2  TYR  25           HE2      TYR  25  -4.533   1.359   5.371
   30    HH   TYR  25           HH       TYR  25  -2.598   1.142   8.366
   31    H    ASN  26           H        ASN  26  -5.321  -2.578   3.755
   32    HA   ASN  26           HA       ASN  26  -4.754  -4.333   6.131
   33   1HB   ASN  26          1HB       ASN  26  -4.206  -2.036   6.668
   34   2HB   ASN  26          2HB       ASN  26  -5.709  -1.440   5.968
   35   1HD2  ASN  26          1HD2      ASN  26  -7.642  -1.537   7.212
   36   2HD2  ASN  26          2HD2      ASN  26  -7.603  -2.042   8.894
   37    H    CYS  27           H        CYS  27  -7.380  -2.523   4.441
   38    HA   CYS  27           HA       CYS  27  -9.487  -3.806   5.862
   39   1HB   CYS  27          1HB       CYS  27  -9.569  -2.315   3.200
   40   2HB   CYS  27          2HB       CYS  27 -10.915  -2.576   4.313
   41    H    GLY  28           H        GLY  28  -7.681  -4.859   3.098
   42   1HA   GLY  28          2HA       GLY  28  -9.119  -7.317   2.684
   43   2HA   GLY  28          1HA       GLY  28  -7.834  -6.655   1.670
   44    H    LYS  29           H        LYS  29  -9.958  -4.194   1.643
   45    HA   LYS  29           HA       LYS  29 -11.965  -5.233  -0.264
   46   1HB   LYS  29          1HB       LYS  29 -11.558  -2.709   1.338
   47   2HB   LYS  29          2HB       LYS  29 -12.404  -2.555  -0.185
   48   1HG   LYS  29          1HG       LYS  29 -14.025  -2.738   1.473
   49   2HG   LYS  29          2HG       LYS  29 -14.097  -4.209   0.516
   50   1HD   LYS  29          1HD       LYS  29 -12.556  -4.094   3.136
   51   2HD   LYS  29          2HD       LYS  29 -14.309  -4.303   3.119
   52   1HE   LYS  29          1HE       LYS  29 -14.154  -6.338   1.801
   53   2HE   LYS  29          2HE       LYS  29 -12.405  -6.152   1.633
   54   1HZ   LYS  29          3HZ       LYS  29 -13.806  -6.555   4.219
   55   2HZ   LYS  29          1HZ       LYS  29 -12.956  -7.701   3.421
   56   3HZ   LYS  29          2HZ       LYS  29 -12.185  -6.386   4.026
   57    HA   PRO  30           HA       PRO  30  -9.911  -3.308  -3.888
   58   1HB   PRO  30          2HB       PRO  30 -11.972  -3.341  -5.642
   59   2HB   PRO  30          1HB       PRO  30 -11.193  -4.852  -5.101
   60   1HG   PRO  30          1HG       PRO  30 -13.732  -3.588  -4.016
   61   2HG   PRO  30          2HG       PRO  30 -13.488  -5.279  -4.562
   62   1HD   PRO  30          1HD       PRO  30 -13.299  -4.505  -1.936
   63   2HD   PRO  30          2HD       PRO  30 -12.314  -5.836  -2.614
   64    H    GLY  31           H        GLY  31 -11.065  -1.399  -5.479
   65   1HA   GLY  31          2HA       GLY  31 -12.781   0.515  -4.253
   66   2HA   GLY  31          1HA       GLY  31 -11.680   0.823  -5.602
   67    H    HIS  32           H        HIS  32  -9.295   0.086  -4.024
   68    HA   HIS  32           HA       HIS  32  -9.150   2.280  -2.010
   69   1HB   HIS  32          1HB       HIS  32  -8.133  -0.533  -2.099
   70   2HB   HIS  32          2HB       HIS  32  -7.097   0.671  -1.346
   71    HD1  HIS  32           HD1      HIS  32 -10.762  -0.586  -0.930
   72    HD2  HIS  32           HD2      HIS  32  -7.621   1.371   1.068
   73    HE1  HIS  32           HE1      HIS  32 -11.505  -0.317   1.506
   74    H    LEU  33           H        LEU  33  -7.429   3.529  -1.830
   75    HA   LEU  33           HA       LEU  33  -5.321   3.827  -3.848
   76   1HB   LEU  33          1HB       LEU  33  -7.684   5.745  -3.483
   77   2HB   LEU  33          2HB       LEU  33  -6.209   6.188  -4.325
   78    HG   LEU  33           HG       LEU  33  -8.154   4.042  -5.260
   79   1HD1  LEU  33          1HD1      LEU  33  -9.082   6.308  -5.383
   80   2HD1  LEU  33          2HD1      LEU  33  -7.641   6.866  -6.262
   81   3HD1  LEU  33          3HD1      LEU  33  -8.733   5.667  -6.997
   82   1HD2  LEU  33          2HD2      LEU  33  -5.707   5.277  -6.611
   83   2HD2  LEU  33          3HD2      LEU  33  -5.838   3.599  -6.039
   84   3HD2  LEU  33          1HD2      LEU  33  -6.856   4.155  -7.371
   85    H    SER  34           H        SER  34  -4.075   5.887  -3.273
   86    HA   SER  34           HA       SER  34  -3.358   6.289  -0.590
   87   1HB   SER  34          1HB       SER  34  -3.329   8.331  -2.842
   88   2HB   SER  34          2HB       SER  34  -2.295   8.326  -1.401
   89    HG   SER  34           HG       SER  34  -1.367   7.423  -3.405
   90    H    SER  35           H        SER  35  -6.201   7.502  -2.221
   91    HA   SER  35           HA       SER  35  -6.831   9.539  -0.177
   92   1HB   SER  35          1HB       SER  35  -8.772   9.966  -1.686
   93   2HB   SER  35          2HB       SER  35  -7.200  10.121  -2.489
   94    HG   SER  35           HG       SER  35  -8.723   8.897  -3.724
   95    H    GLN  36           H        GLN  36  -7.243   6.212  -0.384
   96    HA   GLN  36           HA       GLN  36  -9.856   6.206   1.084
   97   1HB   GLN  36          1HB       GLN  36  -9.514   4.930  -1.157
   98   2HB   GLN  36          2HB       GLN  36  -8.476   3.849  -0.229
   99   1HG   GLN  36          1HG       GLN  36 -10.563   2.780  -0.248
  100   2HG   GLN  36          2HG       GLN  36 -10.505   3.511   1.349
  101   1HE2  GLN  36          2HE2      GLN  36 -12.059   3.532  -1.835
  102   2HE2  GLN  36          1HE2      GLN  36 -13.328   4.672  -1.387
  103    H    CYS  37           H        CYS  37  -6.544   4.897   1.079
  104    HA   CYS  37           HA       CYS  37  -6.463   4.752   4.027
  105   1HB   CYS  37          1HB       CYS  37  -6.044   2.427   2.108
  106   2HB   CYS  37          2HB       CYS  37  -5.171   2.493   3.625
  107    H    ARG  38           H        ARG  38  -4.150   4.311   4.710
  108    HA   ARG  38           HA       ARG  38  -2.372   6.291   3.720
  109   1HB   ARG  38          1HB       ARG  38  -1.904   3.829   5.450
  110   2HB   ARG  38          2HB       ARG  38  -0.659   5.034   5.129
  111   1HG   ARG  38          1HG       ARG  38  -1.453   6.473   6.629
  112   2HG   ARG  38          2HG       ARG  38  -3.087   6.399   5.993
  113   1HD   ARG  38          1HD       ARG  38  -1.867   4.384   7.926
  114   2HD   ARG  38          2HD       ARG  38  -2.899   5.728   8.402
  115    HE   ARG  38           HE       ARG  38  -3.722   3.173   7.349
  116   1HH1  ARG  38          1HH2      ARG  38  -4.818   6.507   7.537
  117   2HH1  ARG  38          2HH2      ARG  38  -6.481   6.058   7.285
  118   1HH2  ARG  38          2HH1      ARG  38  -5.848   2.694   7.008
  119   2HH2  ARG  38          1HH1      ARG  38  -7.033   3.959   6.928
  120    H    ALA  39           H        ALA  39  -2.603   2.912   2.723
  121    HA   ALA  39           HA       ALA  39  -1.389   3.641   0.213
  122   1HB   ALA  39          1HB       ALA  39  -0.017   1.524   1.938
  123   2HB   ALA  39          2HB       ALA  39   0.402   1.897   0.262
  124   3HB   ALA  39          3HB       ALA  39   0.675   3.113   1.519
  125    HA   PRO  40           HA       PRO  40  -3.717  -0.183  -0.910
  126   1HB   PRO  40          2HB       PRO  40  -2.673  -0.746  -3.354
  127   2HB   PRO  40          1HB       PRO  40  -3.761   0.649  -3.086
  128   1HG   PRO  40          1HG       PRO  40  -0.726   0.651  -3.187
  129   2HG   PRO  40          2HG       PRO  40  -1.861   1.731  -4.059
  130   1HD   PRO  40          1HD       PRO  40  -0.656   2.425  -1.693
  131   2HD   PRO  40          2HD       PRO  40  -2.297   2.984  -2.123
  132    H    LYS  41           H        LYS  41  -3.044  -2.444  -1.578
  133    HA   LYS  41           HA       LYS  41  -1.362  -3.668   0.255
  134   1HB   LYS  41          1HB       LYS  41  -3.295  -4.574  -1.150
  135   2HB   LYS  41          2HB       LYS  41  -2.130  -4.840  -2.445
  136   1HG   LYS  41          1HG       LYS  41  -0.886  -6.424  -1.031
  137   2HG   LYS  41          2HG       LYS  41  -1.906  -6.021   0.365
  138   1HD   LYS  41          1HD       LYS  41  -3.885  -6.933  -0.809
  139   2HD   LYS  41          2HD       LYS  41  -2.877  -7.307  -2.228
  140   1HE   LYS  41          1HE       LYS  41  -1.472  -8.807  -0.832
  141   2HE   LYS  41          2HE       LYS  41  -2.471  -8.437   0.580
  142   1HZ   LYS  41          2HZ       LYS  41  -3.447  -9.775  -1.891
  143   2HZ   LYS  41          3HZ       LYS  41  -3.154 -10.519  -0.470
  144   3HZ   LYS  41          1HZ       LYS  41  -4.368  -9.437  -0.582
  145    H    VAL  42           H        VAL  42  -0.205  -2.112  -2.514
  146    HA   VAL  42           HA       VAL  42   2.302  -3.388  -3.018
  147    HB   VAL  42           HB       VAL  42   1.547  -0.434  -3.070
  148   1HG1  VAL  42          1HG1      VAL  42   3.829  -1.904  -4.448
  149   2HG1  VAL  42          2HG1      VAL  42   3.355  -0.221  -4.765
  150   3HG1  VAL  42          3HG1      VAL  42   3.980  -0.666  -3.178
  151   1HG2  VAL  42          2HG2      VAL  42   1.473  -2.533  -5.282
  152   2HG2  VAL  42          3HG2      VAL  42   0.062  -1.739  -4.550
  153   3HG2  VAL  42          1HG2      VAL  42   1.199  -0.793  -5.505
  154    H    CYS  43           H        CYS  43   1.271  -1.227  -0.381
  155    HA   CYS  43           HA       CYS  43   3.854  -1.529   1.042
  156   1HB   CYS  43          1HB       CYS  43   3.985   0.342  -0.652
  157   2HB   CYS  43          2HB       CYS  43   2.688   1.168   0.222
  158    H    PHE  44           H        PHE  44   3.218   0.678   2.735
  159    HA   PHE  44           HA       PHE  44   0.559   0.210   3.947
  160   1HB   PHE  44          1HB       PHE  44   1.327  -0.111   6.141
  161   2HB   PHE  44          2HB       PHE  44   2.267  -1.225   5.167
  162    HD1  PHE  44           HD1      PHE  44   2.344   1.586   7.464
  163    HD2  PHE  44           HD2      PHE  44   4.707  -0.582   4.575
  164    HE1  PHE  44           HE1      PHE  44   4.411   2.616   8.378
  165    HE2  PHE  44           HE2      PHE  44   6.768   0.452   5.495
  166    HZ   PHE  44           HZ       PHE  44   6.625   2.055   7.388
  167    H    LYS  45           H        LYS  45   3.260   2.343   3.280
  168    HA   LYS  45           HA       LYS  45   1.623   4.714   3.910
  169   1HB   LYS  45          1HB       LYS  45   2.655   4.076   6.086
  170   2HB   LYS  45          2HB       LYS  45   4.260   4.183   5.362
  171   1HG   LYS  45          1HG       LYS  45   3.890   6.614   4.937
  172   2HG   LYS  45          2HG       LYS  45   2.262   6.477   5.633
  173   1HD   LYS  45          1HD       LYS  45   3.261   5.767   7.799
  174   2HD   LYS  45          2HD       LYS  45   4.885   5.905   7.091
  175   1HE   LYS  45          1HE       LYS  45   4.473   8.320   6.644
  176   2HE   LYS  45          2HE       LYS  45   2.864   8.178   7.362
  177   1HZ   LYS  45          3HZ       LYS  45   3.936   7.573   9.472
  178   2HZ   LYS  45          1HZ       LYS  45   5.423   7.713   8.806
  179   3HZ   LYS  45          2HZ       LYS  45   4.473   9.028   8.968
  180    H    CYS  46           H        CYS  46   5.063   3.835   3.173
  181    HA   CYS  46           HA       CYS  46   5.520   6.336   1.898
  182   1HB   CYS  46          1HB       CYS  46   7.763   5.097   1.343
  183   2HB   CYS  46          2HB       CYS  46   7.347   5.576   2.984
  184    H    LYS  47           H        LYS  47   4.754   3.196   0.510
  185    HA   LYS  47           HA       LYS  47   4.335   2.502  -1.641
  186   1HB   LYS  47          1HB       LYS  47   2.308   3.561  -2.441
  187   2HB   LYS  47          2HB       LYS  47   2.320   3.347  -0.697
  188   1HG   LYS  47          1HG       LYS  47   2.912   5.747  -0.402
  189   2HG   LYS  47          2HG       LYS  47   2.839   5.979  -2.151
  190   1HD   LYS  47          1HD       LYS  47   0.484   5.489  -2.190
  191   2HD   LYS  47          2HD       LYS  47   0.488   4.911  -0.518
  192   1HE   LYS  47          1HE       LYS  47   1.251   7.761  -1.275
  193   2HE   LYS  47          2HE       LYS  47  -0.414   7.278  -0.936
  194   1HZ   LYS  47          2HZ       LYS  47   1.801   6.920   1.016
  195   2HZ   LYS  47          3HZ       LYS  47   0.715   8.152   1.053
  196   3HZ   LYS  47          1HZ       LYS  47   0.232   6.599   1.272
  197    H    GLN  48           H        GLN  48   6.795   4.121  -1.861
  198    HA   GLN  48           HA       GLN  48   6.690   5.575  -4.324
  199   1HB   GLN  48          1HB       GLN  48   9.059   4.241  -2.947
  200   2HB   GLN  48          2HB       GLN  48   9.182   5.401  -4.262
  201   1HG   GLN  48          1HG       GLN  48   8.112   5.940  -1.463
  202   2HG   GLN  48          2HG       GLN  48   9.625   6.502  -2.149
  203   1HE2  GLN  48          2HE2      GLN  48   6.297   7.278  -1.721
  204   2HE2  GLN  48          1HE2      GLN  48   6.287   8.693  -2.781
  205    HA   PRO  49           HA       PRO  49   6.278   2.881  -7.571
  206   1HB   PRO  49          2HB       PRO  49   8.883   3.836  -8.780
  207   2HB   PRO  49          1HB       PRO  49   7.290   3.616  -9.574
  208   1HG   PRO  49          1HG       PRO  49   8.048   6.076  -8.772
  209   2HG   PRO  49          2HG       PRO  49   6.379   5.511  -8.433
  210   1HD   PRO  49          1HD       PRO  49   8.749   5.615  -6.569
  211   2HD   PRO  49          2HD       PRO  49   7.042   6.052  -6.274
  212    H    GLY  50           H        GLY  50   9.421   2.255  -6.104
  213   1HA   GLY  50          2HA       GLY  50  10.606   0.222  -7.382
  214   2HA   GLY  50          1HA       GLY  50   9.146  -0.614  -6.853
  215    H    HIS  51           H        HIS  51   9.835   1.539  -4.401
  216    HA   HIS  51           HA       HIS  51  12.067   0.407  -3.075
  217   1HB   HIS  51          1HB       HIS  51  11.488   1.803  -1.297
  218   2HB   HIS  51          2HB       HIS  51  10.847   2.662  -2.689
  219    HD1  HIS  51           HD1      HIS  51   7.944   1.860  -3.037
  220    HD2  HIS  51           HD2      HIS  51   9.912   1.407   0.664
  221    HE1  HIS  51           HE1      HIS  51   6.154   1.309  -1.322
  222    H    PHE  52           H        PHE  52   8.735  -0.690  -3.150
  223    HA   PHE  52           HA       PHE  52   8.557  -1.925  -0.631
  224   1HB   PHE  52          1HB       PHE  52   6.650  -3.206  -1.742
  225   2HB   PHE  52          2HB       PHE  52   6.560  -1.461  -1.697
  226    HD1  PHE  52           HD1      PHE  52   6.575  -0.114  -3.709
  227    HD2  PHE  52           HD2      PHE  52   7.089  -4.395  -3.928
  228    HE1  PHE  52           HE1      PHE  52   6.223  -0.030  -6.154
  229    HE2  PHE  52           HE2      PHE  52   6.753  -4.299  -6.384
  230    HZ   PHE  52           HZ       PHE  52   6.324  -2.117  -7.505
  231    H    SER  53           H        SER  53   9.571  -3.381  -3.737
  232    HA   SER  53           HA       SER  53   9.961  -6.032  -2.832
  233   1HB   SER  53          1HB       SER  53  11.415  -4.529  -5.043
  234   2HB   SER  53          2HB       SER  53  11.327  -6.292  -4.859
  235    HG   SER  53           HG       SER  53   9.755  -5.524  -6.330
  236    H    LYS  54           H        LYS  54  11.711  -3.376  -1.740
  237    HA   LYS  54           HA       LYS  54  13.905  -5.124  -0.728
  238   1HB   LYS  54          1HB       LYS  54  15.562  -3.404  -1.177
  239   2HB   LYS  54          2HB       LYS  54  14.781  -3.940  -2.660
  240   1HG   LYS  54          1HG       LYS  54  13.407  -1.902  -2.737
  241   2HG   LYS  54          2HG       LYS  54  14.024  -1.391  -1.159
  242   1HD   LYS  54          1HD       LYS  54  15.138  -0.125  -2.861
  243   2HD   LYS  54          2HD       LYS  54  16.313  -1.223  -2.123
  244   1HE   LYS  54          1HE       LYS  54  16.029  -2.793  -4.046
  245   2HE   LYS  54          2HE       LYS  54  14.845  -1.693  -4.764
  246   1HZ   LYS  54          3HZ       LYS  54  16.614  -0.013  -4.921
  247   2HZ   LYS  54          1HZ       LYS  54  17.702  -1.037  -4.258
  248   3HZ   LYS  54          2HZ       LYS  54  17.055  -1.366  -5.717
  249    H    GLN  55           H        GLN  55  11.332  -3.585   0.356
  250    HA   GLN  55           HA       GLN  55  12.587  -3.044   2.968
  251   1HB   GLN  55          1HB       GLN  55  12.753  -0.878   1.700
  252   2HB   GLN  55          2HB       GLN  55  10.994  -0.856   1.557
  253   1HG   GLN  55          1HG       GLN  55  10.857  -0.878   4.090
  254   2HG   GLN  55          2HG       GLN  55  12.619  -0.792   4.144
  255   1HE2  GLN  55          1HE2      GLN  55   9.647   0.980   3.488
  256   2HE2  GLN  55          2HE2      GLN  55  10.408   2.563   3.374
  257    H    CYS  56           H        CYS  56   9.433  -2.460   1.317
  258    HA   CYS  56           HA       CYS  56   8.062  -3.081   3.832
  259   1HB   CYS  56          1HB       CYS  56   7.092  -1.844   1.223
  260   2HB   CYS  56          2HB       CYS  56   6.165  -1.961   2.726
  261    H    ARG  57           H        ARG  57   8.510  -4.700   0.819
  262    HA   ARG  57           HA       ARG  57   6.557  -6.831   1.558
  263   1HB   ARG  57          1HB       ARG  57   5.982  -4.906  -0.374
  264   2HB   ARG  57          2HB       ARG  57   6.758  -6.136  -1.346
  265   1HG   ARG  57          1HG       ARG  57   4.682  -7.036  -1.467
  266   2HG   ARG  57          2HG       ARG  57   5.009  -7.693   0.132
  267   1HD   ARG  57          1HD       ARG  57   3.486  -5.165  -0.598
  268   2HD   ARG  57          2HD       ARG  57   2.834  -6.630   0.146
  269    HE   ARG  57           HE       ARG  57   4.861  -5.531   1.856
  270   1HH1  ARG  57          2HH2      ARG  57   1.659  -4.608   0.793
  271   2HH1  ARG  57          1HH2      ARG  57   1.483  -3.478   2.111
  272   1HH2  ARG  57          1HH1      ARG  57   4.511  -4.237   3.526
  273   2HH2  ARG  57          2HH1      ARG  57   2.953  -3.456   3.762
  274    H    SER  58           H        SER  58   9.672  -6.248   1.074
  275    HA   SER  58           HA       SER  58  10.717  -8.232  -0.666
  276   1HB   SER  58          1HB       SER  58  12.762  -7.990   0.842
  277   2HB   SER  58          2HB       SER  58  12.169  -6.538   0.031
  278    HG   SER  58           HG       SER  58  11.558  -7.269   2.720

  No H/Q in entry =         278
  Start of MODEL   12
    1    H1   GLN  22           H3       GLN  22  -6.960   0.748  -5.686
    2    H2   GLN  22           H2       GLN  22  -6.879   0.274  -7.257
    3    H3   GLN  22           H1       GLN  22  -7.941  -0.450  -6.220
    4    HA   GLN  22           HA       GLN  22  -6.109  -1.936  -6.573
    5   1HB   GLN  22          1HB       GLN  22  -4.475   0.530  -5.867
    6   2HB   GLN  22          2HB       GLN  22  -3.883  -1.075  -5.474
    7   1HG   GLN  22          1HG       GLN  22  -2.881  -0.569  -7.502
    8   2HG   GLN  22          2HG       GLN  22  -4.116  -1.758  -7.880
    9   1HE2  GLN  22          2HE2      GLN  22  -2.917  -0.090  -9.868
   10   2HE2  GLN  22          1HE2      GLN  22  -4.169   1.003 -10.450
   11    H    THR  23           H        THR  23  -6.202  -3.447  -4.997
   12    HA   THR  23           HA       THR  23  -7.727  -3.134  -2.772
   13    HB   THR  23           HB       THR  23  -5.501  -5.179  -2.997
   14    HG1  THR  23           HG1      THR  23  -7.043  -6.339  -4.216
   15   1HG2  THR  23          3HG2      THR  23  -8.321  -5.371  -1.842
   16   2HG2  THR  23          1HG2      THR  23  -7.138  -6.689  -1.934
   17   3HG2  THR  23          2HG2      THR  23  -6.821  -5.308  -0.881
   18    H    CYS  24           H        CYS  24  -7.610  -2.496  -0.737
   19    HA   CYS  24           HA       CYS  24  -5.620  -0.957   0.392
   20   1HB   CYS  24          1HB       CYS  24  -8.051  -1.333   1.082
   21   2HB   CYS  24          2HB       CYS  24  -7.506  -2.779   1.925
   22    H    TYR  25           H        TYR  25  -3.971  -1.215   1.878
   23    HA   TYR  25           HA       TYR  25  -2.587  -3.734   2.175
   24   1HB   TYR  25          1HB       TYR  25  -1.021  -2.594   3.381
   25   2HB   TYR  25          2HB       TYR  25  -1.624  -1.332   2.331
   26    HD1  TYR  25           HD1      TYR  25  -0.451  -1.856   5.494
   27    HD2  TYR  25           HD2      TYR  25  -3.933  -0.154   3.590
   28    HE1  TYR  25           HE1      TYR  25  -0.880  -0.458   7.507
   29    HE2  TYR  25           HE2      TYR  25  -4.382   1.182   5.612
   30    HH   TYR  25           HH       TYR  25  -2.270   1.072   8.503
   31    H    ASN  26           H        ASN  26  -5.367  -2.521   3.796
   32    HA   ASN  26           HA       ASN  26  -5.068  -4.565   5.966
   33   1HB   ASN  26          1HB       ASN  26  -4.282  -2.321   6.715
   34   2HB   ASN  26          2HB       ASN  26  -5.859  -1.641   6.315
   35   1HD2  ASN  26          1HD2      ASN  26  -4.189  -3.998   8.434
   36   2HD2  ASN  26          2HD2      ASN  26  -5.427  -3.959   9.680
   37    H    CYS  27           H        CYS  27  -7.428  -2.417   4.261
   38    HA   CYS  27           HA       CYS  27  -9.714  -3.643   5.469
   39   1HB   CYS  27          1HB       CYS  27  -9.522  -1.958   2.938
   40   2HB   CYS  27          2HB       CYS  27 -10.980  -2.288   3.871
   41    H    GLY  28           H        GLY  28  -7.755  -4.799   2.875
   42   1HA   GLY  28          2HA       GLY  28  -9.269  -7.126   2.320
   43   2HA   GLY  28          1HA       GLY  28  -7.983  -6.464   1.305
   44    H    LYS  29           H        LYS  29  -9.369  -3.961   0.743
   45    HA   LYS  29           HA       LYS  29 -11.796  -4.791  -0.795
   46   1HB   LYS  29          1HB       LYS  29 -12.214  -3.531   1.274
   47   2HB   LYS  29          2HB       LYS  29 -11.177  -2.237   0.712
   48   1HG   LYS  29          1HG       LYS  29 -13.432  -1.550   0.392
   49   2HG   LYS  29          2HG       LYS  29 -12.774  -1.853  -1.215
   50   1HD   LYS  29          1HD       LYS  29 -13.928  -4.053  -1.283
   51   2HD   LYS  29          2HD       LYS  29 -14.500  -3.808   0.382
   52   1HE   LYS  29          1HE       LYS  29 -15.733  -1.775  -0.352
   53   2HE   LYS  29          2HE       LYS  29 -15.184  -2.037  -2.010
   54   1HZ   LYS  29          1HZ       LYS  29 -16.888  -3.920  -0.463
   55   2HZ   LYS  29          2HZ       LYS  29 -17.410  -2.943  -1.659
   56   3HZ   LYS  29          3HZ       LYS  29 -16.386  -4.164  -1.999
   57    HA   PRO  30           HA       PRO  30  -9.185  -3.666  -4.314
   58   1HB   PRO  30          2HB       PRO  30 -11.903  -3.633  -5.634
   59   2HB   PRO  30          1HB       PRO  30 -10.351  -4.281  -6.259
   60   1HG   PRO  30          1HG       PRO  30 -12.153  -5.959  -5.160
   61   2HG   PRO  30          2HG       PRO  30 -10.419  -6.114  -4.720
   62   1HD   PRO  30          1HD       PRO  30 -12.652  -4.818  -3.158
   63   2HD   PRO  30          2HD       PRO  30 -11.318  -5.867  -2.588
   64    H    GLY  31           H        GLY  31 -12.084  -1.718  -3.623
   65   1HA   GLY  31          2HA       GLY  31 -12.708   0.432  -4.141
   66   2HA   GLY  31          1HA       GLY  31 -11.478   0.450  -5.403
   67    H    HIS  32           H        HIS  32  -9.232  -0.006  -3.542
   68    HA   HIS  32           HA       HIS  32  -9.232   2.474  -1.906
   69   1HB   HIS  32          1HB       HIS  32  -7.843  -0.163  -1.701
   70   2HB   HIS  32          2HB       HIS  32  -6.983   1.259  -1.120
   71    HD1  HIS  32           HD1      HIS  32 -10.442  -0.402  -0.553
   72    HD2  HIS  32           HD2      HIS  32  -7.541   2.013   1.271
   73    HE1  HIS  32           HE1      HIS  32 -11.245  -0.008   1.855
   74    H    LEU  33           H        LEU  33  -7.403   3.723  -1.739
   75    HA   LEU  33           HA       LEU  33  -5.593   4.176  -3.999
   76   1HB   LEU  33          1HB       LEU  33  -7.910   6.032  -3.228
   77   2HB   LEU  33          2HB       LEU  33  -6.552   6.548  -4.214
   78    HG   LEU  33           HG       LEU  33  -8.566   4.416  -5.033
   79   1HD1  LEU  33          2HD1      LEU  33  -9.538   6.665  -4.918
   80   2HD1  LEU  33          3HD1      LEU  33  -8.217   7.304  -5.921
   81   3HD1  LEU  33          1HD1      LEU  33  -9.367   6.127  -6.595
   82   1HD2  LEU  33          2HD2      LEU  33  -6.309   5.772  -6.587
   83   2HD2  LEU  33          3HD2      LEU  33  -6.366   4.058  -6.117
   84   3HD2  LEU  33          1HD2      LEU  33  -7.535   4.688  -7.278
   85    H    SER  34           H        SER  34  -4.306   6.202  -3.485
   86    HA   SER  34           HA       SER  34  -3.084   6.303  -0.993
   87   1HB   SER  34          1HB       SER  34  -3.406   8.520  -3.054
   88   2HB   SER  34          2HB       SER  34  -2.165   8.464  -1.788
   89    HG   SER  34           HG       SER  34  -1.485   7.645  -3.887
   90    H    SER  35           H        SER  35  -6.188   7.616  -1.654
   91    HA   SER  35           HA       SER  35  -6.159   9.241   0.864
   92   1HB   SER  35          1HB       SER  35  -7.917   9.600  -1.586
   93   2HB   SER  35          2HB       SER  35  -7.898  10.626  -0.144
   94    HG   SER  35           HG       SER  35  -5.767  11.233  -0.649
   95    H    GLN  36           H        GLN  36  -7.147   6.276  -0.144
   96    HA   GLN  36           HA       GLN  36  -9.775   6.302   1.273
   97   1HB   GLN  36          1HB       GLN  36  -9.325   5.139  -1.020
   98   2HB   GLN  36          2HB       GLN  36  -8.447   3.944  -0.075
   99   1HG   GLN  36          1HG       GLN  36 -10.581   2.998  -0.228
  100   2HG   GLN  36          2HG       GLN  36 -10.671   3.780   1.340
  101   1HE2  GLN  36          2HE2      GLN  36 -11.888   3.725  -1.981
  102   2HE2  GLN  36          1HE2      GLN  36 -13.085   4.990  -1.733
  103    H    CYS  37           H        CYS  37  -6.542   4.829   1.365
  104    HA   CYS  37           HA       CYS  37  -6.499   4.905   4.275
  105   1HB   CYS  37          1HB       CYS  37  -6.084   2.323   2.708
  106   2HB   CYS  37          2HB       CYS  37  -5.248   2.600   4.213
  107    H    ARG  38           H        ARG  38  -4.108   4.259   4.930
  108    HA   ARG  38           HA       ARG  38  -2.308   6.161   3.870
  109   1HB   ARG  38          1HB       ARG  38  -1.738   3.607   5.446
  110   2HB   ARG  38          2HB       ARG  38  -0.545   4.832   5.047
  111   1HG   ARG  38          1HG       ARG  38  -0.987   5.579   7.078
  112   2HG   ARG  38          2HG       ARG  38  -2.241   6.496   6.263
  113   1HD   ARG  38          1HD       ARG  38  -2.749   3.764   7.518
  114   2HD   ARG  38          2HD       ARG  38  -2.741   5.228   8.486
  115    HE   ARG  38           HE       ARG  38  -4.557   6.117   6.994
  116   1HH1  ARG  38          2HH2      ARG  38  -4.343   2.633   7.568
  117   2HH1  ARG  38          1HH2      ARG  38  -6.054   2.440   7.277
  118   1HH2  ARG  38          1HH1      ARG  38  -6.725   5.733   6.724
  119   2HH2  ARG  38          2HH1      ARG  38  -7.299   4.091   6.677
  120    H    ALA  39           H        ALA  39  -2.670   2.752   2.871
  121    HA   ALA  39           HA       ALA  39  -1.507   3.407   0.300
  122   1HB   ALA  39          3HB       ALA  39   0.568   2.984   1.610
  123   2HB   ALA  39          1HB       ALA  39  -0.086   1.408   2.125
  124   3HB   ALA  39          2HB       ALA  39   0.320   1.691   0.428
  125    HA   PRO  40           HA       PRO  40  -3.676  -0.533  -0.749
  126   1HB   PRO  40          2HB       PRO  40  -2.558  -1.116  -3.151
  127   2HB   PRO  40          1HB       PRO  40  -3.710   0.239  -2.953
  128   1HG   PRO  40          1HG       PRO  40  -0.678   0.371  -2.983
  129   2HG   PRO  40          2HG       PRO  40  -1.836   1.372  -3.914
  130   1HD   PRO  40          1HD       PRO  40  -0.720   2.188  -1.546
  131   2HD   PRO  40          2HD       PRO  40  -2.374   2.662  -2.028
  132    H    LYS  41           H        LYS  41  -2.919  -2.816  -1.193
  133    HA   LYS  41           HA       LYS  41  -0.996  -3.658   0.694
  134   1HB   LYS  41          1HB       LYS  41  -1.445  -5.896  -0.042
  135   2HB   LYS  41          2HB       LYS  41  -2.945  -4.980  -0.021
  136   1HG   LYS  41          1HG       LYS  41  -2.846  -4.723  -2.491
  137   2HG   LYS  41          2HG       LYS  41  -1.308  -5.608  -2.522
  138   1HD   LYS  41          1HD       LYS  41  -2.429  -7.591  -1.529
  139   2HD   LYS  41          2HD       LYS  41  -3.976  -6.718  -1.538
  140   1HE   LYS  41          1HE       LYS  41  -3.860  -6.513  -4.002
  141   2HE   LYS  41          2HE       LYS  41  -2.278  -7.301  -4.010
  142   1HZ   LYS  41          1HZ       LYS  41  -4.796  -8.600  -3.101
  143   2HZ   LYS  41          2HZ       LYS  41  -4.059  -8.874  -4.530
  144   3HZ   LYS  41          3HZ       LYS  41  -3.328  -9.313  -3.142
  145    H    VAL  42           H        VAL  42  -0.136  -2.387  -2.219
  146    HA   VAL  42           HA       VAL  42   2.366  -3.684  -2.807
  147    HB   VAL  42           HB       VAL  42   1.562  -0.747  -3.004
  148   1HG1  VAL  42          1HG1      VAL  42   3.778  -2.290  -4.405
  149   2HG1  VAL  42          2HG1      VAL  42   3.279  -0.631  -4.802
  150   3HG1  VAL  42          3HG1      VAL  42   3.986  -0.975  -3.225
  151   1HG2  VAL  42          1HG2      VAL  42   1.385  -2.981  -5.074
  152   2HG2  VAL  42          2HG2      VAL  42   0.010  -2.143  -4.320
  153   3HG2  VAL  42          3HG2      VAL  42   1.091  -1.259  -5.393
  154    H    CYS  43           H        CYS  43   1.351  -1.425  -0.259
  155    HA   CYS  43           HA       CYS  43   3.983  -1.568   1.101
  156   1HB   CYS  43          1HB       CYS  43   3.946   0.253  -0.655
  157   2HB   CYS  43          2HB       CYS  43   2.636   1.031   0.242
  158    H    PHE  44           H        PHE  44   3.361   0.574   2.797
  159    HA   PHE  44           HA       PHE  44   0.737   0.072   4.085
  160   1HB   PHE  44          1HB       PHE  44   1.582  -0.154   6.256
  161   2HB   PHE  44          2HB       PHE  44   2.562  -1.241   5.293
  162    HD1  PHE  44           HD1      PHE  44   2.526   1.653   7.491
  163    HD2  PHE  44           HD2      PHE  44   4.946  -0.481   4.624
  164    HE1  PHE  44           HE1      PHE  44   4.546   2.837   8.314
  165    HE2  PHE  44           HE2      PHE  44   6.961   0.708   5.452
  166    HZ   PHE  44           HZ       PHE  44   6.766   2.371   7.291
  167    H    LYS  45           H        LYS  45   3.277   2.303   3.186
  168    HA   LYS  45           HA       LYS  45   1.526   4.589   3.758
  169   1HB   LYS  45          1HB       LYS  45   2.673   4.133   5.945
  170   2HB   LYS  45          2HB       LYS  45   4.233   4.391   5.164
  171   1HG   LYS  45          1HG       LYS  45   3.578   6.736   4.646
  172   2HG   LYS  45          2HG       LYS  45   1.978   6.444   5.364
  173   1HD   LYS  45          1HD       LYS  45   3.066   5.959   7.553
  174   2HD   LYS  45          2HD       LYS  45   4.656   6.276   6.824
  175   1HE   LYS  45          1HE       LYS  45   3.935   8.593   6.277
  176   2HE   LYS  45          2HE       LYS  45   2.353   8.275   6.998
  177   1HZ   LYS  45          3HZ       LYS  45   3.476   7.913   9.136
  178   2HZ   LYS  45          1HZ       LYS  45   4.937   8.214   8.468
  179   3HZ   LYS  45          2HZ       LYS  45   3.823   9.400   8.567
  180    H    CYS  46           H        CYS  46   4.998   3.900   2.963
  181    HA   CYS  46           HA       CYS  46   5.264   6.349   1.551
  182   1HB   CYS  46          1HB       CYS  46   7.533   5.166   0.916
  183   2HB   CYS  46          2HB       CYS  46   7.194   5.763   2.536
  184    H    LYS  47           H        LYS  47   4.560   3.130   0.342
  185    HA   LYS  47           HA       LYS  47   4.076   2.314  -1.751
  186   1HB   LYS  47          1HB       LYS  47   1.980   3.257  -2.510
  187   2HB   LYS  47          2HB       LYS  47   2.074   3.151  -0.758
  188   1HG   LYS  47          1HG       LYS  47   2.608   5.587  -0.646
  189   2HG   LYS  47          2HG       LYS  47   2.430   5.701  -2.398
  190   1HD   LYS  47          1HD       LYS  47   0.093   5.151  -2.272
  191   2HD   LYS  47          2HD       LYS  47   0.212   4.663  -0.574
  192   1HE   LYS  47          1HE       LYS  47   0.839   7.487  -1.520
  193   2HE   LYS  47          2HE       LYS  47  -0.787   6.974  -1.061
  194   1HZ   LYS  47          3HZ       LYS  47   1.540   6.772   0.780
  195   2HZ   LYS  47          1HZ       LYS  47   0.434   7.988   0.811
  196   3HZ   LYS  47          2HZ       LYS  47  -0.004   6.443   1.139
  197    H    GLN  48           H        GLN  48   6.463   4.016  -2.152
  198    HA   GLN  48           HA       GLN  48   6.197   5.326  -4.682
  199   1HB   GLN  48          1HB       GLN  48   8.677   4.158  -3.350
  200   2HB   GLN  48          2HB       GLN  48   8.692   5.249  -4.729
  201   1HG   GLN  48          1HG       GLN  48   7.731   5.897  -1.913
  202   2HG   GLN  48          2HG       GLN  48   9.184   6.480  -2.698
  203   1HE2  GLN  48          2HE2      GLN  48   5.846   7.141  -2.157
  204   2HE2  GLN  48          1HE2      GLN  48   5.729   8.497  -3.285
  205    HA   PRO  49           HA       PRO  49   5.715   2.445  -7.750
  206   1HB   PRO  49          2HB       PRO  49   8.213   3.433  -9.143
  207   2HB   PRO  49          1HB       PRO  49   6.596   3.102  -9.841
  208   1HG   PRO  49          1HG       PRO  49   7.284   5.631  -9.213
  209   2HG   PRO  49          2HG       PRO  49   5.659   5.019  -8.761
  210   1HD   PRO  49          1HD       PRO  49   8.105   5.336  -7.025
  211   2HD   PRO  49          2HD       PRO  49   6.392   5.704  -6.671
  212    H    GLY  50           H        GLY  50   8.977   2.044  -6.457
  213   1HA   GLY  50          2HA       GLY  50  10.159  -0.008  -7.704
  214   2HA   GLY  50          1HA       GLY  50   8.793  -0.879  -7.008
  215    H    HIS  51           H        HIS  51   9.470   1.393  -4.710
  216    HA   HIS  51           HA       HIS  51  11.901   0.515  -3.526
  217   1HB   HIS  51          1HB       HIS  51  11.336   1.945  -1.760
  218   2HB   HIS  51          2HB       HIS  51  10.562   2.692  -3.148
  219    HD1  HIS  51           HD1      HIS  51   7.693   1.727  -3.271
  220    HD2  HIS  51           HD2      HIS  51   9.896   1.609   0.324
  221    HE1  HIS  51           HE1      HIS  51   6.032   1.250  -1.416
  222    H    PHE  52           H        PHE  52   8.660  -0.773  -3.255
  223    HA   PHE  52           HA       PHE  52   8.676  -1.714  -0.640
  224   1HB   PHE  52          1HB       PHE  52   6.754  -3.154  -1.433
  225   2HB   PHE  52          2HB       PHE  52   6.625  -1.434  -1.710
  226    HD1  PHE  52           HD1      PHE  52   6.569  -0.484  -3.953
  227    HD2  PHE  52           HD2      PHE  52   7.099  -4.726  -3.363
  228    HE1  PHE  52           HE1      PHE  52   6.122  -0.875  -6.353
  229    HE2  PHE  52           HE2      PHE  52   6.666  -5.107  -5.775
  230    HZ   PHE  52           HZ       PHE  52   6.182  -3.182  -7.278
  231    H    SER  53           H        SER  53   9.636  -3.551  -3.559
  232    HA   SER  53           HA       SER  53  10.130  -6.044  -2.333
  233   1HB   SER  53          1HB       SER  53  11.593  -4.807  -4.694
  234   2HB   SER  53          2HB       SER  53  11.466  -6.536  -4.314
  235    HG   SER  53           HG       SER  53   9.936  -5.893  -5.894
  236    H    LYS  54           H        LYS  54  11.796  -3.205  -1.617
  237    HA   LYS  54           HA       LYS  54  14.205  -4.674  -0.618
  238   1HB   LYS  54          1HB       LYS  54  14.200  -1.805  -1.642
  239   2HB   LYS  54          2HB       LYS  54  15.574  -2.777  -1.140
  240   1HG   LYS  54          1HG       LYS  54  15.872  -3.065  -3.348
  241   2HG   LYS  54          2HG       LYS  54  14.713  -4.375  -3.142
  242   1HD   LYS  54          1HD       LYS  54  12.877  -2.704  -3.800
  243   2HD   LYS  54          2HD       LYS  54  14.164  -1.523  -4.102
  244   1HE   LYS  54          1HE       LYS  54  15.192  -3.172  -5.731
  245   2HE   LYS  54          2HE       LYS  54  13.787  -4.216  -5.486
  246   1HZ   LYS  54          2HZ       LYS  54  12.408  -2.258  -6.235
  247   2HZ   LYS  54          3HZ       LYS  54  13.782  -1.486  -6.646
  248   3HZ   LYS  54          1HZ       LYS  54  13.382  -2.870  -7.411
  249    H    GLN  55           H        GLN  55  11.480  -3.330   0.526
  250    HA   GLN  55           HA       GLN  55  12.724  -2.698   3.113
  251   1HB   GLN  55          1HB       GLN  55  12.804  -0.529   1.874
  252   2HB   GLN  55          2HB       GLN  55  11.055  -0.588   1.672
  253   1HG   GLN  55          1HG       GLN  55  10.823  -0.587   4.194
  254   2HG   GLN  55          2HG       GLN  55  12.579  -0.446   4.315
  255   1HE2  GLN  55          1HE2      GLN  55   9.587   1.214   3.387
  256   2HE2  GLN  55          2HE2      GLN  55  10.298   2.824   3.329
  257    H    CYS  56           H        CYS  56   9.536  -2.136   1.538
  258    HA   CYS  56           HA       CYS  56   8.199  -2.790   4.017
  259   1HB   CYS  56          1HB       CYS  56   7.139  -1.864   1.312
  260   2HB   CYS  56          2HB       CYS  56   6.245  -1.868   2.842
  261    H    ARG  57           H        ARG  57   8.797  -4.582   1.136
  262    HA   ARG  57           HA       ARG  57   6.902  -6.752   1.905
  263   1HB   ARG  57          1HB       ARG  57   6.273  -4.875  -0.040
  264   2HB   ARG  57          2HB       ARG  57   7.113  -6.060  -1.009
  265   1HG   ARG  57          1HG       ARG  57   5.087  -7.068  -1.153
  266   2HG   ARG  57          2HG       ARG  57   5.415  -7.695   0.457
  267   1HD   ARG  57          1HD       ARG  57   3.784  -5.252  -0.330
  268   2HD   ARG  57          2HD       ARG  57   3.199  -6.732   0.443
  269    HE   ARG  57           HE       ARG  57   5.151  -5.509   2.146
  270   1HH1  ARG  57          2HH1      ARG  57   1.917  -4.756   1.038
  271   2HH1  ARG  57          1HH1      ARG  57   1.691  -3.582   2.312
  272   1HH2  ARG  57          1HH2      ARG  57   4.740  -4.176   3.769
  273   2HH2  ARG  57          2HH2      ARG  57   3.153  -3.447   3.969
  274    H    SER  58           H        SER  58   9.938  -6.272   1.772
  275    HA   SER  58           HA       SER  58  11.341  -7.765  -0.062
  276   1HB   SER  58          1HB       SER  58  11.873  -7.678   2.925
  277   2HB   SER  58          2HB       SER  58  13.051  -8.016   1.642
  278    HG   SER  58           HG       SER  58  13.080  -5.802   2.342

  No H/Q in entry =         278
  Start of MODEL   13
    1    H1   GLN  22           H1       GLN  22  -6.979   0.681  -5.707
    2    H2   GLN  22           H3       GLN  22  -7.045   0.164  -7.270
    3    H3   GLN  22           H2       GLN  22  -8.085  -0.439  -6.149
    4    HA   GLN  22           HA       GLN  22  -6.431  -2.070  -6.595
    5   1HB   GLN  22          1HB       GLN  22  -4.663  -0.500  -7.345
    6   2HB   GLN  22          2HB       GLN  22  -4.461   0.076  -5.692
    7   1HG   GLN  22          1HG       GLN  22  -2.682  -1.468  -6.280
    8   2HG   GLN  22          2HG       GLN  22  -3.653  -2.164  -4.993
    9   1HE2  GLN  22          1HE2      GLN  22  -2.124  -2.980  -7.866
   10   2HE2  GLN  22          2HE2      GLN  22  -3.139  -4.357  -8.281
   11    H    THR  23           H        THR  23  -6.263  -3.587  -4.982
   12    HA   THR  23           HA       THR  23  -7.761  -3.270  -2.710
   13    HB   THR  23           HB       THR  23  -5.501  -5.271  -3.011
   14    HG1  THR  23           HG1      THR  23  -7.045  -6.484  -4.109
   15   1HG2  THR  23          3HG2      THR  23  -8.204  -5.418  -1.594
   16   2HG2  THR  23          1HG2      THR  23  -7.080  -6.778  -1.799
   17   3HG2  THR  23          2HG2      THR  23  -6.609  -5.400  -0.801
   18    H    CYS  24           H        CYS  24  -7.581  -2.679  -0.663
   19    HA   CYS  24           HA       CYS  24  -5.625  -0.997   0.352
   20   1HB   CYS  24          1HB       CYS  24  -8.016  -1.455   1.111
   21   2HB   CYS  24          2HB       CYS  24  -7.400  -2.876   1.948
   22    H    TYR  25           H        TYR  25  -3.976  -1.169   1.901
   23    HA   TYR  25           HA       TYR  25  -2.460  -3.620   2.192
   24   1HB   TYR  25          1HB       TYR  25  -0.969  -2.420   3.421
   25   2HB   TYR  25          2HB       TYR  25  -1.603  -1.183   2.363
   26    HD1  TYR  25           HD1      TYR  25  -0.511  -1.748   5.573
   27    HD2  TYR  25           HD2      TYR  25  -3.919  -0.019   3.565
   28    HE1  TYR  25           HE1      TYR  25  -0.998  -0.364   7.579
   29    HE2  TYR  25           HE2      TYR  25  -4.429   1.311   5.592
   30    HH   TYR  25           HH       TYR  25  -2.421   1.158   8.541
   31    H    ASN  26           H        ASN  26  -5.288  -2.511   3.757
   32    HA   ASN  26           HA       ASN  26  -4.920  -4.371   6.093
   33   1HB   ASN  26          1HB       ASN  26  -4.410  -2.092   6.760
   34   2HB   ASN  26          2HB       ASN  26  -5.853  -1.465   5.970
   35   1HD2  ASN  26          2HD2      ASN  26  -7.901  -1.648   7.031
   36   2HD2  ASN  26          1HD2      ASN  26  -7.985  -2.194   8.698
   37    H    CYS  27           H        CYS  27  -7.378  -2.473   4.269
   38    HA   CYS  27           HA       CYS  27  -9.556  -3.747   5.605
   39   1HB   CYS  27          1HB       CYS  27  -9.542  -1.947   3.148
   40   2HB   CYS  27          2HB       CYS  27 -10.897  -2.235   4.246
   41    H    GLY  28           H        GLY  28  -7.867  -4.679   2.736
   42   1HA   GLY  28          2HA       GLY  28  -9.494  -6.974   2.209
   43   2HA   GLY  28          1HA       GLY  28  -8.168  -6.372   1.217
   44    H    LYS  29           H        LYS  29 -10.171  -3.776   1.256
   45    HA   LYS  29           HA       LYS  29 -12.168  -4.620  -0.765
   46   1HB   LYS  29          1HB       LYS  29 -11.605  -2.132   0.824
   47   2HB   LYS  29          2HB       LYS  29 -12.436  -1.964  -0.713
   48   1HG   LYS  29          1HG       LYS  29 -14.048  -2.020   0.994
   49   2HG   LYS  29          2HG       LYS  29 -14.230  -3.477   0.029
   50   1HD   LYS  29          1HD       LYS  29 -12.643  -3.505   2.623
   51   2HD   LYS  29          2HD       LYS  29 -14.407  -3.555   2.646
   52   1HE   LYS  29          1HE       LYS  29 -14.461  -5.583   1.300
   53   2HE   LYS  29          2HE       LYS  29 -12.705  -5.558   1.112
   54   1HZ   LYS  29          2HZ       LYS  29 -14.116  -5.864   3.706
   55   2HZ   LYS  29          3HZ       LYS  29 -13.367  -7.067   2.891
   56   3HZ   LYS  29          1HZ       LYS  29 -12.488  -5.829   3.509
   57    HA   PRO  30           HA       PRO  30  -9.275  -3.801  -4.190
   58   1HB   PRO  30          2HB       PRO  30 -11.915  -3.717  -5.647
   59   2HB   PRO  30          1HB       PRO  30 -10.376  -4.493  -6.136
   60   1HG   PRO  30          1HG       PRO  30 -12.366  -5.989  -5.087
   61   2HG   PRO  30          2HG       PRO  30 -10.674  -6.250  -4.540
   62   1HD   PRO  30          1HD       PRO  30 -12.876  -4.690  -3.168
   63   2HD   PRO  30          2HD       PRO  30 -11.701  -5.854  -2.480
   64    H    GLY  31           H        GLY  31 -12.152  -1.817  -3.558
   65   1HA   GLY  31          2HA       GLY  31 -12.763   0.329  -4.109
   66   2HA   GLY  31          1HA       GLY  31 -11.507   0.341  -5.346
   67    H    HIS  32           H        HIS  32  -9.287  -0.113  -3.472
   68    HA   HIS  32           HA       HIS  32  -9.305   2.361  -1.826
   69   1HB   HIS  32          1HB       HIS  32  -7.874  -0.254  -1.640
   70   2HB   HIS  32          2HB       HIS  32  -7.023   1.182  -1.079
   71    HD1  HIS  32           HD1      HIS  32 -10.457  -0.511  -0.449
   72    HD2  HIS  32           HD2      HIS  32  -7.552   1.936   1.321
   73    HE1  HIS  32           HE1      HIS  32 -11.224  -0.115   1.973
   74    H    LEU  33           H        LEU  33  -7.494   3.639  -1.683
   75    HA   LEU  33           HA       LEU  33  -5.736   4.138  -3.977
   76   1HB   LEU  33          1HB       LEU  33  -8.034   5.976  -3.111
   77   2HB   LEU  33          2HB       LEU  33  -6.717   6.493  -4.150
   78    HG   LEU  33           HG       LEU  33  -8.760   4.359  -4.891
   79   1HD1  LEU  33          1HD1      LEU  33  -9.738   6.603  -4.722
   80   2HD1  LEU  33          2HD1      LEU  33  -8.468   7.252  -5.784
   81   3HD1  LEU  33          3HD1      LEU  33  -9.642   6.070  -6.407
   82   1HD2  LEU  33          2HD2      LEU  33  -6.590   5.740  -6.542
   83   2HD2  LEU  33          3HD2      LEU  33  -6.602   4.026  -6.069
   84   3HD2  LEU  33          1HD2      LEU  33  -7.832   4.639  -7.176
   85    H    SER  34           H        SER  34  -4.411   6.124  -3.456
   86    HA   SER  34           HA       SER  34  -3.217   6.231  -0.933
   87   1HB   SER  34          1HB       SER  34  -3.452   8.421  -3.036
   88   2HB   SER  34          2HB       SER  34  -2.238   8.356  -1.745
   89    HG   SER  34           HG       SER  34  -1.551   7.498  -3.835
   90    H    SER  35           H        SER  35  -6.283   7.598  -1.716
   91    HA   SER  35           HA       SER  35  -6.307   9.348   0.701
   92   1HB   SER  35          1HB       SER  35  -8.275  10.388  -0.399
   93   2HB   SER  35          2HB       SER  35  -6.795  10.506  -1.368
   94    HG   SER  35           HG       SER  35  -8.622   9.829  -2.613
   95    H    GLN  36           H        GLN  36  -7.345   6.271  -0.303
   96    HA   GLN  36           HA       GLN  36  -9.820   6.230   1.330
   97   1HB   GLN  36          1HB       GLN  36  -9.400   5.022  -0.966
   98   2HB   GLN  36          2HB       GLN  36  -8.486   3.866  -0.006
   99   1HG   GLN  36          1HG       GLN  36 -10.612   2.895  -0.098
  100   2HG   GLN  36          2HG       GLN  36 -10.673   3.707   1.458
  101   1HE2  GLN  36          2HE2      GLN  36 -11.952   3.592  -1.847
  102   2HE2  GLN  36          1HE2      GLN  36 -13.163   4.841  -1.587
  103    H    CYS  37           H        CYS  37  -6.528   4.901   1.300
  104    HA   CYS  37           HA       CYS  37  -6.364   4.901   4.223
  105   1HB   CYS  37          1HB       CYS  37  -5.956   2.395   2.534
  106   2HB   CYS  37          2HB       CYS  37  -5.063   2.634   4.010
  107    H    ARG  38           H        ARG  38  -3.999   4.386   4.801
  108    HA   ARG  38           HA       ARG  38  -2.210   6.255   3.636
  109   1HB   ARG  38          1HB       ARG  38  -1.733   3.814   5.390
  110   2HB   ARG  38          2HB       ARG  38  -0.472   4.973   4.977
  111   1HG   ARG  38          1HG       ARG  38  -1.136   6.472   6.482
  112   2HG   ARG  38          2HG       ARG  38  -2.815   6.408   5.978
  113   1HD   ARG  38          1HD       ARG  38  -1.476   4.399   7.839
  114   2HD   ARG  38          2HD       ARG  38  -2.432   5.772   8.381
  115    HE   ARG  38           HE       ARG  38  -3.407   3.225   7.443
  116   1HH1  ARG  38          2HH1      ARG  38  -4.394   6.591   7.670
  117   2HH1  ARG  38          1HH1      ARG  38  -6.083   6.187   7.561
  118   1HH2  ARG  38          1HH2      ARG  38  -5.563   2.804   7.266
  119   2HH2  ARG  38          2HH2      ARG  38  -6.717   4.100   7.272
  120    H    ALA  39           H        ALA  39  -2.612   2.820   2.775
  121    HA   ALA  39           HA       ALA  39  -1.414   3.385   0.202
  122   1HB   ALA  39          2HB       ALA  39   0.645   2.941   1.527
  123   2HB   ALA  39          3HB       ALA  39  -0.046   1.387   2.063
  124   3HB   ALA  39          1HB       ALA  39   0.372   1.638   0.364
  125    HA   PRO  40           HA       PRO  40  -3.662  -0.527  -0.773
  126   1HB   PRO  40          2HB       PRO  40  -2.553  -1.165  -3.169
  127   2HB   PRO  40          1HB       PRO  40  -3.687   0.207  -2.987
  128   1HG   PRO  40          1HG       PRO  40  -0.654   0.284  -3.036
  129   2HG   PRO  40          2HG       PRO  40  -1.799   1.299  -3.967
  130   1HD   PRO  40          1HD       PRO  40  -0.647   2.115  -1.617
  131   2HD   PRO  40          2HD       PRO  40  -2.293   2.619  -2.092
  132    H    LYS  41           H        LYS  41  -2.931  -2.817  -1.332
  133    HA   LYS  41           HA       LYS  41  -1.139  -3.872   0.541
  134   1HB   LYS  41          1HB       LYS  41  -3.022  -4.845  -1.321
  135   2HB   LYS  41          2HB       LYS  41  -1.535  -5.636  -1.791
  136   1HG   LYS  41          1HG       LYS  41  -2.806  -5.676   0.984
  137   2HG   LYS  41          2HG       LYS  41  -2.902  -6.953  -0.227
  138   1HD   LYS  41          1HD       LYS  41  -0.408  -7.231  -0.076
  139   2HD   LYS  41          2HD       LYS  41  -0.395  -6.035   1.244
  140   1HE   LYS  41          1HE       LYS  41  -1.983  -7.444   2.535
  141   2HE   LYS  41          2HE       LYS  41  -1.979  -8.641   1.233
  142   1HZ   LYS  41          3HZ       LYS  41   0.408  -8.966   1.630
  143   2HZ   LYS  41          1HZ       LYS  41   0.398  -7.867   2.845
  144   3HZ   LYS  41          2HZ       LYS  41  -0.434  -9.260   2.993
  145    H    VAL  42           H        VAL  42  -0.140  -2.402  -2.304
  146    HA   VAL  42           HA       VAL  42   2.384  -3.646  -2.850
  147    HB   VAL  42           HB       VAL  42   1.553  -0.715  -2.985
  148   1HG1  VAL  42          2HG1      VAL  42   3.835  -2.179  -4.366
  149   2HG1  VAL  42          3HG1      VAL  42   3.314  -0.519  -4.731
  150   3HG1  VAL  42          1HG1      VAL  42   3.987  -0.893  -3.145
  151   1HG2  VAL  42          2HG2      VAL  42   1.479  -2.892  -5.123
  152   2HG2  VAL  42          3HG2      VAL  42   0.066  -2.110  -4.380
  153   3HG2  VAL  42          1HG2      VAL  42   1.152  -1.167  -5.397
  154    H    CYS  43           H        CYS  43   1.341  -1.432  -0.266
  155    HA   CYS  43           HA       CYS  43   3.971  -1.585   1.100
  156   1HB   CYS  43          1HB       CYS  43   3.959   0.232  -0.656
  157   2HB   CYS  43          2HB       CYS  43   2.650   1.023   0.228
  158    H    PHE  44           H        PHE  44   3.294   0.628   2.749
  159    HA   PHE  44           HA       PHE  44   0.695   0.086   4.056
  160   1HB   PHE  44          1HB       PHE  44   1.540  -0.114   6.230
  161   2HB   PHE  44          2HB       PHE  44   2.534  -1.199   5.275
  162    HD1  PHE  44           HD1      PHE  44   2.465   1.707   7.456
  163    HD2  PHE  44           HD2      PHE  44   4.908  -0.413   4.597
  164    HE1  PHE  44           HE1      PHE  44   4.471   2.924   8.266
  165    HE2  PHE  44           HE2      PHE  44   6.909   0.812   5.412
  166    HZ   PHE  44           HZ       PHE  44   6.696   2.483   7.239
  167    H    LYS  45           H        LYS  45   3.268   2.326   3.221
  168    HA   LYS  45           HA       LYS  45   1.494   4.618   3.709
  169   1HB   LYS  45          1HB       LYS  45   2.552   4.175   5.936
  170   2HB   LYS  45          2HB       LYS  45   4.146   4.397   5.210
  171   1HG   LYS  45          1HG       LYS  45   3.546   6.752   4.650
  172   2HG   LYS  45          2HG       LYS  45   1.928   6.496   5.336
  173   1HD   LYS  45          1HD       LYS  45   2.958   6.007   7.550
  174   2HD   LYS  45          2HD       LYS  45   4.571   6.269   6.852
  175   1HE   LYS  45          1HE       LYS  45   3.925   8.603   6.265
  176   2HE   LYS  45          2HE       LYS  45   2.328   8.338   6.977
  177   1HZ   LYS  45          1HZ       LYS  45   3.425   7.962   9.127
  178   2HZ   LYS  45          2HZ       LYS  45   4.899   8.213   8.465
  179   3HZ   LYS  45          3HZ       LYS  45   3.821   9.434   8.546
  180    H    CYS  46           H        CYS  46   4.976   3.881   3.018
  181    HA   CYS  46           HA       CYS  46   5.335   6.331   1.633
  182   1HB   CYS  46          1HB       CYS  46   7.585   5.078   1.035
  183   2HB   CYS  46          2HB       CYS  46   7.231   5.698   2.643
  184    H    LYS  47           H        LYS  47   4.609   3.131   0.370
  185    HA   LYS  47           HA       LYS  47   4.161   2.346  -1.741
  186   1HB   LYS  47          1HB       LYS  47   2.093   3.315  -2.536
  187   2HB   LYS  47          2HB       LYS  47   2.144   3.200  -0.783
  188   1HG   LYS  47          1HG       LYS  47   2.699   5.625  -0.642
  189   2HG   LYS  47          2HG       LYS  47   2.578   5.754  -2.397
  190   1HD   LYS  47          1HD       LYS  47   0.232   5.233  -2.350
  191   2HD   LYS  47          2HD       LYS  47   0.289   4.738  -0.652
  192   1HE   LYS  47          1HE       LYS  47   0.972   7.558  -1.579
  193   2HE   LYS  47          2HE       LYS  47  -0.666   7.059  -1.143
  194   1HZ   LYS  47          2HZ       LYS  47   1.639   6.845   0.727
  195   2HZ   LYS  47          3HZ       LYS  47   0.527   8.057   0.752
  196   3HZ   LYS  47          1HZ       LYS  47   0.094   6.504   1.065
  197    H    GLN  48           H        GLN  48   6.571   4.053  -2.069
  198    HA   GLN  48           HA       GLN  48   6.372   5.394  -4.585
  199   1HB   GLN  48          1HB       GLN  48   8.814   4.186  -3.221
  200   2HB   GLN  48          2HB       GLN  48   8.865   5.303  -4.576
  201   1HG   GLN  48          1HG       GLN  48   7.847   5.902  -1.770
  202   2HG   GLN  48          2HG       GLN  48   9.326   6.485  -2.511
  203   1HE2  GLN  48          2HE2      GLN  48   5.986   7.177  -2.030
  204   2HE2  GLN  48          1HE2      GLN  48   5.910   8.555  -3.133
  205    HA   PRO  49           HA       PRO  49   5.955   2.558  -7.709
  206   1HB   PRO  49          2HB       PRO  49   8.486   3.556  -9.034
  207   2HB   PRO  49          1HB       PRO  49   6.879   3.249  -9.768
  208   1HG   PRO  49          1HG       PRO  49   7.573   5.762  -9.084
  209   2HG   PRO  49          2HG       PRO  49   5.935   5.155  -8.672
  210   1HD   PRO  49          1HD       PRO  49   8.355   5.415  -6.888
  211   2HD   PRO  49          2HD       PRO  49   6.642   5.802  -6.558
  212    H    GLY  50           H        GLY  50   9.155   2.100  -6.309
  213   1HA   GLY  50          2HA       GLY  50  10.383   0.066  -7.543
  214   2HA   GLY  50          1HA       GLY  50   8.969  -0.803  -6.948
  215    H    HIS  51           H        HIS  51   9.668   1.482  -4.603
  216    HA   HIS  51           HA       HIS  51  11.976   0.490  -3.313
  217   1HB   HIS  51          1HB       HIS  51  11.397   1.927  -1.564
  218   2HB   HIS  51          2HB       HIS  51  10.682   2.705  -2.968
  219    HD1  HIS  51           HD1      HIS  51   7.800   1.774  -3.186
  220    HD2  HIS  51           HD2      HIS  51   9.897   1.604   0.469
  221    HE1  HIS  51           HE1      HIS  51   6.084   1.278  -1.382
  222    H    PHE  52           H        PHE  52   8.693  -0.725  -3.196
  223    HA   PHE  52           HA       PHE  52   8.611  -1.782  -0.611
  224   1HB   PHE  52          1HB       PHE  52   6.720  -3.198  -1.569
  225   2HB   PHE  52          2HB       PHE  52   6.585  -1.458  -1.682
  226    HD1  PHE  52           HD1      PHE  52   6.538  -0.301  -3.810
  227    HD2  PHE  52           HD2      PHE  52   7.154  -4.570  -3.647
  228    HE1  PHE  52           HE1      PHE  52   6.149  -0.451  -6.246
  229    HE2  PHE  52           HE2      PHE  52   6.786  -4.708  -6.095
  230    HZ   PHE  52           HZ       PHE  52   6.288  -2.650  -7.404
  231    H    SER  53           H        SER  53   9.591  -3.479  -3.610
  232    HA   SER  53           HA       SER  53  10.090  -6.028  -2.502
  233   1HB   SER  53          1HB       SER  53  11.507  -4.648  -4.815
  234   2HB   SER  53          2HB       SER  53  11.468  -6.395  -4.500
  235    HG   SER  53           HG       SER  53   9.888  -5.764  -6.039
  236    H    LYS  54           H        LYS  54  11.748  -3.215  -1.679
  237    HA   LYS  54           HA       LYS  54  14.186  -4.684  -0.741
  238   1HB   LYS  54          1HB       LYS  54  14.011  -1.813  -1.747
  239   2HB   LYS  54          2HB       LYS  54  15.470  -2.650  -1.239
  240   1HG   LYS  54          1HG       LYS  54  13.800  -3.346  -3.695
  241   2HG   LYS  54          2HG       LYS  54  15.294  -2.419  -3.685
  242   1HD   LYS  54          1HD       LYS  54  16.570  -4.345  -2.883
  243   2HD   LYS  54          2HD       LYS  54  15.092  -5.316  -2.749
  244   1HE   LYS  54          1HE       LYS  54  14.688  -5.024  -5.191
  245   2HE   LYS  54          2HE       LYS  54  16.200  -4.115  -5.322
  246   1HZ   LYS  54          2HZ       LYS  54  15.985  -6.949  -4.444
  247   2HZ   LYS  54          3HZ       LYS  54  16.510  -6.455  -5.907
  248   3HZ   LYS  54          1HZ       LYS  54  17.384  -6.114  -4.572
  249    H    GLN  55           H        GLN  55  11.441  -3.324   0.456
  250    HA   GLN  55           HA       GLN  55  12.726  -2.686   3.040
  251   1HB   GLN  55          1HB       GLN  55  12.782  -0.556   1.711
  252   2HB   GLN  55          2HB       GLN  55  11.023  -0.616   1.583
  253   1HG   GLN  55          1HG       GLN  55  10.907  -0.548   4.118
  254   2HG   GLN  55          2HG       GLN  55  12.664  -0.380   4.149
  255   1HE2  GLN  55          1HE2      GLN  55   9.603   1.211   3.382
  256   2HE2  GLN  55          2HE2      GLN  55  10.282   2.828   3.225
  257    H    CYS  56           H        CYS  56   9.533  -2.362   1.395
  258    HA   CYS  56           HA       CYS  56   8.197  -2.883   3.956
  259   1HB   CYS  56          1HB       CYS  56   7.156  -1.860   1.283
  260   2HB   CYS  56          2HB       CYS  56   6.256  -1.906   2.805
  261    H    ARG  57           H        ARG  57   8.708  -4.598   1.012
  262    HA   ARG  57           HA       ARG  57   6.890  -6.817   1.833
  263   1HB   ARG  57          1HB       ARG  57   6.265  -4.995  -0.208
  264   2HB   ARG  57          2HB       ARG  57   7.077  -6.262  -1.096
  265   1HG   ARG  57          1HG       ARG  57   5.026  -7.215  -1.175
  266   2HG   ARG  57          2HG       ARG  57   5.363  -7.774   0.458
  267   1HD   ARG  57          1HD       ARG  57   3.787  -5.316  -0.406
  268   2HD   ARG  57          2HD       ARG  57   3.155  -6.764   0.387
  269    HE   ARG  57           HE       ARG  57   5.135  -5.558   2.078
  270   1HH1  ARG  57          2HH1      ARG  57   1.926  -4.741   0.940
  271   2HH1  ARG  57          1HH1      ARG  57   1.698  -3.592   2.235
  272   1HH2  ARG  57          2HH2      ARG  57   4.724  -4.225   3.707
  273   2HH2  ARG  57          1HH2      ARG  57   3.144  -3.477   3.892
  274    H    SER  58           H        SER  58   9.962  -6.060   1.382
  275    HA   SER  58           HA       SER  58  11.177  -8.011  -0.285
  276   1HB   SER  58          1HB       SER  58  13.165  -7.596   1.257
  277   2HB   SER  58          2HB       SER  58  12.496  -6.200   0.408
  278    HG   SER  58           HG       SER  58  11.869  -6.927   3.095

  No H/Q in entry =         278
  Start of MODEL   14
    1    H1   GLN  22           H2       GLN  22  -8.105  -0.040  -7.089
    2    H2   GLN  22           H1       GLN  22  -7.258   1.052  -6.207
    3    H3   GLN  22           H3       GLN  22  -6.802   0.701  -7.752
    4    HA   GLN  22           HA       GLN  22  -6.220  -1.537  -7.149
    5   1HB   GLN  22          1HB       GLN  22  -4.935   0.471  -5.240
    6   2HB   GLN  22          2HB       GLN  22  -4.293  -1.110  -5.689
    7   1HG   GLN  22          1HG       GLN  22  -4.132  -0.353  -8.073
    8   2HG   GLN  22          2HG       GLN  22  -4.659   1.258  -7.562
    9   1HE2  GLN  22          1HE2      GLN  22  -2.752   2.452  -7.939
   10   2HE2  GLN  22          2HE2      GLN  22  -1.235   2.057  -7.143
   11    H    THR  23           H        THR  23  -5.265  -2.300  -4.561
   12    HA   THR  23           HA       THR  23  -7.806  -2.801  -3.053
   13    HB   THR  23           HB       THR  23  -5.532  -4.720  -3.687
   14    HG1  THR  23           HG1      THR  23  -7.099  -5.748  -4.919
   15   1HG2  THR  23          3HG2      THR  23  -8.151  -5.268  -2.223
   16   2HG2  THR  23          1HG2      THR  23  -6.949  -6.476  -2.707
   17   3HG2  THR  23          2HG2      THR  23  -6.531  -5.277  -1.485
   18    H    CYS  24           H        CYS  24  -7.641  -2.825  -0.819
   19    HA   CYS  24           HA       CYS  24  -5.790  -1.047   0.310
   20   1HB   CYS  24          1HB       CYS  24  -8.166  -1.696   1.031
   21   2HB   CYS  24          2HB       CYS  24  -7.441  -3.100   1.818
   22    H    TYR  25           H        TYR  25  -4.145  -1.219   1.805
   23    HA   TYR  25           HA       TYR  25  -2.506  -3.607   1.958
   24   1HB   TYR  25          1HB       TYR  25  -1.039  -2.387   3.202
   25   2HB   TYR  25          2HB       TYR  25  -1.729  -1.161   2.161
   26    HD1  TYR  25           HD1      TYR  25  -0.619  -1.788   5.378
   27    HD2  TYR  25           HD2      TYR  25  -4.008  -0.012   3.375
   28    HE1  TYR  25           HE1      TYR  25  -1.133  -0.456   7.414
   29    HE2  TYR  25           HE2      TYR  25  -4.538   1.274   5.426
   30    HH   TYR  25           HH       TYR  25  -2.572   1.025   8.403
   31    H    ASN  26           H        ASN  26  -5.266  -2.523   3.786
   32    HA   ASN  26           HA       ASN  26  -4.735  -4.571   5.917
   33   1HB   ASN  26          1HB       ASN  26  -3.930  -2.322   6.574
   34   2HB   ASN  26          2HB       ASN  26  -5.536  -1.651   6.285
   35   1HD2  ASN  26          1HD2      ASN  26  -3.668  -3.899   8.344
   36   2HD2  ASN  26          2HD2      ASN  26  -4.818  -3.857   9.669
   37    H    CYS  27           H        CYS  27  -7.308  -2.510   4.416
   38    HA   CYS  27           HA       CYS  27  -9.479  -3.783   5.771
   39   1HB   CYS  27          1HB       CYS  27  -9.458  -2.325   3.089
   40   2HB   CYS  27          2HB       CYS  27 -10.867  -2.647   4.100
   41    H    GLY  28           H        GLY  28  -7.549  -4.842   3.091
   42   1HA   GLY  28          2HA       GLY  28  -8.960  -7.303   2.586
   43   2HA   GLY  28          1HA       GLY  28  -7.639  -6.620   1.633
   44    H    LYS  29           H        LYS  29  -9.862  -4.205   1.660
   45    HA   LYS  29           HA       LYS  29 -11.813  -5.211  -0.274
   46   1HB   LYS  29          1HB       LYS  29 -11.435  -2.771   1.422
   47   2HB   LYS  29          2HB       LYS  29 -12.191  -2.474  -0.130
   48   1HG   LYS  29          1HG       LYS  29 -13.901  -2.812   1.487
   49   2HG   LYS  29          2HG       LYS  29 -13.930  -4.133   0.316
   50   1HD   LYS  29          1HD       LYS  29 -12.775  -5.609   1.957
   51   2HD   LYS  29          2HD       LYS  29 -12.730  -4.263   3.120
   52   1HE   LYS  29          1HE       LYS  29 -15.200  -4.141   3.088
   53   2HE   LYS  29          2HE       LYS  29 -15.264  -5.443   1.894
   54   1HZ   LYS  29          3HZ       LYS  29 -14.183  -5.720   4.649
   55   2HZ   LYS  29          1HZ       LYS  29 -15.632  -6.279   4.145
   56   3HZ   LYS  29          2HZ       LYS  29 -14.258  -6.924   3.544
   57    HA   PRO  30           HA       PRO  30  -9.821  -3.285  -3.936
   58   1HB   PRO  30          2HB       PRO  30 -11.905  -3.405  -5.670
   59   2HB   PRO  30          1HB       PRO  30 -11.023  -4.869  -5.155
   60   1HG   PRO  30          1HG       PRO  30 -13.630  -3.786  -4.039
   61   2HG   PRO  30          2HG       PRO  30 -13.269  -5.456  -4.589
   62   1HD   PRO  30          1HD       PRO  30 -13.125  -4.676  -1.965
   63   2HD   PRO  30          2HD       PRO  30 -12.043  -5.926  -2.648
   64    H    GLY  31           H        GLY  31 -10.990  -1.427  -5.526
   65   1HA   GLY  31          2HA       GLY  31 -12.766   0.464  -4.333
   66   2HA   GLY  31          1HA       GLY  31 -11.651   0.781  -5.669
   67    H    HIS  32           H        HIS  32  -9.273   0.089  -4.070
   68    HA   HIS  32           HA       HIS  32  -9.182   2.288  -2.056
   69   1HB   HIS  32          1HB       HIS  32  -8.143  -0.512  -2.119
   70   2HB   HIS  32          2HB       HIS  32  -7.106   0.700  -1.379
   71    HD1  HIS  32           HD1      HIS  32 -10.757  -0.581  -0.945
   72    HD2  HIS  32           HD2      HIS  32  -7.629   1.420   1.034
   73    HE1  HIS  32           HE1      HIS  32 -11.493  -0.310   1.496
   74    H    LEU  33           H        LEU  33  -7.455   3.537  -1.831
   75    HA   LEU  33           HA       LEU  33  -5.347   3.875  -3.845
   76   1HB   LEU  33          1HB       LEU  33  -7.707   5.788  -3.433
   77   2HB   LEU  33          2HB       LEU  33  -6.239   6.235  -4.289
   78    HG   LEU  33           HG       LEU  33  -8.206   4.106  -5.221
   79   1HD1  LEU  33          1HD1      LEU  33  -9.124   6.379  -5.309
   80   2HD1  LEU  33          2HD1      LEU  33  -7.693   6.937  -6.202
   81   3HD1  LEU  33          3HD1      LEU  33  -8.800   5.752  -6.934
   82   1HD2  LEU  33          3HD2      LEU  33  -5.772   5.343  -6.595
   83   2HD2  LEU  33          1HD2      LEU  33  -5.900   3.662  -6.035
   84   3HD2  LEU  33          2HD2      LEU  33  -6.938   4.235  -7.348
   85    H    SER  34           H        SER  34  -4.103   5.924  -3.243
   86    HA   SER  34           HA       SER  34  -3.369   6.274  -0.557
   87   1HB   SER  34          1HB       SER  34  -3.344   8.349  -2.780
   88   2HB   SER  34          2HB       SER  34  -2.307   8.328  -1.341
   89    HG   SER  34           HG       SER  34  -1.382   7.446  -3.355
   90    H    SER  35           H        SER  35  -6.215   7.535  -2.152
   91    HA   SER  35           HA       SER  35  -6.821   9.534  -0.066
   92   1HB   SER  35          1HB       SER  35  -8.782   9.985  -1.543
   93   2HB   SER  35          2HB       SER  35  -7.221  10.153  -2.364
   94    HG   SER  35           HG       SER  35  -8.762   8.948  -3.597
   95    H    GLN  36           H        GLN  36  -7.260   6.207  -0.354
   96    HA   GLN  36           HA       GLN  36  -9.868   6.181   1.114
   97   1HB   GLN  36          1HB       GLN  36  -9.472   4.925  -1.140
   98   2HB   GLN  36          2HB       GLN  36  -8.479   3.824  -0.187
   99   1HG   GLN  36          1HG       GLN  36 -10.578   2.786  -0.268
  100   2HG   GLN  36          2HG       GLN  36 -10.567   3.521   1.328
  101   1HE2  GLN  36          2HE2      GLN  36 -12.035   3.524  -1.894
  102   2HE2  GLN  36          1HE2      GLN  36 -13.290   4.697  -1.497
  103    H    CYS  37           H        CYS  37  -6.549   4.889   1.138
  104    HA   CYS  37           HA       CYS  37  -6.498   4.739   4.086
  105   1HB   CYS  37          1HB       CYS  37  -6.056   2.406   2.181
  106   2HB   CYS  37          2HB       CYS  37  -5.204   2.478   3.710
  107    H    ARG  38           H        ARG  38  -4.194   4.288   4.793
  108    HA   ARG  38           HA       ARG  38  -2.389   6.257   3.849
  109   1HB   ARG  38          1HB       ARG  38  -1.947   3.747   5.517
  110   2HB   ARG  38          2HB       ARG  38  -0.691   4.946   5.233
  111   1HG   ARG  38          1HG       ARG  38  -1.483   6.369   6.753
  112   2HG   ARG  38          2HG       ARG  38  -3.124   6.295   6.136
  113   1HD   ARG  38          1HD       ARG  38  -1.874   4.233   7.999
  114   2HD   ARG  38          2HD       ARG  38  -2.884   5.572   8.534
  115    HE   ARG  38           HE       ARG  38  -3.754   3.058   7.412
  116   1HH1  ARG  38          1HH1      ARG  38  -4.808   6.389   7.777
  117   2HH1  ARG  38          2HH1      ARG  38  -6.481   5.972   7.542
  118   1HH2  ARG  38          1HH2      ARG  38  -5.896   2.619   7.079
  119   2HH2  ARG  38          2HH2      ARG  38  -7.066   3.899   7.102
  120    H    ALA  39           H        ALA  39  -2.635   2.895   2.789
  121    HA   ALA  39           HA       ALA  39  -1.387   3.659   0.305
  122   1HB   ALA  39          2HB       ALA  39  -0.048   1.513   2.017
  123   2HB   ALA  39          3HB       ALA  39   0.393   1.899   0.350
  124   3HB   ALA  39          1HB       ALA  39   0.658   3.103   1.623
  125    HA   PRO  40           HA       PRO  40  -3.701  -0.131  -0.942
  126   1HB   PRO  40          2HB       PRO  40  -2.634  -0.614  -3.390
  127   2HB   PRO  40          1HB       PRO  40  -3.725   0.772  -3.093
  128   1HG   PRO  40          1HG       PRO  40  -0.690   0.781  -3.161
  129   2HG   PRO  40          2HG       PRO  40  -1.818   1.887  -4.008
  130   1HD   PRO  40          1HD       PRO  40  -0.636   2.501  -1.610
  131   2HD   PRO  40          2HD       PRO  40  -2.270   3.081  -2.043
  132    H    LYS  41           H        LYS  41  -3.006  -2.378  -1.651
  133    HA   LYS  41           HA       LYS  41  -1.316  -3.569   0.200
  134   1HB   LYS  41          1HB       LYS  41  -3.243  -4.546  -1.144
  135   2HB   LYS  41          2HB       LYS  41  -2.139  -4.728  -2.495
  136   1HG   LYS  41          1HG       LYS  41  -2.508  -6.827  -1.301
  137   2HG   LYS  41          2HG       LYS  41  -0.812  -6.368  -1.227
  138   1HD   LYS  41          1HD       LYS  41  -1.091  -5.585   1.099
  139   2HD   LYS  41          2HD       LYS  41  -2.842  -5.897   1.007
  140   1HE   LYS  41          1HE       LYS  41  -2.380  -8.304   0.631
  141   2HE   LYS  41          2HE       LYS  41  -0.643  -7.993   0.720
  142   1HZ   LYS  41          2HZ       LYS  41  -2.569  -7.520   2.939
  143   2HZ   LYS  41          3HZ       LYS  41  -1.526  -8.771   2.851
  144   3HZ   LYS  41          1HZ       LYS  41  -0.959  -7.251   3.023
  145    H    VAL  42           H        VAL  42  -0.164  -2.025  -2.564
  146    HA   VAL  42           HA       VAL  42   2.348  -3.289  -3.057
  147    HB   VAL  42           HB       VAL  42   1.620  -0.328  -3.075
  148   1HG1  VAL  42          1HG1      VAL  42   3.861  -1.825  -4.489
  149   2HG1  VAL  42          2HG1      VAL  42   3.427  -0.126  -4.773
  150   3HG1  VAL  42          3HG1      VAL  42   4.056  -0.614  -3.202
  151   1HG2  VAL  42          2HG2      VAL  42   1.496  -2.405  -5.308
  152   2HG2  VAL  42          3HG2      VAL  42   0.107  -1.581  -4.566
  153   3HG2  VAL  42          1HG2      VAL  42   1.260  -0.657  -5.518
  154    H    CYS  43           H        CYS  43   1.291  -1.170  -0.396
  155    HA   CYS  43           HA       CYS  43   3.870  -1.483   1.040
  156   1HB   CYS  43          1HB       CYS  43   3.993   0.403  -0.639
  157   2HB   CYS  43          2HB       CYS  43   2.696   1.217   0.246
  158    H    PHE  44           H        PHE  44   3.274   0.657   2.782
  159    HA   PHE  44           HA       PHE  44   0.594   0.235   3.968
  160   1HB   PHE  44          1HB       PHE  44   1.348  -0.144   6.154
  161   2HB   PHE  44          2HB       PHE  44   2.278  -1.251   5.165
  162    HD1  PHE  44           HD1      PHE  44   2.380   1.504   7.524
  163    HD2  PHE  44           HD2      PHE  44   4.729  -0.617   4.591
  164    HE1  PHE  44           HE1      PHE  44   4.452   2.486   8.473
  165    HE2  PHE  44           HE2      PHE  44   6.798   0.368   5.547
  166    HZ   PHE  44           HZ       PHE  44   6.665   1.924   7.481
  167    H    LYS  45           H        LYS  45   3.282   2.340   3.253
  168    HA   LYS  45           HA       LYS  45   1.735   4.719   4.053
  169   1HB   LYS  45          1HB       LYS  45   2.853   4.044   6.150
  170   2HB   LYS  45          2HB       LYS  45   4.410   3.995   5.338
  171   1HG   LYS  45          1HG       LYS  45   4.240   5.980   6.684
  172   2HG   LYS  45          2HG       LYS  45   4.315   6.453   4.989
  173   1HD   LYS  45          1HD       LYS  45   1.869   6.858   4.974
  174   2HD   LYS  45          2HD       LYS  45   1.757   6.280   6.655
  175   1HE   LYS  45          1HE       LYS  45   3.323   8.094   7.357
  176   2HE   LYS  45          2HE       LYS  45   3.387   8.677   5.690
  177   1HZ   LYS  45          2HZ       LYS  45   0.991   9.128   5.828
  178   2HZ   LYS  45          3HZ       LYS  45   0.938   8.589   7.374
  179   3HZ   LYS  45          1HZ       LYS  45   1.783   9.932   7.004
  180    H    CYS  46           H        CYS  46   5.132   3.857   3.126
  181    HA   CYS  46           HA       CYS  46   5.473   6.395   1.853
  182   1HB   CYS  46          1HB       CYS  46   7.763   5.361   1.328
  183   2HB   CYS  46          2HB       CYS  46   7.299   5.612   3.009
  184    H    LYS  47           H        LYS  47   4.756   3.232   0.521
  185    HA   LYS  47           HA       LYS  47   4.306   2.500  -1.613
  186   1HB   LYS  47          1HB       LYS  47   2.255   3.544  -2.391
  187   2HB   LYS  47          2HB       LYS  47   2.298   3.330  -0.648
  188   1HG   LYS  47          1HG       LYS  47   2.870   5.732  -0.358
  189   2HG   LYS  47          2HG       LYS  47   2.771   5.967  -2.105
  190   1HD   LYS  47          1HD       LYS  47   0.419   5.450  -2.109
  191   2HD   LYS  47          2HD       LYS  47   0.459   4.874  -0.436
  192   1HE   LYS  47          1HE       LYS  47   1.176   7.731  -1.210
  193   2HE   LYS  47          2HE       LYS  47  -0.477   7.230  -0.840
  194   1HZ   LYS  47          3HZ       LYS  47   1.777   6.897   1.074
  195   2HZ   LYS  47          1HZ       LYS  47   0.682   8.121   1.125
  196   3HZ   LYS  47          2HZ       LYS  47   0.213   6.565   1.359
  197    H    GLN  48           H        GLN  48   6.750   4.087  -1.902
  198    HA   GLN  48           HA       GLN  48   6.604   5.545  -4.363
  199   1HB   GLN  48          1HB       GLN  48   8.985   4.181  -3.033
  200   2HB   GLN  48          2HB       GLN  48   9.096   5.330  -4.361
  201   1HG   GLN  48          1HG       GLN  48   8.086   5.905  -1.546
  202   2HG   GLN  48          2HG       GLN  48   9.598   6.436  -2.259
  203   1HE2  GLN  48          2HE2      GLN  48   6.286   7.270  -1.793
  204   2HE2  GLN  48          1HE2      GLN  48   6.287   8.679  -2.859
  205    HA   PRO  49           HA       PRO  49   6.038   2.853  -7.583
  206   1HB   PRO  49          2HB       PRO  49   8.612   3.770  -8.882
  207   2HB   PRO  49          1HB       PRO  49   6.991   3.568  -9.622
  208   1HG   PRO  49          1HG       PRO  49   7.810   6.019  -8.854
  209   2HG   PRO  49          2HG       PRO  49   6.145   5.480  -8.461
  210   1HD   PRO  49          1HD       PRO  49   8.570   5.566  -6.670
  211   2HD   PRO  49          2HD       PRO  49   6.876   6.015  -6.325
  212    H    GLY  50           H        GLY  50   9.270   2.237  -6.282
  213   1HA   GLY  50          2HA       GLY  50  10.357   0.188  -7.617
  214   2HA   GLY  50          1HA       GLY  50   8.955  -0.648  -6.950
  215    H    HIS  51           H        HIS  51   9.604   1.414  -4.517
  216    HA   HIS  51           HA       HIS  51  12.023   0.418  -3.351
  217   1HB   HIS  51          1HB       HIS  51  11.454   1.742  -1.507
  218   2HB   HIS  51          2HB       HIS  51  10.744   2.604  -2.861
  219    HD1  HIS  51           HD1      HIS  51   7.849   1.812  -3.119
  220    HD2  HIS  51           HD2      HIS  51   9.945   1.225   0.494
  221    HE1  HIS  51           HE1      HIS  51   6.118   1.229  -1.361
  222    H    PHE  52           H        PHE  52   8.732  -0.770  -3.245
  223    HA   PHE  52           HA       PHE  52   8.644  -1.805  -0.678
  224   1HB   PHE  52          1HB       PHE  52   6.662  -3.103  -1.537
  225   2HB   PHE  52          2HB       PHE  52   6.638  -1.376  -1.790
  226    HD1  PHE  52           HD1      PHE  52   6.713  -0.387  -4.026
  227    HD2  PHE  52           HD2      PHE  52   6.919  -4.665  -3.476
  228    HE1  PHE  52           HE1      PHE  52   6.286  -0.723  -6.440
  229    HE2  PHE  52           HE2      PHE  52   6.501  -4.989  -5.898
  230    HZ   PHE  52           HZ       PHE  52   6.189  -3.019  -7.387
  231    H    SER  53           H        SER  53   9.540  -3.635  -3.630
  232    HA   SER  53           HA       SER  53   9.853  -6.172  -2.426
  233   1HB   SER  53          1HB       SER  53  11.379  -5.008  -4.786
  234   2HB   SER  53          2HB       SER  53  11.183  -6.731  -4.404
  235    HG   SER  53           HG       SER  53   9.667  -6.019  -5.973
  236    H    LYS  54           H        LYS  54  11.702  -3.465  -1.671
  237    HA   LYS  54           HA       LYS  54  13.935  -5.122  -0.574
  238   1HB   LYS  54          1HB       LYS  54  14.190  -2.339  -1.802
  239   2HB   LYS  54          2HB       LYS  54  15.470  -3.266  -1.034
  240   1HG   LYS  54          1HG       LYS  54  16.007  -3.854  -3.130
  241   2HG   LYS  54          2HG       LYS  54  14.807  -5.104  -2.863
  242   1HD   LYS  54          1HD       LYS  54  14.370  -4.206  -5.013
  243   2HD   LYS  54          2HD       LYS  54  13.101  -3.520  -3.988
  244   1HE   LYS  54          1HE       LYS  54  14.387  -1.413  -3.780
  245   2HE   LYS  54          2HE       LYS  54  15.709  -2.117  -4.722
  246   1HZ   LYS  54          3HZ       LYS  54  14.161  -2.305  -6.608
  247   2HZ   LYS  54          1HZ       LYS  54  12.958  -1.611  -5.735
  248   3HZ   LYS  54          2HZ       LYS  54  14.293  -0.753  -6.125
  249    H    GLN  55           H        GLN  55  11.304  -3.628   0.477
  250    HA   GLN  55           HA       GLN  55  12.535  -3.051   3.075
  251   1HB   GLN  55          1HB       GLN  55  12.716  -0.874   1.847
  252   2HB   GLN  55          2HB       GLN  55  10.962  -0.851   1.664
  253   1HG   GLN  55          1HG       GLN  55  10.761  -0.884   4.188
  254   2HG   GLN  55          2HG       GLN  55  12.522  -0.823   4.292
  255   1HE2  GLN  55          1HE2      GLN  55   9.595   0.988   3.492
  256   2HE2  GLN  55          2HE2      GLN  55  10.379   2.565   3.424
  257    H    CYS  56           H        CYS  56   9.389  -2.375   1.453
  258    HA   CYS  56           HA       CYS  56   8.006  -3.025   3.930
  259   1HB   CYS  56          1HB       CYS  56   7.045  -1.859   1.284
  260   2HB   CYS  56          2HB       CYS  56   6.112  -1.932   2.787
  261    H    ARG  57           H        ARG  57   8.543  -4.720   0.991
  262    HA   ARG  57           HA       ARG  57   6.512  -6.801   1.643
  263   1HB   ARG  57          1HB       ARG  57   6.013  -4.833  -0.242
  264   2HB   ARG  57          2HB       ARG  57   6.817  -6.020  -1.241
  265   1HG   ARG  57          1HG       ARG  57   4.750  -6.925  -1.460
  266   2HG   ARG  57          2HG       ARG  57   5.013  -7.626   0.132
  267   1HD   ARG  57          1HD       ARG  57   3.522  -5.077  -0.594
  268   2HD   ARG  57          2HD       ARG  57   2.844  -6.554   0.104
  269    HE   ARG  57           HE       ARG  57   4.822  -5.490   1.893
  270   1HH1  ARG  57          1HH2      ARG  57   1.664  -4.530   0.747
  271   2HH1  ARG  57          2HH2      ARG  57   1.451  -3.416   2.075
  272   1HH2  ARG  57          2HH1      ARG  57   4.433  -4.213   3.567
  273   2HH2  ARG  57          1HH1      ARG  57   2.873  -3.431   3.773
  274    H    SER  58           H        SER  58   9.569  -6.480   1.583
  275    HA   SER  58           HA       SER  58  10.934  -7.969  -0.276
  276   1HB   SER  58          1HB       SER  58  11.405  -8.038   2.722
  277   2HB   SER  58          2HB       SER  58  12.594  -8.362   1.447
  278    HG   SER  58           HG       SER  58  12.692  -6.185   2.266

  No H/Q in entry =         278
  Start of MODEL   15
    1    H1   GLN  22           H1       GLN  22  -8.006  -0.869  -7.451
    2    H2   GLN  22           H3       GLN  22  -7.547   0.497  -6.667
    3    H3   GLN  22           H2       GLN  22  -6.755   0.023  -8.029
    4    HA   GLN  22           HA       GLN  22  -5.923  -1.941  -6.933
    5   1HB   GLN  22          1HB       GLN  22  -5.221   0.813  -6.192
    6   2HB   GLN  22          2HB       GLN  22  -4.848  -0.284  -4.889
    7   1HG   GLN  22          1HG       GLN  22  -3.938  -0.689  -7.777
    8   2HG   GLN  22          2HG       GLN  22  -2.998   0.142  -6.542
    9   1HE2  GLN  22          2HE2      GLN  22  -1.566  -1.813  -7.513
   10   2HE2  GLN  22          1HE2      GLN  22  -1.625  -3.245  -6.493
   11    H    THR  23           H        THR  23  -5.293  -2.528  -4.481
   12    HA   THR  23           HA       THR  23  -7.853  -2.963  -2.976
   13    HB   THR  23           HB       THR  23  -5.512  -4.846  -3.471
   14    HG1  THR  23           HG1      THR  23  -7.017  -5.975  -4.685
   15   1HG2  THR  23          1HG2      THR  23  -8.137  -5.386  -2.012
   16   2HG2  THR  23          2HG2      THR  23  -6.913  -6.595  -2.437
   17   3HG2  THR  23          3HG2      THR  23  -6.521  -5.337  -1.266
   18    H    CYS  24           H        CYS  24  -7.704  -2.915  -0.709
   19    HA   CYS  24           HA       CYS  24  -5.856  -1.077   0.362
   20   1HB   CYS  24          1HB       CYS  24  -8.232  -1.710   1.113
   21   2HB   CYS  24          2HB       CYS  24  -7.486  -3.069   1.968
   22    H    TYR  25           H        TYR  25  -4.237  -1.217   1.900
   23    HA   TYR  25           HA       TYR  25  -2.591  -3.614   2.121
   24   1HB   TYR  25          1HB       TYR  25  -1.106  -2.338   3.297
   25   2HB   TYR  25          2HB       TYR  25  -1.800  -1.152   2.215
   26    HD1  TYR  25           HD1      TYR  25  -0.705  -1.679   5.469
   27    HD2  TYR  25           HD2      TYR  25  -4.057   0.060   3.377
   28    HE1  TYR  25           HE1      TYR  25  -1.220  -0.271   7.453
   29    HE2  TYR  25           HE2      TYR  25  -4.597   1.410   5.378
   30    HH   TYR  25           HH       TYR  25  -2.650   1.270   8.375
   31    H    ASN  26           H        ASN  26  -5.384  -2.476   3.818
   32    HA   ASN  26           HA       ASN  26  -4.869  -4.327   6.128
   33   1HB   ASN  26          1HB       ASN  26  -4.135  -2.057   6.679
   34   2HB   ASN  26          2HB       ASN  26  -5.687  -1.389   6.174
   35   1HD2  ASN  26          1HD2      ASN  26  -7.355  -1.320   7.703
   36   2HD2  ASN  26          2HD2      ASN  26  -7.202  -2.038   9.299
   37    H    CYS  27           H        CYS  27  -7.428  -2.381   4.456
   38    HA   CYS  27           HA       CYS  27  -9.590  -3.499   5.926
   39   1HB   CYS  27          1HB       CYS  27  -9.578  -2.205   3.164
   40   2HB   CYS  27          2HB       CYS  27 -10.982  -2.425   4.209
   41    H    GLY  28           H        GLY  28  -7.787  -4.855   3.286
   42   1HA   GLY  28          2HA       GLY  28  -9.294  -7.294   3.092
   43   2HA   GLY  28          1HA       GLY  28  -8.031  -6.741   1.986
   44    H    LYS  29           H        LYS  29  -9.611  -4.218   1.427
   45    HA   LYS  29           HA       LYS  29 -11.907  -5.280  -0.161
   46   1HB   LYS  29          1HB       LYS  29 -11.494  -2.828   1.509
   47   2HB   LYS  29          2HB       LYS  29 -12.279  -2.551  -0.033
   48   1HG   LYS  29          1HG       LYS  29 -13.975  -2.853   1.579
   49   2HG   LYS  29          2HG       LYS  29 -14.003  -4.234   0.479
   50   1HD   LYS  29          1HD       LYS  29 -12.817  -5.606   2.182
   51   2HD   LYS  29          2HD       LYS  29 -12.769  -4.195   3.266
   52   1HE   LYS  29          1HE       LYS  29 -15.229  -4.109   3.297
   53   2HE   LYS  29          2HE       LYS  29 -15.313  -5.468   2.169
   54   1HZ   LYS  29          3HZ       LYS  29 -14.132  -5.606   4.894
   55   2HZ   LYS  29          1HZ       LYS  29 -15.600  -6.191   4.477
   56   3HZ   LYS  29          2HZ       LYS  29 -14.250  -6.860   3.852
   57    HA   PRO  30           HA       PRO  30  -9.978  -3.418  -3.873
   58   1HB   PRO  30          2HB       PRO  30 -12.067  -3.582  -5.586
   59   2HB   PRO  30          1HB       PRO  30 -11.232  -5.049  -5.005
   60   1HG   PRO  30          1HG       PRO  30 -13.790  -3.823  -3.919
   61   2HG   PRO  30          2HG       PRO  30 -13.502  -5.524  -4.410
   62   1HD   PRO  30          1HD       PRO  30 -13.291  -4.652  -1.817
   63   2HD   PRO  30          2HD       PRO  30 -12.277  -5.975  -2.465
   64    H    GLY  31           H        GLY  31 -11.238  -1.615  -5.510
   65   1HA   GLY  31          2HA       GLY  31 -12.933   0.332  -4.299
   66   2HA   GLY  31          1HA       GLY  31 -11.873   0.599  -5.690
   67    H    HIS  32           H        HIS  32  -9.437  -0.085  -4.181
   68    HA   HIS  32           HA       HIS  32  -9.216   2.175  -2.247
   69   1HB   HIS  32          1HB       HIS  32  -8.284  -0.667  -2.208
   70   2HB   HIS  32          2HB       HIS  32  -7.190   0.537  -1.546
   71    HD1  HIS  32           HD1      HIS  32 -10.851  -0.629  -0.962
   72    HD2  HIS  32           HD2      HIS  32  -7.630   1.383   0.853
   73    HE1  HIS  32           HE1      HIS  32 -11.517  -0.245   1.484
   74    H    LEU  33           H        LEU  33  -7.333   3.258  -2.069
   75    HA   LEU  33           HA       LEU  33  -5.307   3.367  -4.186
   76   1HB   LEU  33          1HB       LEU  33  -7.419   5.536  -3.686
   77   2HB   LEU  33          2HB       LEU  33  -5.930   5.833  -4.565
   78    HG   LEU  33           HG       LEU  33  -8.121   3.933  -5.485
   79   1HD1  LEU  33          1HD1      LEU  33  -8.798   6.294  -5.539
   80   2HD1  LEU  33          2HD1      LEU  33  -7.327   6.707  -6.447
   81   3HD1  LEU  33          3HD1      LEU  33  -8.561   5.654  -7.173
   82   1HD2  LEU  33          2HD2      LEU  33  -5.588   4.924  -6.880
   83   2HD2  LEU  33          3HD2      LEU  33  -5.896   3.257  -6.348
   84   3HD2  LEU  33          1HD2      LEU  33  -6.879   3.964  -7.634
   85    H    SER  34           H        SER  34  -3.801   5.175  -3.670
   86    HA   SER  34           HA       SER  34  -2.823   5.388  -1.060
   87   1HB   SER  34          1HB       SER  34  -2.562   7.347  -3.373
   88   2HB   SER  34          2HB       SER  34  -1.442   7.178  -2.011
   89    HG   SER  34           HG       SER  34  -0.820   6.028  -3.975
   90    H    SER  35           H        SER  35  -5.686   6.834  -2.081
   91    HA   SER  35           HA       SER  35  -5.644   8.890   0.088
   92   1HB   SER  35          1HB       SER  35  -7.323  10.088  -1.290
   93   2HB   SER  35          2HB       SER  35  -5.760   9.914  -2.111
   94    HG   SER  35           HG       SER  35  -7.551   9.384  -3.477
   95    H    GLN  36           H        GLN  36  -7.109   5.939  -0.924
   96    HA   GLN  36           HA       GLN  36  -9.619   6.300   0.586
   97   1HB   GLN  36          1HB       GLN  36  -9.307   4.799  -1.487
   98   2HB   GLN  36          2HB       GLN  36  -8.360   3.733  -0.448
   99   1HG   GLN  36          1HG       GLN  36 -10.529   2.802  -0.484
  100   2HG   GLN  36          2HG       GLN  36 -10.434   3.595   1.077
  101   1HE2  GLN  36          2HE2      GLN  36 -12.031   3.516  -2.062
  102   2HE2  GLN  36          1HE2      GLN  36 -13.192   4.789  -1.690
  103    H    CYS  37           H        CYS  37  -6.443   4.795   0.934
  104    HA   CYS  37           HA       CYS  37  -6.577   4.861   3.874
  105   1HB   CYS  37          1HB       CYS  37  -6.110   2.402   2.154
  106   2HB   CYS  37          2HB       CYS  37  -5.291   2.552   3.697
  107    H    ARG  38           H        ARG  38  -4.257   4.340   4.717
  108    HA   ARG  38           HA       ARG  38  -2.457   6.331   3.844
  109   1HB   ARG  38          1HB       ARG  38  -1.929   3.787   5.450
  110   2HB   ARG  38          2HB       ARG  38  -0.730   5.031   5.144
  111   1HG   ARG  38          1HG       ARG  38  -1.356   5.755   7.142
  112   2HG   ARG  38          2HG       ARG  38  -2.525   6.677   6.214
  113   1HD   ARG  38          1HD       ARG  38  -3.139   3.949   7.428
  114   2HD   ARG  38          2HD       ARG  38  -3.250   5.425   8.371
  115    HE   ARG  38           HE       ARG  38  -4.901   6.260   6.646
  116   1HH1  ARG  38          2HH2      ARG  38  -4.726   2.811   7.395
  117   2HH1  ARG  38          1HH2      ARG  38  -6.418   2.598   7.029
  118   1HH2  ARG  38          1HH1      ARG  38  -7.047   5.862   6.254
  119   2HH2  ARG  38          2HH1      ARG  38  -7.640   4.230   6.301
  120    H    ALA  39           H        ALA  39  -2.620   2.976   2.769
  121    HA   ALA  39           HA       ALA  39  -1.396   3.739   0.269
  122   1HB   ALA  39          3HB       ALA  39  -0.035   1.619   2.001
  123   2HB   ALA  39          1HB       ALA  39   0.395   2.002   0.328
  124   3HB   ALA  39          2HB       ALA  39   0.655   3.212   1.598
  125    HA   PRO  40           HA       PRO  40  -3.766  -0.065  -0.852
  126   1HB   PRO  40          2HB       PRO  40  -2.751  -0.628  -3.306
  127   2HB   PRO  40          1HB       PRO  40  -3.815   0.784  -3.020
  128   1HG   PRO  40          1HG       PRO  40  -0.785   0.743  -3.153
  129   2HG   PRO  40          2HG       PRO  40  -1.914   1.843  -4.006
  130   1HD   PRO  40          1HD       PRO  40  -0.673   2.501  -1.646
  131   2HD   PRO  40          2HD       PRO  40  -2.304   3.093  -2.062
  132    H    LYS  41           H        LYS  41  -3.095  -2.341  -1.564
  133    HA   LYS  41           HA       LYS  41  -1.419  -3.585   0.268
  134   1HB   LYS  41          1HB       LYS  41  -3.323  -4.512  -1.124
  135   2HB   LYS  41          2HB       LYS  41  -2.189  -4.690  -2.463
  136   1HG   LYS  41          1HG       LYS  41  -0.853  -6.286  -1.151
  137   2HG   LYS  41          2HG       LYS  41  -1.849  -5.982   0.287
  138   1HD   LYS  41          1HD       LYS  41  -3.819  -6.927  -0.873
  139   2HD   LYS  41          2HD       LYS  41  -2.840  -7.191  -2.335
  140   1HE   LYS  41          1HE       LYS  41  -1.323  -8.681  -1.042
  141   2HE   LYS  41          2HE       LYS  41  -2.304  -8.429   0.405
  142   1HZ   LYS  41          1HZ       LYS  41  -3.266  -9.700  -2.106
  143   2HZ   LYS  41          2HZ       LYS  41  -2.905 -10.491  -0.727
  144   3HZ   LYS  41          3HZ       LYS  41  -4.175  -9.471  -0.764
  145    H    VAL  42           H        VAL  42  -0.275  -1.999  -2.502
  146    HA   VAL  42           HA       VAL  42   2.251  -3.209  -3.013
  147    HB   VAL  42           HB       VAL  42   1.461  -0.264  -2.995
  148   1HG1  VAL  42          1HG1      VAL  42   3.738  -1.685  -4.430
  149   2HG1  VAL  42          2HG1      VAL  42   3.251   0.003  -4.700
  150   3HG1  VAL  42          3HG1      VAL  42   3.895  -0.477  -3.132
  151   1HG2  VAL  42          3HG2      VAL  42   1.380  -2.316  -5.252
  152   2HG2  VAL  42          1HG2      VAL  42  -0.028  -1.545  -4.490
  153   3HG2  VAL  42          2HG2      VAL  42   1.092  -0.572  -5.436
  154    H    CYS  43           H        CYS  43   1.205  -1.100  -0.331
  155    HA   CYS  43           HA       CYS  43   3.795  -1.417   1.078
  156   1HB   CYS  43          1HB       CYS  43   3.922   0.485  -0.581
  157   2HB   CYS  43          2HB       CYS  43   2.627   1.296   0.307
  158    H    PHE  44           H        PHE  44   3.158   0.767   2.805
  159    HA   PHE  44           HA       PHE  44   0.517   0.282   4.033
  160   1HB   PHE  44          1HB       PHE  44   1.287  -0.143   6.204
  161   2HB   PHE  44          2HB       PHE  44   2.211  -1.229   5.187
  162    HD1  PHE  44           HD1      PHE  44   2.327   1.463   7.613
  163    HD2  PHE  44           HD2      PHE  44   4.658  -0.574   4.605
  164    HE1  PHE  44           HE1      PHE  44   4.405   2.427   8.568
  165    HE2  PHE  44           HE2      PHE  44   6.732   0.395   5.568
  166    HZ   PHE  44           HZ       PHE  44   6.610   1.901   7.541
  167    H    LYS  45           H        LYS  45   3.284   2.381   3.482
  168    HA   LYS  45           HA       LYS  45   1.690   4.761   4.195
  169   1HB   LYS  45          1HB       LYS  45   2.688   4.015   6.348
  170   2HB   LYS  45          2HB       LYS  45   4.302   4.109   5.638
  171   1HG   LYS  45          1HG       LYS  45   3.993   6.561   5.296
  172   2HG   LYS  45          2HG       LYS  45   2.360   6.442   5.981
  173   1HD   LYS  45          1HD       LYS  45   3.331   5.650   8.130
  174   2HD   LYS  45          2HD       LYS  45   4.962   5.760   7.430
  175   1HE   LYS  45          1HE       LYS  45   4.614   8.197   7.035
  176   2HE   LYS  45          2HE       LYS  45   3.002   8.081   7.753
  177   1HZ   LYS  45          2HZ       LYS  45   4.061   7.403   9.847
  178   2HZ   LYS  45          3HZ       LYS  45   5.549   7.518   9.182
  179   3HZ   LYS  45          1HZ       LYS  45   4.634   8.853   9.374
  180    H    CYS  46           H        CYS  46   5.102   3.819   3.406
  181    HA   CYS  46           HA       CYS  46   5.631   6.370   2.255
  182   1HB   CYS  46          1HB       CYS  46   7.834   5.088   1.627
  183   2HB   CYS  46          2HB       CYS  46   7.443   5.511   3.291
  184    H    LYS  47           H        LYS  47   4.738   3.334   0.727
  185    HA   LYS  47           HA       LYS  47   4.261   2.762  -1.444
  186   1HB   LYS  47          1HB       LYS  47   2.304   4.012  -2.191
  187   2HB   LYS  47          2HB       LYS  47   2.297   3.674  -0.468
  188   1HG   LYS  47          1HG       LYS  47   3.000   5.986   0.026
  189   2HG   LYS  47          2HG       LYS  47   3.053   6.364  -1.697
  190   1HD   LYS  47          1HD       LYS  47   0.705   6.122  -1.917
  191   2HD   LYS  47          2HD       LYS  47   0.518   5.344  -0.339
  192   1HE   LYS  47          1HE       LYS  47   1.554   8.193  -0.670
  193   2HE   LYS  47          2HE       LYS  47  -0.166   7.822  -0.510
  194   1HZ   LYS  47          2HZ       LYS  47   1.873   7.077   1.525
  195   2HZ   LYS  47          3HZ       LYS  47   0.829   8.339   1.645
  196   3HZ   LYS  47          1HZ       LYS  47   0.273   6.795   1.626
  197    H    GLN  48           H        GLN  48   6.814   4.257  -1.614
  198    HA   GLN  48           HA       GLN  48   6.756   5.832  -4.004
  199   1HB   GLN  48          1HB       GLN  48   9.074   4.334  -2.713
  200   2HB   GLN  48          2HB       GLN  48   9.238   5.544  -3.977
  201   1HG   GLN  48          1HG       GLN  48   8.213   6.005  -1.148
  202   2HG   GLN  48          2HG       GLN  48   9.744   6.529  -1.821
  203   1HE2  GLN  48          2HE2      GLN  48   6.458   7.434  -1.329
  204   2HE2  GLN  48          1HE2      GLN  48   6.504   8.893  -2.326
  205    HA   PRO  49           HA       PRO  49   6.196   3.305  -7.369
  206   1HB   PRO  49          2HB       PRO  49   8.816   4.233  -8.567
  207   2HB   PRO  49          1HB       PRO  49   7.205   4.104  -9.347
  208   1HG   PRO  49          1HG       PRO  49   8.057   6.494  -8.441
  209   2HG   PRO  49          2HG       PRO  49   6.373   5.970  -8.104
  210   1HD   PRO  49          1HD       PRO  49   8.770   5.907  -6.271
  211   2HD   PRO  49          2HD       PRO  49   7.080   6.385  -5.934
  212    H    GLY  50           H        GLY  50   9.343   2.518  -5.981
  213   1HA   GLY  50          2HA       GLY  50  10.447   0.518  -7.372
  214   2HA   GLY  50          1HA       GLY  50   8.974  -0.304  -6.860
  215    H    HIS  51           H        HIS  51   9.738   1.696  -4.313
  216    HA   HIS  51           HA       HIS  51  11.978   0.472  -3.091
  217   1HB   HIS  51          1HB       HIS  51  11.440   1.767  -1.222
  218   2HB   HIS  51          2HB       HIS  51  10.813   2.713  -2.562
  219    HD1  HIS  51           HD1      HIS  51   7.882   1.983  -2.926
  220    HD2  HIS  51           HD2      HIS  51   9.869   1.385   0.745
  221    HE1  HIS  51           HE1      HIS  51   6.091   1.460  -1.208
  222    H    PHE  52           H        PHE  52   8.634  -0.580  -3.138
  223    HA   PHE  52           HA       PHE  52   8.477  -1.939  -0.687
  224   1HB   PHE  52          1HB       PHE  52   6.544  -3.142  -1.848
  225   2HB   PHE  52          2HB       PHE  52   6.479  -1.400  -1.711
  226    HD1  PHE  52           HD1      PHE  52   6.941  -4.221  -4.095
  227    HD2  PHE  52           HD2      PHE  52   6.498   0.048  -3.652
  228    HE1  PHE  52           HE1      PHE  52   6.584  -3.997  -6.539
  229    HE2  PHE  52           HE2      PHE  52   6.122   0.262  -6.086
  230    HZ   PHE  52           HZ       PHE  52   6.180  -1.754  -7.543
  231    H    SER  53           H        SER  53   9.411  -3.292  -3.873
  232    HA   SER  53           HA       SER  53   9.753  -5.979  -3.058
  233   1HB   SER  53          1HB       SER  53  11.183  -4.454  -5.269
  234   2HB   SER  53          2HB       SER  53  11.060  -6.219  -5.126
  235    HG   SER  53           HG       SER  53   9.465  -5.384  -6.530
  236    H    LYS  54           H        LYS  54  11.646  -3.379  -2.021
  237    HA   LYS  54           HA       LYS  54  13.803  -5.223  -1.090
  238   1HB   LYS  54          1HB       LYS  54  15.473  -3.498  -1.453
  239   2HB   LYS  54          2HB       LYS  54  14.673  -3.932  -2.961
  240   1HG   LYS  54          1HG       LYS  54  13.324  -1.877  -2.895
  241   2HG   LYS  54          2HG       LYS  54  13.956  -1.476  -1.291
  242   1HD   LYS  54          1HD       LYS  54  15.072  -0.112  -2.916
  243   2HD   LYS  54          2HD       LYS  54  16.240  -1.266  -2.254
  244   1HE   LYS  54          1HE       LYS  54  15.928  -2.709  -4.271
  245   2HE   LYS  54          2HE       LYS  54  14.758  -1.550  -4.914
  246   1HZ   LYS  54          2HZ       LYS  54  16.548   0.113  -4.967
  247   2HZ   LYS  54          3HZ       LYS  54  17.624  -0.965  -4.376
  248   3HZ   LYS  54          1HZ       LYS  54  16.968  -1.192  -5.852
  249    H    GLN  55           H        GLN  55  11.262  -3.621   0.017
  250    HA   GLN  55           HA       GLN  55  12.432  -3.359   2.707
  251   1HB   GLN  55          1HB       GLN  55  12.703  -1.113   1.646
  252   2HB   GLN  55          2HB       GLN  55  10.963  -1.018   1.413
  253   1HG   GLN  55          1HG       GLN  55  10.689  -1.230   3.930
  254   2HG   GLN  55          2HG       GLN  55  12.446  -1.223   4.077
  255   1HE2  GLN  55          1HE2      GLN  55   9.590   0.746   3.580
  256   2HE2  GLN  55          2HE2      GLN  55  10.440   2.287   3.553
  257    H    CYS  56           H        CYS  56   9.319  -2.000   1.682
  258    HA   CYS  56           HA       CYS  56   8.004  -3.149   3.832
  259   1HB   CYS  56          1HB       CYS  56   6.867  -1.875   1.303
  260   2HB   CYS  56          2HB       CYS  56   6.028  -2.046   2.856
  261    H    ARG  57           H        ARG  57   8.415  -4.605   0.724
  262    HA   ARG  57           HA       ARG  57   6.522  -6.813   1.384
  263   1HB   ARG  57          1HB       ARG  57   5.904  -4.783  -0.426
  264   2HB   ARG  57          2HB       ARG  57   6.655  -5.958  -1.480
  265   1HG   ARG  57          1HG       ARG  57   4.578  -6.855  -1.595
  266   2HG   ARG  57          2HG       ARG  57   4.936  -7.588  -0.037
  267   1HD   ARG  57          1HD       ARG  57   3.414  -5.016  -0.615
  268   2HD   ARG  57          2HD       ARG  57   2.763  -6.512   0.067
  269    HE   ARG  57           HE       ARG  57   4.815  -5.543   1.806
  270   1HH1  ARG  57          1HH2      ARG  57   1.644  -4.471   0.806
  271   2HH1  ARG  57          2HH2      ARG  57   1.499  -3.392   2.169
  272   1HH2  ARG  57          1HH1      ARG  57   4.517  -4.314   3.538
  273   2HH2  ARG  57          2HH1      ARG  57   2.990  -3.489   3.815
  274    H    SER  58           H        SER  58   9.548  -6.340   1.213
  275    HA   SER  58           HA       SER  58  10.785  -7.907  -0.798
  276   1HB   SER  58          1HB       SER  58  11.875  -6.317   0.817
  277   2HB   SER  58          2HB       SER  58  11.691  -7.550   2.082
  278    HG   SER  58           HG       SER  58  13.748  -7.723   1.059

  No H/Q in entry =         278
  Start of MODEL   16
    1    H1   GLN  22           H3       GLN  22  -8.297  -0.374  -6.138
    2    H2   GLN  22           H2       GLN  22  -7.285   0.840  -5.718
    3    H3   GLN  22           H1       GLN  22  -7.318   0.301  -7.274
    4    HA   GLN  22           HA       GLN  22  -6.502  -1.859  -6.588
    5   1HB   GLN  22          1HB       GLN  22  -4.885  -0.124  -7.339
    6   2HB   GLN  22          2HB       GLN  22  -4.731   0.454  -5.682
    7   1HG   GLN  22          1HG       GLN  22  -2.824  -0.917  -6.259
    8   2HG   GLN  22          2HG       GLN  22  -3.748  -1.738  -5.012
    9   1HE2  GLN  22          1HE2      GLN  22  -2.089  -2.340  -7.852
   10   2HE2  GLN  22          2HE2      GLN  22  -2.971  -3.784  -8.337
   11    H    THR  23           H        THR  23  -6.309  -3.358  -4.983
   12    HA   THR  23           HA       THR  23  -7.777  -3.109  -2.687
   13    HB   THR  23           HB       THR  23  -5.447  -5.020  -3.034
   14    HG1  THR  23           HG1      THR  23  -6.949  -6.276  -4.139
   15   1HG2  THR  23          3HG2      THR  23  -8.143  -5.332  -1.629
   16   2HG2  THR  23          1HG2      THR  23  -6.917  -6.602  -1.820
   17   3HG2  THR  23          2HG2      THR  23  -6.564  -5.196  -0.814
   18    H    CYS  24           H        CYS  24  -7.595  -2.475  -0.664
   19    HA   CYS  24           HA       CYS  24  -5.670  -0.785   0.377
   20   1HB   CYS  24          1HB       CYS  24  -8.046  -1.295   1.149
   21   2HB   CYS  24          2HB       CYS  24  -7.403  -2.729   1.947
   22    H    TYR  25           H        TYR  25  -4.023  -0.950   1.935
   23    HA   TYR  25           HA       TYR  25  -2.426  -3.336   2.123
   24   1HB   TYR  25          1HB       TYR  25  -0.990  -2.170   3.412
   25   2HB   TYR  25          2HB       TYR  25  -1.700  -0.872   2.479
   26    HD1  TYR  25           HD1      TYR  25  -0.696  -1.910   5.675
   27    HD2  TYR  25           HD2      TYR  25  -3.891   0.248   3.728
   28    HE1  TYR  25           HE1      TYR  25  -1.318  -0.864   7.846
   29    HE2  TYR  25           HE2      TYR  25  -4.539   1.248   5.909
   30    HH   TYR  25           HH       TYR  25  -4.133   1.327   8.168
   31    H    ASN  26           H        ASN  26  -5.232  -2.320   3.852
   32    HA   ASN  26           HA       ASN  26  -4.853  -4.422   5.970
   33   1HB   ASN  26          1HB       ASN  26  -4.374  -2.240   6.860
   34   2HB   ASN  26          2HB       ASN  26  -5.791  -1.525   6.094
   35   1HD2  ASN  26          2HD2      ASN  26  -7.863  -1.766   7.084
   36   2HD2  ASN  26          1HD2      ASN  26  -7.994  -2.441   8.702
   37    H    CYS  27           H        CYS  27  -7.338  -2.449   4.262
   38    HA   CYS  27           HA       CYS  27  -9.503  -3.773   5.540
   39   1HB   CYS  27          1HB       CYS  27  -9.492  -1.944   3.107
   40   2HB   CYS  27          2HB       CYS  27 -10.866  -2.290   4.164
   41    H    GLY  28           H        GLY  28  -7.702  -4.907   2.894
   42   1HA   GLY  28          2HA       GLY  28  -9.255  -7.202   2.396
   43   2HA   GLY  28          1HA       GLY  28  -7.997  -6.567   1.328
   44    H    LYS  29           H        LYS  29  -9.357  -4.075   0.754
   45    HA   LYS  29           HA       LYS  29 -11.841  -4.895  -0.696
   46   1HB   LYS  29          1HB       LYS  29 -12.151  -3.643   1.428
   47   2HB   LYS  29          2HB       LYS  29 -11.198  -2.333   0.787
   48   1HG   LYS  29          1HG       LYS  29 -13.503  -1.725   0.590
   49   2HG   LYS  29          2HG       LYS  29 -12.891  -1.996  -1.035
   50   1HD   LYS  29          1HD       LYS  29 -15.136  -2.910  -0.790
   51   2HD   LYS  29          2HD       LYS  29 -13.996  -4.225  -1.090
   52   1HE   LYS  29          1HE       LYS  29 -13.957  -4.760   1.336
   53   2HE   LYS  29          2HE       LYS  29 -15.033  -3.395   1.663
   54   1HZ   LYS  29          1HZ       LYS  29 -15.745  -5.768   0.017
   55   2HZ   LYS  29          2HZ       LYS  29 -16.258  -5.485   1.539
   56   3HZ   LYS  29          3HZ       LYS  29 -16.741  -4.507   0.328
   57    HA   PRO  30           HA       PRO  30  -9.287  -3.662  -4.238
   58   1HB   PRO  30          2HB       PRO  30 -12.012  -3.786  -5.540
   59   2HB   PRO  30          1HB       PRO  30 -10.433  -4.361  -6.168
   60   1HG   PRO  30          1HG       PRO  30 -12.153  -6.117  -5.054
   61   2HG   PRO  30          2HG       PRO  30 -10.411  -6.194  -4.628
   62   1HD   PRO  30          1HD       PRO  30 -12.686  -4.990  -3.049
   63   2HD   PRO  30          2HD       PRO  30 -11.308  -5.983  -2.488
   64    H    GLY  31           H        GLY  31 -12.281  -1.905  -3.467
   65   1HA   GLY  31          2HA       GLY  31 -13.040   0.214  -3.919
   66   2HA   GLY  31          1HA       GLY  31 -11.853   0.329  -5.216
   67    H    HIS  32           H        HIS  32  -9.521  -0.028  -3.468
   68    HA   HIS  32           HA       HIS  32  -9.584   2.441  -1.806
   69   1HB   HIS  32          1HB       HIS  32  -8.061  -0.129  -1.642
   70   2HB   HIS  32          2HB       HIS  32  -7.256   1.338  -1.096
   71    HD1  HIS  32           HD1      HIS  32 -10.634  -0.441  -0.412
   72    HD2  HIS  32           HD2      HIS  32  -7.698   1.980   1.353
   73    HE1  HIS  32           HE1      HIS  32 -11.328  -0.143   2.041
   74    H    LEU  33           H        LEU  33  -7.786   3.732  -1.700
   75    HA   LEU  33           HA       LEU  33  -5.977   4.197  -3.951
   76   1HB   LEU  33          1HB       LEU  33  -8.230   6.106  -3.118
   77   2HB   LEU  33          2HB       LEU  33  -6.876   6.578  -4.133
   78    HG   LEU  33           HG       LEU  33  -8.986   4.522  -4.915
   79   1HD1  LEU  33          2HD1      LEU  33  -9.890   6.798  -4.740
   80   2HD1  LEU  33          3HD1      LEU  33  -8.587   7.410  -5.783
   81   3HD1  LEU  33          1HD1      LEU  33  -9.793   6.273  -6.428
   82   1HD2  LEU  33          1HD2      LEU  33  -6.752   5.840  -6.532
   83   2HD2  LEU  33          2HD2      LEU  33  -6.823   4.125  -6.065
   84   3HD2  LEU  33          3HD2      LEU  33  -8.023   4.782  -7.184
   85    H    SER  34           H        SER  34  -4.564   6.122  -3.309
   86    HA   SER  34           HA       SER  34  -3.603   6.137  -0.664
   87   1HB   SER  34          1HB       SER  34  -3.456   8.353  -2.736
   88   2HB   SER  34          2HB       SER  34  -2.389   8.160  -1.333
   89    HG   SER  34           HG       SER  34  -1.606   7.300  -3.417
   90    H    SER  35           H        SER  35  -6.501   7.624  -1.754
   91    HA   SER  35           HA       SER  35  -6.700   9.481   0.560
   92   1HB   SER  35          1HB       SER  35  -8.701  10.306  -0.672
   93   2HB   SER  35          2HB       SER  35  -7.198  10.440  -1.601
   94    HG   SER  35           HG       SER  35  -8.937   9.556  -2.842
   95    H    GLN  36           H        GLN  36  -7.616   6.290  -0.261
   96    HA   GLN  36           HA       GLN  36 -10.104   6.280   1.363
   97   1HB   GLN  36          1HB       GLN  36  -9.724   5.051  -0.915
   98   2HB   GLN  36          2HB       GLN  36  -8.766   3.916   0.025
   99   1HG   GLN  36          1HG       GLN  36 -10.871   2.904  -0.015
  100   2HG   GLN  36          2HG       GLN  36 -10.910   3.715   1.543
  101   1HE2  GLN  36          2HE2      GLN  36 -12.282   3.554  -1.715
  102   2HE2  GLN  36          1HE2      GLN  36 -13.506   4.789  -1.435
  103    H    CYS  37           H        CYS  37  -6.855   4.859   1.288
  104    HA   CYS  37           HA       CYS  37  -6.562   5.075   4.189
  105   1HB   CYS  37          1HB       CYS  37  -6.052   2.468   2.667
  106   2HB   CYS  37          2HB       CYS  37  -5.265   2.856   4.186
  107    H    ARG  38           H        ARG  38  -4.136   4.936   4.679
  108    HA   ARG  38           HA       ARG  38  -2.738   6.749   3.076
  109   1HB   ARG  38          1HB       ARG  38  -0.916   6.544   4.467
  110   2HB   ARG  38          2HB       ARG  38  -2.266   6.148   5.513
  111   1HG   ARG  38          1HG       ARG  38  -0.432   4.094   4.172
  112   2HG   ARG  38          2HG       ARG  38  -0.170   4.746   5.768
  113   1HD   ARG  38          1HD       ARG  38  -2.757   3.305   5.068
  114   2HD   ARG  38          2HD       ARG  38  -1.325   2.432   5.545
  115    HE   ARG  38           HE       ARG  38  -3.036   4.042   7.279
  116   1HH1  ARG  38          1HH1      ARG  38   0.186   2.660   6.997
  117   2HH1  ARG  38          2HH1      ARG  38   0.427   2.682   8.730
  118   1HH2  ARG  38          2HH2      ARG  38  -2.642   4.035   9.463
  119   2HH2  ARG  38          1HH2      ARG  38  -1.130   3.440  10.079
  120    H    ALA  39           H        ALA  39  -2.828   3.302   2.503
  121    HA   ALA  39           HA       ALA  39  -1.353   3.646   0.024
  122   1HB   ALA  39          3HB       ALA  39   0.527   3.407   1.621
  123   2HB   ALA  39          1HB       ALA  39  -0.203   1.921   2.275
  124   3HB   ALA  39          2HB       ALA  39   0.407   1.956   0.611
  125    HA   PRO  40           HA       PRO  40  -3.602  -0.261  -0.851
  126   1HB   PRO  40          2HB       PRO  40  -2.486  -0.933  -3.226
  127   2HB   PRO  40          1HB       PRO  40  -3.573   0.482  -3.074
  128   1HG   PRO  40          1HG       PRO  40  -0.536   0.447  -3.067
  129   2HG   PRO  40          2HG       PRO  40  -1.626   1.497  -4.026
  130   1HD   PRO  40          1HD       PRO  40  -0.488   2.270  -1.643
  131   2HD   PRO  40          2HD       PRO  40  -2.091   2.856  -2.177
  132    H    LYS  41           H        LYS  41  -2.909  -2.565  -1.370
  133    HA   LYS  41           HA       LYS  41  -1.158  -3.544   0.574
  134   1HB   LYS  41          1HB       LYS  41  -3.136  -4.667  -0.682
  135   2HB   LYS  41          2HB       LYS  41  -1.972  -5.087  -1.921
  136   1HG   LYS  41          1HG       LYS  41  -2.430  -6.942  -0.383
  137   2HG   LYS  41          2HG       LYS  41  -0.729  -6.489  -0.311
  138   1HD   LYS  41          1HD       LYS  41  -1.060  -5.329   1.806
  139   2HD   LYS  41          2HD       LYS  41  -2.826  -5.516   1.674
  140   1HE   LYS  41          1HE       LYS  41  -2.649  -7.918   1.925
  141   2HE   LYS  41          2HE       LYS  41  -0.880  -7.839   1.919
  142   1HZ   LYS  41          1HZ       LYS  41  -2.546  -6.452   3.960
  143   2HZ   LYS  41          2HZ       LYS  41  -1.898  -7.942   4.191
  144   3HZ   LYS  41          3HZ       LYS  41  -0.931  -6.642   3.987
  145    H    VAL  42           H        VAL  42  -0.123  -2.378  -2.418
  146    HA   VAL  42           HA       VAL  42   2.369  -3.677  -2.841
  147    HB   VAL  42           HB       VAL  42   1.673  -0.722  -3.127
  148   1HG1  VAL  42          2HG1      VAL  42   3.854  -2.383  -4.455
  149   2HG1  VAL  42          3HG1      VAL  42   3.411  -0.723  -4.915
  150   3HG1  VAL  42          1HG1      VAL  42   4.090  -1.034  -3.320
  151   1HG2  VAL  42          2HG2      VAL  42   1.434  -3.007  -5.135
  152   2HG2  VAL  42          3HG2      VAL  42   0.085  -2.093  -4.423
  153   3HG2  VAL  42          1HG2      VAL  42   1.211  -1.284  -5.508
  154    H    CYS  43           H        CYS  43   1.391  -1.390  -0.333
  155    HA   CYS  43           HA       CYS  43   3.999  -1.591   1.060
  156   1HB   CYS  43          1HB       CYS  43   3.977   0.301  -0.631
  157   2HB   CYS  43          2HB       CYS  43   2.665   1.045   0.294
  158    H    PHE  44           H        PHE  44   3.455   0.359   2.894
  159    HA   PHE  44           HA       PHE  44   0.759   0.015   4.077
  160   1HB   PHE  44          1HB       PHE  44   1.531  -0.469   6.242
  161   2HB   PHE  44          2HB       PHE  44   2.406  -1.576   5.201
  162    HD1  PHE  44           HD1      PHE  44   2.649   1.132   7.619
  163    HD2  PHE  44           HD2      PHE  44   4.868  -1.038   4.623
  164    HE1  PHE  44           HE1      PHE  44   4.773   2.030   8.542
  165    HE2  PHE  44           HE2      PHE  44   6.988  -0.140   5.550
  166    HZ   PHE  44           HZ       PHE  44   6.946   1.400   7.503
  167    H    LYS  45           H        LYS  45   3.227   2.112   3.079
  168    HA   LYS  45           HA       LYS  45   1.887   4.487   4.112
  169   1HB   LYS  45          1HB       LYS  45   3.184   3.785   6.117
  170   2HB   LYS  45          2HB       LYS  45   4.657   3.741   5.170
  171   1HG   LYS  45          1HG       LYS  45   4.618   5.720   6.521
  172   2HG   LYS  45          2HG       LYS  45   4.509   6.207   4.832
  173   1HD   LYS  45          1HD       LYS  45   2.081   6.608   5.076
  174   2HD   LYS  45          2HD       LYS  45   2.135   5.986   6.744
  175   1HE   LYS  45          1HE       LYS  45   3.749   7.792   7.342
  176   2HE   LYS  45          2HE       LYS  45   3.652   8.422   5.694
  177   1HZ   LYS  45          3HZ       LYS  45   1.370   8.262   7.596
  178   2HZ   LYS  45          1HZ       LYS  45   2.172   9.623   7.201
  179   3HZ   LYS  45          2HZ       LYS  45   1.280   8.856   6.073
  180    H    CYS  46           H        CYS  46   5.183   3.588   3.030
  181    HA   CYS  46           HA       CYS  46   5.646   6.050   1.762
  182   1HB   CYS  46          1HB       CYS  46   7.650   4.347   0.866
  183   2HB   CYS  46          2HB       CYS  46   7.657   5.340   2.312
  184    H    LYS  47           H        LYS  47   4.642   2.994   0.336
  185    HA   LYS  47           HA       LYS  47   4.100   2.337  -1.789
  186   1HB   LYS  47          1HB       LYS  47   2.120   3.522  -2.564
  187   2HB   LYS  47          2HB       LYS  47   2.137   3.307  -0.818
  188   1HG   LYS  47          1HG       LYS  47   2.861   5.637  -0.503
  189   2HG   LYS  47          2HG       LYS  47   2.891   5.896  -2.251
  190   1HD   LYS  47          1HD       LYS  47   0.502   5.648  -2.395
  191   2HD   LYS  47          2HD       LYS  47   0.381   5.055  -0.730
  192   1HE   LYS  47          1HE       LYS  47   1.460   7.815  -1.454
  193   2HE   LYS  47          2HE       LYS  47  -0.246   7.507  -1.101
  194   1HZ   LYS  47          3HZ       LYS  47   1.934   6.882   0.829
  195   2HZ   LYS  47          1HZ       LYS  47   1.012   8.244   0.879
  196   3HZ   LYS  47          2HZ       LYS  47   0.328   6.766   1.084
  197    H    GLN  48           H        GLN  48   6.619   3.974  -2.030
  198    HA   GLN  48           HA       GLN  48   6.488   5.341  -4.543
  199   1HB   GLN  48          1HB       GLN  48   8.883   4.075  -3.154
  200   2HB   GLN  48          2HB       GLN  48   8.973   5.207  -4.494
  201   1HG   GLN  48          1HG       GLN  48   7.952   5.785  -1.687
  202   2HG   GLN  48          2HG       GLN  48   9.434   6.365  -2.421
  203   1HE2  GLN  48          2HE2      GLN  48   6.113   7.091  -1.908
  204   2HE2  GLN  48          1HE2      GLN  48   6.043   8.484  -2.995
  205    HA   PRO  49           HA       PRO  49   6.028   2.527  -7.671
  206   1HB   PRO  49          2HB       PRO  49   8.614   3.435  -8.954
  207   2HB   PRO  49          1HB       PRO  49   7.013   3.178  -9.718
  208   1HG   PRO  49          1HG       PRO  49   7.775   5.669  -9.028
  209   2HG   PRO  49          2HG       PRO  49   6.110   5.117  -8.650
  210   1HD   PRO  49          1HD       PRO  49   8.496   5.318  -6.814
  211   2HD   PRO  49          2HD       PRO  49   6.786   5.745  -6.520
  212    H    GLY  50           H        GLY  50   9.280   2.046  -6.342
  213   1HA   GLY  50          2HA       GLY  50  10.419  -0.049  -7.524
  214   2HA   GLY  50          1HA       GLY  50   9.017  -0.881  -6.850
  215    H    HIS  51           H        HIS  51   9.632   1.366  -4.539
  216    HA   HIS  51           HA       HIS  51  12.031   0.499  -3.287
  217   1HB   HIS  51          1HB       HIS  51  11.402   1.871  -1.506
  218   2HB   HIS  51          2HB       HIS  51  10.673   2.647  -2.900
  219    HD1  HIS  51           HD1      HIS  51   7.807   1.657  -3.133
  220    HD2  HIS  51           HD2      HIS  51   9.901   1.528   0.527
  221    HE1  HIS  51           HE1      HIS  51   6.089   1.175  -1.332
  222    H    PHE  52           H        PHE  52   8.786  -0.835  -3.119
  223    HA   PHE  52           HA       PHE  52   8.820  -1.926  -0.559
  224   1HB   PHE  52          1HB       PHE  52   6.934  -3.360  -1.389
  225   2HB   PHE  52          2HB       PHE  52   6.766  -1.635  -1.636
  226    HD1  PHE  52           HD1      PHE  52   7.261  -4.889  -3.338
  227    HD2  PHE  52           HD2      PHE  52   6.739  -0.638  -3.872
  228    HE1  PHE  52           HE1      PHE  52   6.838  -5.237  -5.758
  229    HE2  PHE  52           HE2      PHE  52   6.312  -0.996  -6.283
  230    HZ   PHE  52           HZ       PHE  52   6.368  -3.291  -7.236
  231    H    SER  53           H        SER  53   9.795  -3.609  -3.590
  232    HA   SER  53           HA       SER  53  10.410  -6.116  -2.464
  233   1HB   SER  53          1HB       SER  53  11.777  -4.717  -4.792
  234   2HB   SER  53          2HB       SER  53  11.793  -6.461  -4.456
  235    HG   SER  53           HG       SER  53  10.188  -5.891  -5.997
  236    H    LYS  54           H        LYS  54  11.965  -3.245  -1.647
  237    HA   LYS  54           HA       LYS  54  14.374  -4.661  -0.590
  238   1HB   LYS  54          1HB       LYS  54  14.315  -1.821  -1.707
  239   2HB   LYS  54          2HB       LYS  54  15.699  -2.676  -1.043
  240   1HG   LYS  54          1HG       LYS  54  16.190  -3.063  -3.207
  241   2HG   LYS  54          2HG       LYS  54  15.145  -4.444  -2.964
  242   1HD   LYS  54          1HD       LYS  54  14.462  -3.486  -5.033
  243   2HD   LYS  54          2HD       LYS  54  13.219  -3.011  -3.890
  244   1HE   LYS  54          1HE       LYS  54  13.645  -1.095  -5.185
  245   2HE   LYS  54          2HE       LYS  54  14.398  -0.781  -3.619
  246   1HZ   LYS  54          2HZ       LYS  54  15.831  -1.697  -6.066
  247   2HZ   LYS  54          3HZ       LYS  54  15.861  -0.179  -5.475
  248   3HZ   LYS  54          1HZ       LYS  54  16.549  -1.391  -4.630
  249    H    GLN  55           H        GLN  55  11.584  -3.453   0.477
  250    HA   GLN  55           HA       GLN  55  12.731  -2.783   3.096
  251   1HB   GLN  55          1HB       GLN  55  12.686  -0.595   1.822
  252   2HB   GLN  55          2HB       GLN  55  10.931  -0.745   1.716
  253   1HG   GLN  55          1HG       GLN  55  10.897  -0.847   4.276
  254   2HG   GLN  55          2HG       GLN  55  12.629  -0.501   4.246
  255   1HE2  GLN  55          1HE2      GLN  55   9.394   0.769   3.562
  256   2HE2  GLN  55          2HE2      GLN  55   9.872   2.458   3.494
  257    H    CYS  56           H        CYS  56   9.598  -2.598   1.330
  258    HA   CYS  56           HA       CYS  56   8.153  -3.369   3.773
  259   1HB   CYS  56          1HB       CYS  56   7.162  -2.273   1.109
  260   2HB   CYS  56          2HB       CYS  56   6.226  -2.433   2.599
  261    H    ARG  57           H        ARG  57   9.268  -5.005   1.089
  262    HA   ARG  57           HA       ARG  57   7.559  -7.366   1.536
  263   1HB   ARG  57          1HB       ARG  57   6.745  -5.612  -0.355
  264   2HB   ARG  57          2HB       ARG  57   7.984  -6.388  -1.312
  265   1HG   ARG  57          1HG       ARG  57   5.720  -7.311  -1.681
  266   2HG   ARG  57          2HG       ARG  57   6.833  -8.551  -1.116
  267   1HD   ARG  57          1HD       ARG  57   4.535  -8.647  -0.076
  268   2HD   ARG  57          2HD       ARG  57   5.856  -8.584   1.072
  269    HE   ARG  57           HE       ARG  57   5.298  -6.371   1.693
  270   1HH1  ARG  57          1HH2      ARG  57   3.094  -7.386  -0.866
  271   2HH1  ARG  57          2HH2      ARG  57   2.058  -5.995  -0.571
  272   1HH2  ARG  57          2HH1      ARG  57   3.883  -4.704   1.970
  273   2HH2  ARG  57          1HH1      ARG  57   2.474  -4.582   0.924
  274    H    SER  58           H        SER  58  10.457  -6.542   1.839
  275    HA   SER  58           HA       SER  58  12.265  -7.737   0.108
  276   1HB   SER  58          1HB       SER  58  12.423  -7.683   3.142
  277   2HB   SER  58          2HB       SER  58  13.780  -7.853   2.012
  278    HG   SER  58           HG       SER  58  13.480  -5.665   2.715

  No H/Q in entry =         278
  Start of MODEL   17
    1    H1   GLN  22           H2       GLN  22  -8.071  -0.673  -6.214
    2    H2   GLN  22           H1       GLN  22  -7.267   0.655  -5.694
    3    H3   GLN  22           H3       GLN  22  -7.085   0.151  -7.249
    4    HA   GLN  22           HA       GLN  22  -6.037  -1.906  -6.495
    5   1HB   GLN  22          1HB       GLN  22  -4.751   0.721  -5.622
    6   2HB   GLN  22          2HB       GLN  22  -3.974  -0.839  -5.398
    7   1HG   GLN  22          1HG       GLN  22  -3.021  -0.075  -7.338
    8   2HG   GLN  22          2HG       GLN  22  -4.199  -1.247  -7.906
    9   1HE2  GLN  22          1HE2      GLN  22  -2.880   1.498  -8.946
   10   2HE2  GLN  22          2HE2      GLN  22  -4.295   2.281  -9.638
   11    H    THR  23           H        THR  23  -6.218  -3.417  -4.935
   12    HA   THR  23           HA       THR  23  -7.765  -3.123  -2.715
   13    HB   THR  23           HB       THR  23  -5.518  -5.147  -2.908
   14    HG1  THR  23           HG1      THR  23  -7.037  -6.332  -4.147
   15   1HG2  THR  23          1HG2      THR  23  -8.355  -5.318  -1.791
   16   2HG2  THR  23          2HG2      THR  23  -7.205  -6.667  -1.892
   17   3HG2  THR  23          3HG2      THR  23  -6.858  -5.302  -0.825
   18    H    CYS  24           H        CYS  24  -7.639  -2.586  -0.629
   19    HA   CYS  24           HA       CYS  24  -5.658  -0.964   0.449
   20   1HB   CYS  24          1HB       CYS  24  -8.079  -1.358   1.165
   21   2HB   CYS  24          2HB       CYS  24  -7.514  -2.795   2.005
   22    H    TYR  25           H        TYR  25  -3.984  -1.200   1.914
   23    HA   TYR  25           HA       TYR  25  -2.568  -3.702   2.224
   24   1HB   TYR  25          1HB       TYR  25  -1.004  -2.522   3.397
   25   2HB   TYR  25          2HB       TYR  25  -1.635  -1.281   2.339
   26    HD1  TYR  25           HD1      TYR  25  -0.460  -1.793   5.520
   27    HD2  TYR  25           HD2      TYR  25  -3.924  -0.089   3.586
   28    HE1  TYR  25           HE1      TYR  25  -0.906  -0.399   7.531
   29    HE2  TYR  25           HE2      TYR  25  -4.392   1.242   5.611
   30    HH   TYR  25           HH       TYR  25  -2.311   1.126   8.518
   31    H    ASN  26           H        ASN  26  -5.340  -2.506   3.807
   32    HA   ASN  26           HA       ASN  26  -4.996  -4.355   6.152
   33   1HB   ASN  26          1HB       ASN  26  -4.484  -2.076   6.816
   34   2HB   ASN  26          2HB       ASN  26  -5.925  -1.450   6.020
   35   1HD2  ASN  26          1HD2      ASN  26  -7.983  -1.651   7.070
   36   2HD2  ASN  26          2HD2      ASN  26  -8.068  -2.196   8.738
   37    H    CYS  27           H        CYS  27  -7.440  -2.446   4.319
   38    HA   CYS  27           HA       CYS  27  -9.626  -3.750   5.615
   39   1HB   CYS  27          1HB       CYS  27  -9.608  -1.928   3.172
   40   2HB   CYS  27          2HB       CYS  27 -10.966  -2.237   4.262
   41    H    GLY  28           H        GLY  28  -7.897  -4.624   2.742
   42   1HA   GLY  28          2HA       GLY  28  -9.480  -6.944   2.192
   43   2HA   GLY  28          1HA       GLY  28  -8.160  -6.312   1.212
   44    H    LYS  29           H        LYS  29 -10.210  -3.753   1.249
   45    HA   LYS  29           HA       LYS  29 -12.203  -4.624  -0.758
   46   1HB   LYS  29          1HB       LYS  29 -11.644  -2.118   0.802
   47   2HB   LYS  29          2HB       LYS  29 -12.490  -1.971  -0.731
   48   1HG   LYS  29          1HG       LYS  29 -14.082  -2.030   1.005
   49   2HG   LYS  29          2HG       LYS  29 -14.267  -3.483   0.035
   50   1HD   LYS  29          1HD       LYS  29 -12.655  -3.521   2.611
   51   2HD   LYS  29          2HD       LYS  29 -14.418  -3.575   2.651
   52   1HE   LYS  29          1HE       LYS  29 -14.479  -5.595   1.288
   53   2HE   LYS  29          2HE       LYS  29 -12.723  -5.568   1.099
   54   1HZ   LYS  29          1HZ       LYS  29 -14.133  -5.890   3.691
   55   2HZ   LYS  29          2HZ       LYS  29 -13.382  -7.086   2.869
   56   3HZ   LYS  29          3HZ       LYS  29 -12.505  -5.850   3.494
   57    HA   PRO  30           HA       PRO  30  -9.294  -3.884  -4.172
   58   1HB   PRO  30          2HB       PRO  30 -11.908  -3.877  -5.680
   59   2HB   PRO  30          1HB       PRO  30 -10.355  -4.659  -6.112
   60   1HG   PRO  30          1HG       PRO  30 -12.355  -6.128  -5.042
   61   2HG   PRO  30          2HG       PRO  30 -10.673  -6.358  -4.458
   62   1HD   PRO  30          1HD       PRO  30 -12.905  -4.763  -3.182
   63   2HD   PRO  30          2HD       PRO  30 -11.739  -5.893  -2.432
   64    H    GLY  31           H        GLY  31 -12.212  -1.906  -3.692
   65   1HA   GLY  31          2HA       GLY  31 -12.811   0.218  -4.333
   66   2HA   GLY  31          1HA       GLY  31 -11.521   0.193  -5.533
   67    H    HIS  32           H        HIS  32  -9.540  -0.316  -3.199
   68    HA   HIS  32           HA       HIS  32  -9.516   2.296  -1.849
   69   1HB   HIS  32          1HB       HIS  32  -8.012  -0.274  -1.589
   70   2HB   HIS  32          2HB       HIS  32  -7.181   1.198  -1.104
   71    HD1  HIS  32           HD1      HIS  32 -10.666  -0.375  -0.380
   72    HD2  HIS  32           HD2      HIS  32  -7.582   1.895   1.327
   73    HE1  HIS  32           HE1      HIS  32 -11.338   0.027   2.063
   74    H    LEU  33           H        LEU  33  -7.566   3.524  -1.751
   75    HA   LEU  33           HA       LEU  33  -5.986   3.946  -4.190
   76   1HB   LEU  33          1HB       LEU  33  -8.086   5.901  -3.108
   77   2HB   LEU  33          2HB       LEU  33  -6.824   6.371  -4.231
   78    HG   LEU  33           HG       LEU  33  -9.020   4.359  -4.863
   79   1HD1  LEU  33          1HD1      LEU  33  -9.867   6.648  -4.582
   80   2HD1  LEU  33          2HD1      LEU  33  -8.641   7.255  -5.715
   81   3HD1  LEU  33          3HD1      LEU  33  -9.915   6.152  -6.281
   82   1HD2  LEU  33          2HD2      LEU  33  -6.896   5.664  -6.633
   83   2HD2  LEU  33          3HD2      LEU  33  -6.979   3.940  -6.204
   84   3HD2  LEU  33          1HD2      LEU  33  -8.243   4.657  -7.206
   85    H    SER  34           H        SER  34  -4.559   5.880  -3.802
   86    HA   SER  34           HA       SER  34  -3.010   5.778  -1.466
   87   1HB   SER  34          1HB       SER  34  -2.412   6.673  -3.739
   88   2HB   SER  34          2HB       SER  34  -3.338   8.137  -3.356
   89    HG   SER  34           HG       SER  34  -1.121   8.388  -2.908
   90    H    SER  35           H        SER  35  -6.034   7.424  -1.829
   91    HA   SER  35           HA       SER  35  -5.683   8.939   0.721
   92   1HB   SER  35          1HB       SER  35  -7.506  10.368  -0.159
   93   2HB   SER  35          2HB       SER  35  -6.074  10.360  -1.203
   94    HG   SER  35           HG       SER  35  -8.044  10.095  -2.389
   95    H    GLN  36           H        GLN  36  -7.205   6.133  -0.454
   96    HA   GLN  36           HA       GLN  36  -9.677   6.344   1.131
   97   1HB   GLN  36          1HB       GLN  36  -9.283   5.010  -1.081
   98   2HB   GLN  36          2HB       GLN  36  -8.489   3.824  -0.052
   99   1HG   GLN  36          1HG       GLN  36 -10.665   2.988  -0.132
  100   2HG   GLN  36          2HG       GLN  36 -10.754   3.932   1.341
  101   1HE2  GLN  36          1HE2      GLN  36 -11.820   3.674  -2.058
  102   2HE2  GLN  36          2HE2      GLN  36 -12.970   4.995  -1.940
  103    H    CYS  37           H        CYS  37  -6.526   4.775   1.344
  104    HA   CYS  37           HA       CYS  37  -6.529   4.926   4.254
  105   1HB   CYS  37          1HB       CYS  37  -6.110   2.321   2.732
  106   2HB   CYS  37          2HB       CYS  37  -5.255   2.622   4.222
  107    H    ARG  38           H        ARG  38  -4.114   4.303   4.931
  108    HA   ARG  38           HA       ARG  38  -2.369   6.249   3.883
  109   1HB   ARG  38          1HB       ARG  38  -1.715   3.686   5.408
  110   2HB   ARG  38          2HB       ARG  38  -0.556   4.944   5.014
  111   1HG   ARG  38          1HG       ARG  38  -0.997   5.620   7.079
  112   2HG   ARG  38          2HG       ARG  38  -2.244   6.558   6.277
  113   1HD   ARG  38          1HD       ARG  38  -2.769   3.801   7.463
  114   2HD   ARG  38          2HD       ARG  38  -2.756   5.238   8.470
  115    HE   ARG  38           HE       ARG  38  -4.558   6.171   6.965
  116   1HH1  ARG  38          1HH1      ARG  38  -4.378   2.692   7.570
  117   2HH1  ARG  38          2HH1      ARG  38  -6.090   2.511   7.279
  118   1HH2  ARG  38          2HH2      ARG  38  -6.732   5.807   6.699
  119   2HH2  ARG  38          1HH2      ARG  38  -7.323   4.170   6.673
  120    H    ALA  39           H        ALA  39  -2.598   2.835   2.876
  121    HA   ALA  39           HA       ALA  39  -1.489   3.533   0.279
  122   1HB   ALA  39          3HB       ALA  39  -0.034   1.536   2.077
  123   2HB   ALA  39          1HB       ALA  39   0.367   1.869   0.388
  124   3HB   ALA  39          2HB       ALA  39   0.591   3.136   1.606
  125    HA   PRO  40           HA       PRO  40  -3.690  -0.412  -0.715
  126   1HB   PRO  40          2HB       PRO  40  -2.613  -1.021  -3.134
  127   2HB   PRO  40          1HB       PRO  40  -3.754   0.342  -2.924
  128   1HG   PRO  40          1HG       PRO  40  -0.722   0.455  -3.005
  129   2HG   PRO  40          2HG       PRO  40  -1.889   1.458  -3.923
  130   1HD   PRO  40          1HD       PRO  40  -0.729   2.287  -1.581
  131   2HD   PRO  40          2HD       PRO  40  -2.392   2.761  -2.034
  132    H    LYS  41           H        LYS  41  -2.950  -2.706  -1.191
  133    HA   LYS  41           HA       LYS  41  -1.040  -3.578   0.687
  134   1HB   LYS  41          1HB       LYS  41  -1.476  -5.805  -0.089
  135   2HB   LYS  41          2HB       LYS  41  -2.977  -4.892  -0.068
  136   1HG   LYS  41          1HG       LYS  41  -2.865  -4.601  -2.529
  137   2HG   LYS  41          2HG       LYS  41  -1.318  -5.468  -2.566
  138   1HD   LYS  41          1HD       LYS  41  -2.416  -7.485  -1.628
  139   2HD   LYS  41          2HD       LYS  41  -3.973  -6.631  -1.608
  140   1HE   LYS  41          1HE       LYS  41  -3.868  -6.360  -4.068
  141   2HE   LYS  41          2HE       LYS  41  -2.280  -7.137  -4.101
  142   1HZ   LYS  41          1HZ       LYS  41  -4.788  -8.473  -3.215
  143   2HZ   LYS  41          2HZ       LYS  41  -4.053  -8.706  -4.654
  144   3HZ   LYS  41          3HZ       LYS  41  -3.315  -9.175  -3.278
  145    H    VAL  42           H        VAL  42  -0.161  -2.289  -2.226
  146    HA   VAL  42           HA       VAL  42   2.342  -3.591  -2.798
  147    HB   VAL  42           HB       VAL  42   1.533  -0.660  -3.031
  148   1HG1  VAL  42          3HG1      VAL  42   3.766  -2.210  -4.398
  149   2HG1  VAL  42          1HG1      VAL  42   3.260  -0.557  -4.818
  150   3HG1  VAL  42          2HG1      VAL  42   3.958  -0.879  -3.232
  151   1HG2  VAL  42          2HG2      VAL  42   1.382  -2.920  -5.075
  152   2HG2  VAL  42          3HG2      VAL  42  -0.002  -2.082  -4.339
  153   3HG2  VAL  42          1HG2      VAL  42   1.078  -1.204  -5.416
  154    H    CYS  43           H        CYS  43   1.335  -1.292  -0.280
  155    HA   CYS  43           HA       CYS  43   3.952  -1.479   1.104
  156   1HB   CYS  43          1HB       CYS  43   3.976   0.357  -0.638
  157   2HB   CYS  43          2HB       CYS  43   2.678   1.160   0.252
  158    H    PHE  44           H        PHE  44   3.324   0.690   2.782
  159    HA   PHE  44           HA       PHE  44   0.693   0.238   4.056
  160   1HB   PHE  44          1HB       PHE  44   1.513  -0.086   6.229
  161   2HB   PHE  44          2HB       PHE  44   2.433  -1.199   5.238
  162    HD1  PHE  44           HD1      PHE  44   2.561   1.592   7.547
  163    HD2  PHE  44           HD2      PHE  44   4.854  -0.521   4.562
  164    HE1  PHE  44           HE1      PHE  44   4.643   2.637   8.405
  165    HE2  PHE  44           HE2      PHE  44   6.930   0.534   5.420
  166    HZ   PHE  44           HZ       PHE  44   6.830   2.116   7.336
  167    H    LYS  45           H        LYS  45   3.345   2.358   3.246
  168    HA   LYS  45           HA       LYS  45   1.782   4.744   3.949
  169   1HB   LYS  45          1HB       LYS  45   2.844   4.167   6.106
  170   2HB   LYS  45          2HB       LYS  45   4.422   4.085   5.336
  171   1HG   LYS  45          1HG       LYS  45   4.207   6.128   6.596
  172   2HG   LYS  45          2HG       LYS  45   4.350   6.517   4.885
  173   1HD   LYS  45          1HD       LYS  45   1.904   6.923   4.756
  174   2HD   LYS  45          2HD       LYS  45   1.733   6.444   6.463
  175   1HE   LYS  45          1HE       LYS  45   3.279   8.292   7.112
  176   2HE   LYS  45          2HE       LYS  45   3.416   8.771   5.416
  177   1HZ   LYS  45          2HZ       LYS  45   1.020   9.243   5.427
  178   2HZ   LYS  45          3HZ       LYS  45   0.899   8.803   7.000
  179   3HZ   LYS  45          1HZ       LYS  45   1.768  10.116   6.582
  180    H    CYS  46           H        CYS  46   5.165   3.792   3.126
  181    HA   CYS  46           HA       CYS  46   5.739   6.239   1.864
  182   1HB   CYS  46          1HB       CYS  46   7.720   4.505   1.005
  183   2HB   CYS  46          2HB       CYS  46   7.710   5.474   2.469
  184    H    LYS  47           H        LYS  47   4.663   3.221   0.423
  185    HA   LYS  47           HA       LYS  47   4.096   2.606  -1.710
  186   1HB   LYS  47          1HB       LYS  47   2.078   3.773  -2.357
  187   2HB   LYS  47          2HB       LYS  47   2.202   3.547  -0.621
  188   1HG   LYS  47          1HG       LYS  47   3.032   5.964  -0.464
  189   2HG   LYS  47          2HG       LYS  47   2.589   6.151  -2.160
  190   1HD   LYS  47          1HD       LYS  47   0.257   5.793  -1.649
  191   2HD   LYS  47          2HD       LYS  47   0.646   5.156  -0.034
  192   1HE   LYS  47          1HE       LYS  47   1.593   7.354   0.618
  193   2HE   LYS  47          2HE       LYS  47   1.123   8.022  -0.955
  194   1HZ   LYS  47          2HZ       LYS  47  -0.777   6.856   1.008
  195   2HZ   LYS  47          3HZ       LYS  47  -0.525   8.467   0.814
  196   3HZ   LYS  47          1HZ       LYS  47  -1.176   7.604  -0.409
  197    H    GLN  48           H        GLN  48   6.626   4.117  -2.017
  198    HA   GLN  48           HA       GLN  48   6.463   5.542  -4.509
  199   1HB   GLN  48          1HB       GLN  48   8.860   4.184  -3.212
  200   2HB   GLN  48          2HB       GLN  48   8.938   5.330  -4.539
  201   1HG   GLN  48          1HG       GLN  48   8.040   5.904  -1.690
  202   2HG   GLN  48          2HG       GLN  48   9.512   6.445  -2.472
  203   1HE2  GLN  48          2HE2      GLN  48   6.244   7.277  -1.821
  204   2HE2  GLN  48          1HE2      GLN  48   6.177   8.682  -2.893
  205    HA   PRO  49           HA       PRO  49   5.884   2.704  -7.634
  206   1HB   PRO  49          2HB       PRO  49   8.423   3.627  -8.994
  207   2HB   PRO  49          1HB       PRO  49   6.796   3.377  -9.703
  208   1HG   PRO  49          1HG       PRO  49   7.589   5.862  -9.028
  209   2HG   PRO  49          2HG       PRO  49   5.937   5.313  -8.593
  210   1HD   PRO  49          1HD       PRO  49   8.388   5.482  -6.842
  211   2HD   PRO  49          2HD       PRO  49   6.697   5.934  -6.490
  212    H    GLY  50           H        GLY  50   9.101   2.175  -6.286
  213   1HA   GLY  50          2HA       GLY  50  10.268   0.136  -7.556
  214   2HA   GLY  50          1HA       GLY  50   8.861  -0.724  -6.939
  215    H    HIS  51           H        HIS  51   9.617   1.515  -4.579
  216    HA   HIS  51           HA       HIS  51  11.939   0.481  -3.343
  217   1HB   HIS  51          1HB       HIS  51  11.397   1.887  -1.555
  218   2HB   HIS  51          2HB       HIS  51  10.704   2.705  -2.942
  219    HD1  HIS  51           HD1      HIS  51   7.785   1.791  -3.160
  220    HD2  HIS  51           HD2      HIS  51   9.895   1.732   0.493
  221    HE1  HIS  51           HE1      HIS  51   6.063   1.444  -1.333
  222    H    PHE  52           H        PHE  52   8.654  -0.716  -3.202
  223    HA   PHE  52           HA       PHE  52   8.607  -1.799  -0.622
  224   1HB   PHE  52          1HB       PHE  52   6.666  -3.136  -1.518
  225   2HB   PHE  52          2HB       PHE  52   6.579  -1.398  -1.701
  226    HD1  PHE  52           HD1      PHE  52   6.997  -4.610  -3.523
  227    HD2  PHE  52           HD2      PHE  52   6.565  -0.330  -3.890
  228    HE1  PHE  52           HE1      PHE  52   6.579  -4.853  -5.956
  229    HE2  PHE  52           HE2      PHE  52   6.130  -0.585  -6.311
  230    HZ   PHE  52           HZ       PHE  52   6.150  -2.841  -7.358
  231    H    SER  53           H        SER  53   9.534  -3.480  -3.657
  232    HA   SER  53           HA       SER  53  10.012  -6.046  -2.552
  233   1HB   SER  53          1HB       SER  53  11.403  -4.689  -4.894
  234   2HB   SER  53          2HB       SER  53  11.344  -6.434  -4.576
  235    HG   SER  53           HG       SER  53   9.749  -5.780  -6.090
  236    H    LYS  54           H        LYS  54  11.674  -3.262  -1.729
  237    HA   LYS  54           HA       LYS  54  14.152  -4.717  -0.892
  238   1HB   LYS  54          1HB       LYS  54  13.958  -1.858  -1.938
  239   2HB   LYS  54          2HB       LYS  54  15.428  -2.710  -1.456
  240   1HG   LYS  54          1HG       LYS  54  15.074  -4.348  -3.311
  241   2HG   LYS  54          2HG       LYS  54  13.650  -3.422  -3.831
  242   1HD   LYS  54          1HD       LYS  54  15.083  -1.413  -4.158
  243   2HD   LYS  54          2HD       LYS  54  16.511  -2.386  -3.728
  244   1HE   LYS  54          1HE       LYS  54  15.994  -3.945  -5.604
  245   2HE   LYS  54          2HE       LYS  54  14.582  -2.968  -6.027
  246   1HZ   LYS  54          1HZ       LYS  54  16.094  -1.105  -6.482
  247   2HZ   LYS  54          2HZ       LYS  54  17.398  -2.016  -6.101
  248   3HZ   LYS  54          3HZ       LYS  54  16.494  -2.391  -7.404
  249    H    GLN  55           H        GLN  55  11.458  -3.432   0.386
  250    HA   GLN  55           HA       GLN  55  12.762  -2.872   2.952
  251   1HB   GLN  55          1HB       GLN  55  12.834  -0.664   1.787
  252   2HB   GLN  55          2HB       GLN  55  11.080  -0.703   1.613
  253   1HG   GLN  55          1HG       GLN  55  10.887  -0.779   4.134
  254   2HG   GLN  55          2HG       GLN  55  12.648  -0.665   4.235
  255   1HE2  GLN  55          1HE2      GLN  55   9.666   1.066   3.407
  256   2HE2  GLN  55          2HE2      GLN  55  10.399   2.667   3.408
  257    H    CYS  56           H        CYS  56   9.547  -2.244   1.453
  258    HA   CYS  56           HA       CYS  56   8.251  -2.929   3.941
  259   1HB   CYS  56          1HB       CYS  56   7.132  -1.965   1.273
  260   2HB   CYS  56          2HB       CYS  56   6.290  -1.959   2.830
  261    H    ARG  57           H        ARG  57   8.753  -4.679   1.017
  262    HA   ARG  57           HA       ARG  57   6.829  -6.828   1.765
  263   1HB   ARG  57          1HB       ARG  57   6.195  -4.865  -0.098
  264   2HB   ARG  57          2HB       ARG  57   6.971  -6.043  -1.129
  265   1HG   ARG  57          1HG       ARG  57   4.924  -7.005  -1.240
  266   2HG   ARG  57          2HG       ARG  57   5.267  -7.671   0.352
  267   1HD   ARG  57          1HD       ARG  57   3.692  -5.169  -0.357
  268   2HD   ARG  57          2HD       ARG  57   3.079  -6.644   0.400
  269    HE   ARG  57           HE       ARG  57   5.097  -5.521   2.092
  270   1HH1  ARG  57          1HH1      ARG  57   1.885  -4.630   1.042
  271   2HH1  ARG  57          2HH1      ARG  57   1.709  -3.464   2.331
  272   1HH2  ARG  57          1HH2      ARG  57   4.764  -4.196   3.739
  273   2HH2  ARG  57          2HH2      ARG  57   3.212  -3.407   3.974
  274    H    SER  58           H        SER  58   9.878  -6.388   1.520
  275    HA   SER  58           HA       SER  58  11.180  -7.816  -0.422
  276   1HB   SER  58          1HB       SER  58  11.844  -7.880   2.540
  277   2HB   SER  58          2HB       SER  58  12.960  -8.146   1.188
  278    HG   SER  58           HG       SER  58  13.021  -5.973   2.012

  No H/Q in entry =         278
  Start of MODEL   18
    1    H1   GLN  22           H2       GLN  22  -8.094  -0.647  -6.230
    2    H2   GLN  22           H1       GLN  22  -7.193   0.634  -5.766
    3    H3   GLN  22           H3       GLN  22  -7.083   0.068  -7.310
    4    HA   GLN  22           HA       GLN  22  -6.135  -2.014  -6.538
    5   1HB   GLN  22          1HB       GLN  22  -4.685   0.464  -5.498
    6   2HB   GLN  22          2HB       GLN  22  -3.987  -1.158  -5.564
    7   1HG   GLN  22          1HG       GLN  22  -4.312  -1.198  -8.036
    8   2HG   GLN  22          2HG       GLN  22  -4.924   0.460  -7.971
    9   1HE2  GLN  22          2HE2      GLN  22  -2.941   0.458  -9.615
   10   2HE2  GLN  22          1HE2      GLN  22  -1.421   0.931  -8.864
   11    H    THR  23           H        THR  23  -6.257  -3.523  -4.942
   12    HA   THR  23           HA       THR  23  -7.778  -3.230  -2.685
   13    HB   THR  23           HB       THR  23  -5.477  -5.195  -2.934
   14    HG1  THR  23           HG1      THR  23  -6.948  -6.431  -4.107
   15   1HG2  THR  23          2HG2      THR  23  -8.245  -5.444  -1.661
   16   2HG2  THR  23          3HG2      THR  23  -7.043  -6.743  -1.797
   17   3HG2  THR  23          1HG2      THR  23  -6.701  -5.345  -0.774
   18    H    CYS  24           H        CYS  24  -7.595  -2.670  -0.606
   19    HA   CYS  24           HA       CYS  24  -5.607  -0.987   0.383
   20   1HB   CYS  24          1HB       CYS  24  -8.015  -1.385   1.136
   21   2HB   CYS  24          2HB       CYS  24  -7.424  -2.794   2.016
   22    H    TYR  25           H        TYR  25  -3.966  -1.180   1.920
   23    HA   TYR  25           HA       TYR  25  -2.506  -3.665   2.261
   24   1HB   TYR  25          1HB       TYR  25  -0.982  -2.456   3.465
   25   2HB   TYR  25          2HB       TYR  25  -1.590  -1.242   2.360
   26    HD1  TYR  25           HD1      TYR  25  -0.516  -1.690   5.596
   27    HD2  TYR  25           HD2      TYR  25  -3.908  -0.029   3.509
   28    HE1  TYR  25           HE1      TYR  25  -1.010  -0.225   7.547
   29    HE2  TYR  25           HE2      TYR  25  -4.437   1.351   5.480
   30    HH   TYR  25           HH       TYR  25  -2.436   1.348   8.439
   31    H    ASN  26           H        ASN  26  -5.294  -2.426   3.805
   32    HA   ASN  26           HA       ASN  26  -4.963  -4.211   6.204
   33   1HB   ASN  26          1HB       ASN  26  -4.422  -1.917   6.785
   34   2HB   ASN  26          2HB       ASN  26  -5.857  -1.301   5.971
   35   1HD2  ASN  26          1HD2      ASN  26  -7.915  -1.436   7.033
   36   2HD2  ASN  26          2HD2      ASN  26  -8.000  -1.912   8.722
   37    H    CYS  27           H        CYS  27  -7.375  -2.368   4.272
   38    HA   CYS  27           HA       CYS  27  -9.589  -3.587   5.613
   39   1HB   CYS  27          1HB       CYS  27  -9.515  -1.834   3.127
   40   2HB   CYS  27          2HB       CYS  27 -10.898  -2.104   4.193
   41    H    GLY  28           H        GLY  28  -7.773  -4.813   3.022
   42   1HA   GLY  28          2HA       GLY  28  -9.338  -7.096   2.558
   43   2HA   GLY  28          1HA       GLY  28  -8.067  -6.497   1.488
   44    H    LYS  29           H        LYS  29  -9.429  -4.009   0.807
   45    HA   LYS  29           HA       LYS  29 -11.835  -4.939  -0.703
   46   1HB   LYS  29          1HB       LYS  29 -12.178  -3.541   1.396
   47   2HB   LYS  29          2HB       LYS  29 -11.390  -2.227   0.559
   48   1HG   LYS  29          1HG       LYS  29 -13.499  -1.663  -0.032
   49   2HG   LYS  29          2HG       LYS  29 -13.287  -2.847  -1.316
   50   1HD   LYS  29          1HD       LYS  29 -14.621  -3.278   1.395
   51   2HD   LYS  29          2HD       LYS  29 -15.437  -3.131  -0.166
   52   1HE   LYS  29          1HE       LYS  29 -14.348  -5.226  -0.940
   53   2HE   LYS  29          2HE       LYS  29 -13.524  -5.378   0.622
   54   1HZ   LYS  29          1HZ       LYS  29 -16.472  -5.413   0.248
   55   2HZ   LYS  29          2HZ       LYS  29 -15.544  -6.719   0.557
   56   3HZ   LYS  29          3HZ       LYS  29 -15.706  -5.553   1.685
   57    HA   PRO  30           HA       PRO  30  -9.244  -3.842  -4.227
   58   1HB   PRO  30          2HB       PRO  30 -11.947  -3.928  -5.574
   59   2HB   PRO  30          1HB       PRO  30 -10.374  -4.561  -6.157
   60   1HG   PRO  30          1HG       PRO  30 -12.155  -6.240  -5.022
   61   2HG   PRO  30          2HG       PRO  30 -10.423  -6.345  -4.565
   62   1HD   PRO  30          1HD       PRO  30 -12.693  -5.044  -3.058
   63   2HD   PRO  30          2HD       PRO  30 -11.343  -6.050  -2.449
   64    H    GLY  31           H        GLY  31 -12.189  -1.948  -3.574
   65   1HA   GLY  31          2HA       GLY  31 -12.858   0.176  -4.147
   66   2HA   GLY  31          1HA       GLY  31 -11.638   0.187  -5.418
   67    H    HIS  32           H        HIS  32  -9.455  -0.271  -3.346
   68    HA   HIS  32           HA       HIS  32  -9.450   2.299  -1.885
   69   1HB   HIS  32          1HB       HIS  32  -7.999  -0.297  -1.625
   70   2HB   HIS  32          2HB       HIS  32  -7.132   1.155  -1.142
   71    HD1  HIS  32           HD1      HIS  32 -10.573  -0.472  -0.380
   72    HD2  HIS  32           HD2      HIS  32  -7.588   1.976   1.246
   73    HE1  HIS  32           HE1      HIS  32 -11.261  -0.021   2.052
   74    H    LEU  33           H        LEU  33  -7.522   3.511  -1.761
   75    HA   LEU  33           HA       LEU  33  -5.869   3.953  -4.144
   76   1HB   LEU  33          1HB       LEU  33  -7.981   5.916  -3.105
   77   2HB   LEU  33          2HB       LEU  33  -6.700   6.364  -4.217
   78    HG   LEU  33           HG       LEU  33  -8.917   4.377  -4.861
   79   1HD1  LEU  33          2HD1      LEU  33  -9.746   6.672  -4.585
   80   2HD1  LEU  33          3HD1      LEU  33  -8.511   7.268  -5.714
   81   3HD1  LEU  33          1HD1      LEU  33  -9.790   6.173  -6.284
   82   1HD2  LEU  33          3HD2      LEU  33  -6.779   5.666  -6.625
   83   2HD2  LEU  33          1HD2      LEU  33  -6.862   3.946  -6.183
   84   3HD2  LEU  33          2HD2      LEU  33  -8.124   4.654  -7.196
   85    H    SER  34           H        SER  34  -4.420   5.876  -3.671
   86    HA   SER  34           HA       SER  34  -3.142   5.858  -1.122
   87   1HB   SER  34          1HB       SER  34  -2.012   7.911  -2.033
   88   2HB   SER  34          2HB       SER  34  -1.963   6.507  -3.115
   89    HG   SER  34           HG       SER  34  -2.556   8.458  -4.207
   90    H    SER  35           H        SER  35  -6.062   7.436  -2.026
   91    HA   SER  35           HA       SER  35  -6.004   9.268   0.323
   92   1HB   SER  35          1HB       SER  35  -7.960  10.305  -0.791
   93   2HB   SER  35          2HB       SER  35  -6.507  10.315  -1.806
   94    HG   SER  35           HG       SER  35  -8.396   9.627  -2.952
   95    H    GLN  36           H        GLN  36  -7.191   6.176  -0.520
   96    HA   GLN  36           HA       GLN  36  -9.661   6.339   1.104
   97   1HB   GLN  36          1HB       GLN  36  -9.287   5.015  -1.134
   98   2HB   GLN  36          2HB       GLN  36  -8.459   3.846  -0.112
   99   1HG   GLN  36          1HG       GLN  36 -10.629   2.988  -0.163
  100   2HG   GLN  36          2HG       GLN  36 -10.697   3.924   1.319
  101   1HE2  GLN  36          1HE2      GLN  36 -11.861   3.640  -2.035
  102   2HE2  GLN  36          2HE2      GLN  36 -13.003   4.967  -1.903
  103    H    CYS  37           H        CYS  37  -6.423   4.898   1.218
  104    HA   CYS  37           HA       CYS  37  -6.418   4.951   4.138
  105   1HB   CYS  37          1HB       CYS  37  -6.062   2.411   2.523
  106   2HB   CYS  37          2HB       CYS  37  -5.073   2.646   3.928
  107    H    ARG  38           H        ARG  38  -4.068   4.382   4.868
  108    HA   ARG  38           HA       ARG  38  -2.231   6.279   3.861
  109   1HB   ARG  38          1HB       ARG  38  -1.762   3.749   5.505
  110   2HB   ARG  38          2HB       ARG  38  -0.504   4.897   5.086
  111   1HG   ARG  38          1HG       ARG  38  -0.933   5.749   7.069
  112   2HG   ARG  38          2HG       ARG  38  -2.137   6.686   6.206
  113   1HD   ARG  38          1HD       ARG  38  -2.796   4.036   7.565
  114   2HD   ARG  38          2HD       ARG  38  -2.692   5.527   8.479
  115    HE   ARG  38           HE       ARG  38  -4.488   6.494   7.127
  116   1HH1  ARG  38          1HH1      ARG  38  -4.389   2.962   7.231
  117   2HH1  ARG  38          2HH1      ARG  38  -6.041   2.866   6.656
  118   1HH2  ARG  38          2HH2      ARG  38  -6.642   6.214   6.678
  119   2HH2  ARG  38          1HH2      ARG  38  -7.265   4.607   6.431
  120    H    ALA  39           H        ALA  39  -2.588   2.886   2.848
  121    HA   ALA  39           HA       ALA  39  -1.377   3.553   0.305
  122   1HB   ALA  39          1HB       ALA  39   0.675   3.062   1.634
  123   2HB   ALA  39          2HB       ALA  39  -0.021   1.489   2.102
  124   3HB   ALA  39          3HB       ALA  39   0.407   1.805   0.416
  125    HA   PRO  40           HA       PRO  40  -3.672  -0.306  -0.785
  126   1HB   PRO  40          2HB       PRO  40  -2.580  -0.897  -3.202
  127   2HB   PRO  40          1HB       PRO  40  -3.692   0.486  -2.977
  128   1HG   PRO  40          1HG       PRO  40  -0.658   0.530  -3.030
  129   2HG   PRO  40          2HG       PRO  40  -1.793   1.582  -3.933
  130   1HD   PRO  40          1HD       PRO  40  -0.629   2.324  -1.564
  131   2HD   PRO  40          2HD       PRO  40  -2.271   2.860  -2.024
  132    H    LYS  41           H        LYS  41  -2.975  -2.578  -1.364
  133    HA   LYS  41           HA       LYS  41  -1.251  -3.701   0.521
  134   1HB   LYS  41          1HB       LYS  41  -3.222  -4.676  -0.797
  135   2HB   LYS  41          2HB       LYS  41  -2.079  -5.017  -2.095
  136   1HG   LYS  41          1HG       LYS  41  -0.806  -6.505  -0.591
  137   2HG   LYS  41          2HG       LYS  41  -1.847  -6.045   0.775
  138   1HD   LYS  41          1HD       LYS  41  -3.814  -6.977  -0.441
  139   2HD   LYS  41          2HD       LYS  41  -2.760  -7.497  -1.760
  140   1HE   LYS  41          1HE       LYS  41  -2.530  -8.410   1.149
  141   2HE   LYS  41          2HE       LYS  41  -3.388  -9.297  -0.113
  142   1HZ   LYS  41          1HZ       LYS  41  -1.281  -9.497  -1.326
  143   2HZ   LYS  41          2HZ       LYS  41  -0.475  -8.708  -0.138
  144   3HZ   LYS  41          3HZ       LYS  41  -1.154 -10.159   0.157
  145    H    VAL  42           H        VAL  42  -0.220  -2.304  -2.382
  146    HA   VAL  42           HA       VAL  42   2.298  -3.531  -2.899
  147    HB   VAL  42           HB       VAL  42   1.495  -0.593  -3.029
  148   1HG1  VAL  42          1HG1      VAL  42   3.739  -2.089  -4.438
  149   2HG1  VAL  42          2HG1      VAL  42   3.232  -0.424  -4.803
  150   3HG1  VAL  42          3HG1      VAL  42   3.920  -0.799  -3.226
  151   1HG2  VAL  42          1HG2      VAL  42   1.354  -2.771  -5.162
  152   2HG2  VAL  42          2HG2      VAL  42  -0.034  -1.960  -4.403
  153   3HG2  VAL  42          3HG2      VAL  42   1.056  -1.041  -5.436
  154    H    CYS  43           H        CYS  43   1.287  -1.334  -0.288
  155    HA   CYS  43           HA       CYS  43   3.918  -1.543   1.060
  156   1HB   CYS  43          1HB       CYS  43   3.927   0.318  -0.653
  157   2HB   CYS  43          2HB       CYS  43   2.638   1.109   0.260
  158    H    PHE  44           H        PHE  44   3.271   0.643   2.761
  159    HA   PHE  44           HA       PHE  44   0.672   0.116   4.061
  160   1HB   PHE  44          1HB       PHE  44   1.515  -0.202   6.228
  161   2HB   PHE  44          2HB       PHE  44   2.444  -1.294   5.220
  162    HD1  PHE  44           HD1      PHE  44   2.540   1.519   7.519
  163    HD2  PHE  44           HD2      PHE  44   4.851  -0.613   4.562
  164    HE1  PHE  44           HE1      PHE  44   4.614   2.583   8.373
  165    HE2  PHE  44           HE2      PHE  44   6.922   0.456   5.422
  166    HZ   PHE  44           HZ       PHE  44   6.807   2.059   7.319
  167    H    LYS  45           H        LYS  45   3.317   2.303   3.330
  168    HA   LYS  45           HA       LYS  45   1.637   4.634   3.977
  169   1HB   LYS  45          1HB       LYS  45   2.717   4.016   6.151
  170   2HB   LYS  45          2HB       LYS  45   4.306   4.207   5.405
  171   1HG   LYS  45          1HG       LYS  45   3.797   6.618   4.987
  172   2HG   LYS  45          2HG       LYS  45   2.192   6.391   5.715
  173   1HD   LYS  45          1HD       LYS  45   3.275   5.725   7.859
  174   2HD   LYS  45          2HD       LYS  45   4.872   5.970   7.118
  175   1HE   LYS  45          1HE       LYS  45   4.292   8.357   6.691
  176   2HE   LYS  45          2HE       LYS  45   2.717   8.107   7.454
  177   1HZ   LYS  45          3HZ       LYS  45   3.888   7.562   9.529
  178   2HZ   LYS  45          1HZ       LYS  45   5.343   7.804   8.820
  179   3HZ   LYS  45          2HZ       LYS  45   4.312   9.053   9.021
  180    H    CYS  46           H        CYS  46   5.072   3.795   3.180
  181    HA   CYS  46           HA       CYS  46   5.515   6.298   1.917
  182   1HB   CYS  46          1HB       CYS  46   7.709   5.000   1.241
  183   2HB   CYS  46          2HB       CYS  46   7.386   5.522   2.891
  184    H    LYS  47           H        LYS  47   4.652   3.192   0.516
  185    HA   LYS  47           HA       LYS  47   4.133   2.524  -1.613
  186   1HB   LYS  47          1HB       LYS  47   2.101   3.629  -2.340
  187   2HB   LYS  47          2HB       LYS  47   2.167   3.420  -0.595
  188   1HG   LYS  47          1HG       LYS  47   2.813   5.801  -0.323
  189   2HG   LYS  47          2HG       LYS  47   2.717   6.036  -2.069
  190   1HD   LYS  47          1HD       LYS  47   0.352   5.654  -2.075
  191   2HD   LYS  47          2HD       LYS  47   0.356   5.028  -0.420
  192   1HE   LYS  47          1HE       LYS  47   1.207   7.872  -1.108
  193   2HE   LYS  47          2HE       LYS  47  -0.468   7.441  -0.740
  194   1HZ   LYS  47          2HZ       LYS  47   1.785   6.956   1.142
  195   2HZ   LYS  47          3HZ       LYS  47   0.723   8.207   1.247
  196   3HZ   LYS  47          1HZ       LYS  47   0.217   6.656   1.425
  197    H    GLN  48           H        GLN  48   6.612   4.141  -1.908
  198    HA   GLN  48           HA       GLN  48   6.422   5.582  -4.374
  199   1HB   GLN  48          1HB       GLN  48   8.847   4.257  -3.087
  200   2HB   GLN  48          2HB       GLN  48   8.909   5.418  -4.404
  201   1HG   GLN  48          1HG       GLN  48   7.955   5.950  -1.563
  202   2HG   GLN  48          2HG       GLN  48   9.433   6.520  -2.310
  203   1HE2  GLN  48          2HE2      GLN  48   6.127   7.284  -1.736
  204   2HE2  GLN  48          1HE2      GLN  48   6.065   8.698  -2.794
  205    HA   PRO  49           HA       PRO  49   5.887   2.846  -7.577
  206   1HB   PRO  49          2HB       PRO  49   8.412   3.839  -8.914
  207   2HB   PRO  49          1HB       PRO  49   6.787   3.588  -9.629
  208   1HG   PRO  49          1HG       PRO  49   7.545   6.062  -8.880
  209   2HG   PRO  49          2HG       PRO  49   5.902   5.475  -8.459
  210   1HD   PRO  49          1HD       PRO  49   8.354   5.630  -6.708
  211   2HD   PRO  49          2HD       PRO  49   6.657   6.044  -6.339
  212    H    GLY  50           H        GLY  50   9.108   2.295  -6.253
  213   1HA   GLY  50          2HA       GLY  50  10.277   0.293  -7.589
  214   2HA   GLY  50          1HA       GLY  50   8.872  -0.583  -6.986
  215    H    HIS  51           H        HIS  51   9.621   1.586  -4.568
  216    HA   HIS  51           HA       HIS  51  11.951   0.524  -3.357
  217   1HB   HIS  51          1HB       HIS  51  11.404   1.891  -1.540
  218   2HB   HIS  51          2HB       HIS  51  10.688   2.737  -2.904
  219    HD1  HIS  51           HD1      HIS  51   7.788   1.883  -3.133
  220    HD2  HIS  51           HD2      HIS  51   9.916   1.467   0.481
  221    HE1  HIS  51           HE1      HIS  51   6.075   1.348  -1.341
  222    H    PHE  52           H        PHE  52   8.665  -0.676  -3.271
  223    HA   PHE  52           HA       PHE  52   8.590  -1.733  -0.688
  224   1HB   PHE  52          1HB       PHE  52   6.650  -3.089  -1.619
  225   2HB   PHE  52          2HB       PHE  52   6.559  -1.348  -1.729
  226    HD1  PHE  52           HD1      PHE  52   6.524  -0.191  -3.865
  227    HD2  PHE  52           HD2      PHE  52   6.996  -4.477  -3.690
  228    HE1  PHE  52           HE1      PHE  52   6.084  -0.341  -6.294
  229    HE2  PHE  52           HE2      PHE  52   6.575  -4.616  -6.130
  230    HZ   PHE  52           HZ       PHE  52   6.122  -2.548  -7.439
  231    H    SER  53           H        SER  53   9.529  -3.451  -3.686
  232    HA   SER  53           HA       SER  53   9.829  -6.037  -2.604
  233   1HB   SER  53          1HB       SER  53  11.383  -4.745  -4.878
  234   2HB   SER  53          2HB       SER  53  11.200  -6.488  -4.587
  235    HG   SER  53           HG       SER  53   9.697  -5.715  -6.138
  236    H    LYS  54           H        LYS  54  11.711  -3.359  -1.767
  237    HA   LYS  54           HA       LYS  54  13.822  -5.081  -0.563
  238   1HB   LYS  54          1HB       LYS  54  15.537  -3.448  -1.174
  239   2HB   LYS  54          2HB       LYS  54  14.778  -4.144  -2.597
  240   1HG   LYS  54          1HG       LYS  54  13.488  -2.161  -3.029
  241   2HG   LYS  54          2HG       LYS  54  13.910  -1.443  -1.470
  242   1HD   LYS  54          1HD       LYS  54  15.966  -2.059  -3.629
  243   2HD   LYS  54          2HD       LYS  54  15.116  -0.509  -3.487
  244   1HE   LYS  54          1HE       LYS  54  15.960  -0.241  -1.168
  245   2HE   LYS  54          2HE       LYS  54  16.843  -1.765  -1.305
  246   1HZ   LYS  54          2HZ       LYS  54  17.321   0.630  -3.001
  247   2HZ   LYS  54          3HZ       LYS  54  18.273   0.144  -1.769
  248   3HZ   LYS  54          1HZ       LYS  54  18.146  -0.777  -3.109
  249    H    GLN  55           H        GLN  55  11.324  -3.542   0.424
  250    HA   GLN  55           HA       GLN  55  12.635  -2.663   2.908
  251   1HB   GLN  55          1HB       GLN  55  12.542  -0.616   1.391
  252   2HB   GLN  55          2HB       GLN  55  10.780  -0.723   1.471
  253   1HG   GLN  55          1HG       GLN  55  11.007  -0.585   4.025
  254   2HG   GLN  55          2HG       GLN  55  12.728  -0.283   3.785
  255   1HE2  GLN  55          1HE2      GLN  55   9.467   1.003   3.434
  256   2HE2  GLN  55          2HE2      GLN  55   9.952   2.665   3.132
  257    H    CYS  56           H        CYS  56   9.464  -2.886   1.220
  258    HA   CYS  56           HA       CYS  56   8.123  -3.207   3.860
  259   1HB   CYS  56          1HB       CYS  56   7.089  -2.176   1.188
  260   2HB   CYS  56          2HB       CYS  56   6.179  -2.248   2.701
  261    H    ARG  57           H        ARG  57   8.549  -4.828   0.810
  262    HA   ARG  57           HA       ARG  57   6.698  -7.072   1.566
  263   1HB   ARG  57          1HB       ARG  57   7.339  -5.981  -1.208
  264   2HB   ARG  57          2HB       ARG  57   6.293  -7.349  -0.873
  265   1HG   ARG  57          1HG       ARG  57   5.687  -4.469  -0.099
  266   2HG   ARG  57          2HG       ARG  57   5.083  -5.327  -1.508
  267   1HD   ARG  57          1HD       ARG  57   3.291  -5.596  -0.162
  268   2HD   ARG  57          2HD       ARG  57   4.166  -7.058   0.284
  269    HE   ARG  57           HE       ARG  57   5.089  -5.724   2.237
  270   1HH1  ARG  57          1HH2      ARG  57   2.002  -4.630   0.931
  271   2HH1  ARG  57          2HH2      ARG  57   1.774  -3.537   2.268
  272   1HH2  ARG  57          1HH1      ARG  57   4.659  -4.474   3.892
  273   2HH2  ARG  57          2HH1      ARG  57   3.129  -3.628   4.022
  274    H    SER  58           H        SER  58   9.775  -6.444   1.695
  275    HA   SER  58           HA       SER  58  11.379  -7.975   0.095
  276   1HB   SER  58          1HB       SER  58  11.673  -7.691   3.104
  277   2HB   SER  58          2HB       SER  58  12.962  -8.032   1.934
  278    HG   SER  58           HG       SER  58  12.830  -5.787   2.494

  No H/Q in entry =         278
  Start of MODEL   19
    1    H1   GLN  22           H3       GLN  22  -7.984  -0.495  -6.202
    2    H2   GLN  22           H2       GLN  22  -7.112   0.793  -5.697
    3    H3   GLN  22           H1       GLN  22  -6.989   0.280  -7.257
    4    HA   GLN  22           HA       GLN  22  -5.972  -1.792  -6.561
    5   1HB   GLN  22          1HB       GLN  22  -4.630   0.694  -5.404
    6   2HB   GLN  22          2HB       GLN  22  -3.862  -0.892  -5.528
    7   1HG   GLN  22          1HG       GLN  22  -4.165  -0.856  -7.995
    8   2HG   GLN  22          2HG       GLN  22  -4.836   0.778  -7.888
    9   1HE2  GLN  22          2HE2      GLN  22  -2.134  -0.542  -8.961
   10   2HE2  GLN  22          1HE2      GLN  22  -0.953   0.606  -8.340
   11    H    THR  23           H        THR  23  -6.200  -3.374  -5.053
   12    HA   THR  23           HA       THR  23  -7.724  -3.158  -2.797
   13    HB   THR  23           HB       THR  23  -5.471  -5.163  -3.136
   14    HG1  THR  23           HG1      THR  23  -6.978  -6.304  -4.357
   15   1HG2  THR  23          3HG2      THR  23  -8.232  -5.394  -1.846
   16   2HG2  THR  23          1HG2      THR  23  -7.075  -6.723  -2.060
   17   3HG2  THR  23          2HG2      THR  23  -6.677  -5.387  -0.977
   18    H    CYS  24           H        CYS  24  -7.561  -2.667  -0.709
   19    HA   CYS  24           HA       CYS  24  -5.600  -1.021   0.345
   20   1HB   CYS  24          1HB       CYS  24  -8.005  -1.462   1.067
   21   2HB   CYS  24          2HB       CYS  24  -7.409  -2.884   1.920
   22    H    TYR  25           H        TYR  25  -3.975  -1.207   1.894
   23    HA   TYR  25           HA       TYR  25  -2.486  -3.681   2.204
   24   1HB   TYR  25          1HB       TYR  25  -0.960  -2.474   3.386
   25   2HB   TYR  25          2HB       TYR  25  -1.600  -1.241   2.324
   26    HD1  TYR  25           HD1      TYR  25  -0.442  -1.751   5.509
   27    HD2  TYR  25           HD2      TYR  25  -3.905  -0.067   3.554
   28    HE1  TYR  25           HE1      TYR  25  -0.902  -0.352   7.513
   29    HE2  TYR  25           HE2      TYR  25  -4.385   1.274   5.574
   30    HH   TYR  25           HH       TYR  25  -2.310   1.171   8.488
   31    H    ASN  26           H        ASN  26  -5.294  -2.514   3.748
   32    HA   ASN  26           HA       ASN  26  -4.943  -4.334   6.117
   33   1HB   ASN  26          1HB       ASN  26  -4.457  -2.038   6.750
   34   2HB   ASN  26          2HB       ASN  26  -5.902  -1.439   5.942
   35   1HD2  ASN  26          2HD2      ASN  26  -7.962  -1.649   6.988
   36   2HD2  ASN  26          1HD2      ASN  26  -8.046  -2.169   8.665
   37    H    CYS  27           H        CYS  27  -7.375  -2.502   4.202
   38    HA   CYS  27           HA       CYS  27  -9.576  -3.808   5.491
   39   1HB   CYS  27          1HB       CYS  27  -9.521  -1.973   3.067
   40   2HB   CYS  27          2HB       CYS  27 -10.902  -2.296   4.123
   41    H    GLY  28           H        GLY  28  -7.724  -4.846   2.828
   42   1HA   GLY  28          2HA       GLY  28  -9.235  -7.152   2.260
   43   2HA   GLY  28          1HA       GLY  28  -7.951  -6.490   1.248
   44    H    LYS  29           H        LYS  29  -9.605  -3.960   0.835
   45    HA   LYS  29           HA       LYS  29 -11.810  -4.994  -0.896
   46   1HB   LYS  29          1HB       LYS  29 -12.442  -3.718   1.115
   47   2HB   LYS  29          2HB       LYS  29 -11.549  -2.324   0.510
   48   1HG   LYS  29          1HG       LYS  29 -13.055  -2.286  -1.511
   49   2HG   LYS  29          2HG       LYS  29 -13.939  -3.665  -0.829
   50   1HD   LYS  29          1HD       LYS  29 -14.468  -2.244   1.199
   51   2HD   LYS  29          2HD       LYS  29 -13.628  -0.898   0.424
   52   1HE   LYS  29          1HE       LYS  29 -15.930  -0.527   0.031
   53   2HE   LYS  29          2HE       LYS  29 -15.250  -1.061  -1.506
   54   1HZ   LYS  29          2HZ       LYS  29 -16.760  -2.787   0.393
   55   2HZ   LYS  29          3HZ       LYS  29 -17.355  -2.180  -0.996
   56   3HZ   LYS  29          1HZ       LYS  29 -16.162  -3.288  -1.044
   57    HA   PRO  30           HA       PRO  30  -9.253  -3.693  -4.361
   58   1HB   PRO  30          2HB       PRO  30 -11.950  -3.565  -5.717
   59   2HB   PRO  30          1HB       PRO  30 -10.411  -4.249  -6.329
   60   1HG   PRO  30          1HG       PRO  30 -12.308  -5.881  -5.311
   61   2HG   PRO  30          2HG       PRO  30 -10.586  -6.133  -4.870
   62   1HD   PRO  30          1HD       PRO  30 -12.768  -4.801  -3.262
   63   2HD   PRO  30          2HD       PRO  30 -11.481  -5.929  -2.739
   64    H    GLY  31           H        GLY  31 -12.157  -1.789  -3.604
   65   1HA   GLY  31          2HA       GLY  31 -12.807   0.370  -4.035
   66   2HA   GLY  31          1HA       GLY  31 -11.569   0.458  -5.285
   67    H    HIS  32           H        HIS  32  -9.293   0.016  -3.555
   68    HA   HIS  32           HA       HIS  32  -9.313   2.426  -1.805
   69   1HB   HIS  32          1HB       HIS  32  -7.905  -0.211  -1.651
   70   2HB   HIS  32          2HB       HIS  32  -7.074   1.211  -1.027
   71    HD1  HIS  32           HD1      HIS  32 -10.434  -0.629  -0.496
   72    HD2  HIS  32           HD2      HIS  32  -7.712   1.967   1.356
   73    HE1  HIS  32           HE1      HIS  32 -11.263  -0.312   1.917
   74    H    LEU  33           H        LEU  33  -7.507   3.688  -1.644
   75    HA   LEU  33           HA       LEU  33  -5.636   4.133  -3.846
   76   1HB   LEU  33          1HB       LEU  33  -7.977   5.997  -3.171
   77   2HB   LEU  33          2HB       LEU  33  -6.585   6.499  -4.116
   78    HG   LEU  33           HG       LEU  33  -8.588   4.379  -4.984
   79   1HD1  LEU  33          3HD1      LEU  33  -9.531   6.644  -4.925
   80   2HD1  LEU  33          1HD1      LEU  33  -8.171   7.250  -5.897
   81   3HD1  LEU  33          2HD1      LEU  33  -9.318   6.079  -6.589
   82   1HD2  LEU  33          3HD2      LEU  33  -6.266   5.692  -6.479
   83   2HD2  LEU  33          1HD2      LEU  33  -6.350   3.986  -5.985
   84   3HD2  LEU  33          2HD2      LEU  33  -7.479   4.608  -7.193
   85    H    SER  34           H        SER  34  -4.351   6.165  -3.276
   86    HA   SER  34           HA       SER  34  -3.363   6.374  -0.664
   87   1HB   SER  34          1HB       SER  34  -3.530   8.556  -2.778
   88   2HB   SER  34          2HB       SER  34  -2.372   8.475  -1.438
   89    HG   SER  34           HG       SER  34  -1.606   7.682  -3.540
   90    H    SER  35           H        SER  35  -6.356   7.693  -1.857
   91    HA   SER  35           HA       SER  35  -6.712   9.569   0.410
   92   1HB   SER  35          1HB       SER  35  -8.749  10.216  -0.875
   93   2HB   SER  35          2HB       SER  35  -7.245  10.404  -1.792
   94    HG   SER  35           HG       SER  35  -8.911   9.363  -3.011
   95    H    GLN  36           H        GLN  36  -7.321   6.292  -0.164
   96    HA   GLN  36           HA       GLN  36  -9.864   6.227   1.401
   97   1HB   GLN  36          1HB       GLN  36  -9.488   5.065  -0.920
   98   2HB   GLN  36          2HB       GLN  36  -8.543   3.898  -0.001
   99   1HG   GLN  36          1HG       GLN  36 -10.660   2.910  -0.064
  100   2HG   GLN  36          2HG       GLN  36 -10.694   3.692   1.508
  101   1HE2  GLN  36          2HE2      GLN  36 -12.060   3.601  -1.748
  102   2HE2  GLN  36          1HE2      GLN  36 -13.273   4.845  -1.453
  103    H    CYS  37           H        CYS  37  -6.565   4.876   1.317
  104    HA   CYS  37           HA       CYS  37  -6.428   4.844   4.238
  105   1HB   CYS  37          1HB       CYS  37  -6.035   2.354   2.532
  106   2HB   CYS  37          2HB       CYS  37  -5.133   2.567   4.009
  107    H    ARG  38           H        ARG  38  -4.055   4.314   4.864
  108    HA   ARG  38           HA       ARG  38  -2.302   6.255   3.792
  109   1HB   ARG  38          1HB       ARG  38  -1.656   3.724   5.374
  110   2HB   ARG  38          2HB       ARG  38  -0.506   4.992   4.983
  111   1HG   ARG  38          1HG       ARG  38  -0.988   5.688   7.031
  112   2HG   ARG  38          2HG       ARG  38  -2.238   6.597   6.202
  113   1HD   ARG  38          1HD       ARG  38  -2.748   3.840   7.391
  114   2HD   ARG  38          2HD       ARG  38  -2.747   5.273   8.404
  115    HE   ARG  38           HE       ARG  38  -4.538   6.196   6.857
  116   1HH1  ARG  38          1HH2      ARG  38  -4.365   2.735   7.553
  117   2HH1  ARG  38          2HH2      ARG  38  -6.083   2.555   7.309
  118   1HH2  ARG  38          2HH1      ARG  38  -6.718   5.843   6.656
  119   2HH2  ARG  38          1HH1      ARG  38  -7.333   4.220   6.735
  120    H    ALA  39           H        ALA  39  -2.601   2.844   2.821
  121    HA   ALA  39           HA       ALA  39  -1.401   3.480   0.259
  122   1HB   ALA  39          2HB       ALA  39   0.647   3.059   1.604
  123   2HB   ALA  39          3HB       ALA  39  -0.024   1.494   2.130
  124   3HB   ALA  39          1HB       ALA  39   0.408   1.750   0.435
  125    HA   PRO  40           HA       PRO  40  -3.631  -0.416  -0.787
  126   1HB   PRO  40          2HB       PRO  40  -2.536  -1.015  -3.194
  127   2HB   PRO  40          1HB       PRO  40  -3.640   0.376  -2.981
  128   1HG   PRO  40          1HG       PRO  40  -0.605   0.405  -3.011
  129   2HG   PRO  40          2HG       PRO  40  -1.727   1.451  -3.937
  130   1HD   PRO  40          1HD       PRO  40  -0.590   2.215  -1.564
  131   2HD   PRO  40          2HD       PRO  40  -2.227   2.746  -2.048
  132    H    LYS  41           H        LYS  41  -2.911  -2.687  -1.371
  133    HA   LYS  41           HA       LYS  41  -1.203  -3.820   0.514
  134   1HB   LYS  41          1HB       LYS  41  -3.122  -4.823  -0.810
  135   2HB   LYS  41          2HB       LYS  41  -2.000  -5.061  -2.150
  136   1HG   LYS  41          1HG       LYS  41  -0.645  -6.586  -0.767
  137   2HG   LYS  41          2HG       LYS  41  -1.648  -6.224   0.655
  138   1HD   LYS  41          1HD       LYS  41  -3.612  -7.218  -0.481
  139   2HD   LYS  41          2HD       LYS  41  -2.619  -7.549  -1.921
  140   1HE   LYS  41          1HE       LYS  41  -1.120  -8.982  -0.543
  141   2HE   LYS  41          2HE       LYS  41  -2.120  -8.664   0.880
  142   1HZ   LYS  41          3HZ       LYS  41  -3.055 -10.041  -1.586
  143   2HZ   LYS  41          1HZ       LYS  41  -2.715 -10.772  -0.169
  144   3HZ   LYS  41          2HZ       LYS  41  -3.980  -9.749  -0.270
  145    H    VAL  42           H        VAL  42  -0.117  -2.355  -2.340
  146    HA   VAL  42           HA       VAL  42   2.422  -3.559  -2.813
  147    HB   VAL  42           HB       VAL  42   1.597  -0.628  -2.943
  148   1HG1  VAL  42          1HG1      VAL  42   3.863  -2.105  -4.330
  149   2HG1  VAL  42          2HG1      VAL  42   3.361  -0.436  -4.683
  150   3HG1  VAL  42          3HG1      VAL  42   4.030  -0.829  -3.101
  151   1HG2  VAL  42          3HG2      VAL  42   1.504  -2.796  -5.087
  152   2HG2  VAL  42          1HG2      VAL  42   0.098  -1.993  -4.350
  153   3HG2  VAL  42          2HG2      VAL  42   1.203  -1.067  -5.361
  154    H    CYS  43           H        CYS  43   1.354  -1.343  -0.233
  155    HA   CYS  43           HA       CYS  43   3.981  -1.480   1.144
  156   1HB   CYS  43          1HB       CYS  43   3.975   0.319  -0.625
  157   2HB   CYS  43          2HB       CYS  43   2.653   1.113   0.237
  158    H    PHE  44           H        PHE  44   3.379   0.669   2.828
  159    HA   PHE  44           HA       PHE  44   0.742   0.224   4.104
  160   1HB   PHE  44          1HB       PHE  44   1.573  -0.029   6.282
  161   2HB   PHE  44          2HB       PHE  44   2.510  -1.152   5.315
  162    HD1  PHE  44           HD1      PHE  44   2.589   1.747   7.514
  163    HD2  PHE  44           HD2      PHE  44   4.922  -0.495   4.659
  164    HE1  PHE  44           HE1      PHE  44   4.656   2.840   8.343
  165    HE2  PHE  44           HE2      PHE  44   6.986   0.601   5.497
  166    HZ   PHE  44           HZ       PHE  44   6.858   2.274   7.330
  167    H    LYS  45           H        LYS  45   3.303   2.390   3.170
  168    HA   LYS  45           HA       LYS  45   1.675   4.737   3.868
  169   1HB   LYS  45          1HB       LYS  45   2.873   4.205   5.987
  170   2HB   LYS  45          2HB       LYS  45   4.420   4.329   5.150
  171   1HG   LYS  45          1HG       LYS  45   3.955   6.731   4.670
  172   2HG   LYS  45          2HG       LYS  45   2.376   6.577   5.469
  173   1HD   LYS  45          1HD       LYS  45   3.519   5.977   7.595
  174   2HD   LYS  45          2HD       LYS  45   5.096   6.129   6.787
  175   1HE   LYS  45          1HE       LYS  45   4.593   8.515   6.279
  176   2HE   LYS  45          2HE       LYS  45   3.029   8.359   7.090
  177   1HZ   LYS  45          3HZ       LYS  45   4.229   7.864   9.159
  178   2HZ   LYS  45          1HZ       LYS  45   5.674   8.014   8.407
  179   3HZ   LYS  45          2HZ       LYS  45   4.699   9.311   8.572
  180    H    CYS  46           H        CYS  46   5.094   3.971   2.965
  181    HA   CYS  46           HA       CYS  46   5.370   6.415   1.551
  182   1HB   CYS  46          1HB       CYS  46   7.619   5.159   0.891
  183   2HB   CYS  46          2HB       CYS  46   7.318   5.839   2.486
  184    H    LYS  47           H        LYS  47   4.609   3.208   0.345
  185    HA   LYS  47           HA       LYS  47   4.116   2.397  -1.746
  186   1HB   LYS  47          1HB       LYS  47   2.048   3.403  -2.529
  187   2HB   LYS  47          2HB       LYS  47   2.125   3.266  -0.778
  188   1HG   LYS  47          1HG       LYS  47   2.705   5.682  -0.612
  189   2HG   LYS  47          2HG       LYS  47   2.562   5.835  -2.365
  190   1HD   LYS  47          1HD       LYS  47   0.209   5.350  -2.289
  191   2HD   LYS  47          2HD       LYS  47   0.286   4.819  -0.601
  192   1HE   LYS  47          1HE       LYS  47   1.004   7.648  -1.471
  193   2HE   LYS  47          2HE       LYS  47  -0.642   7.169  -1.045
  194   1HZ   LYS  47          2HZ       LYS  47   1.656   6.868   0.820
  195   2HZ   LYS  47          3HZ       LYS  47   0.574   8.104   0.866
  196   3HZ   LYS  47          1HZ       LYS  47   0.099   6.559   1.149
  197    H    GLN  48           H        GLN  48   6.546   4.035  -2.138
  198    HA   GLN  48           HA       GLN  48   6.324   5.336  -4.682
  199   1HB   GLN  48          1HB       GLN  48   8.776   4.156  -3.308
  200   2HB   GLN  48          2HB       GLN  48   8.816   5.235  -4.694
  201   1HG   GLN  48          1HG       GLN  48   7.831   5.915  -1.896
  202   2HG   GLN  48          2HG       GLN  48   9.299   6.478  -2.670
  203   1HE2  GLN  48          2HE2      GLN  48   5.970   7.189  -2.158
  204   2HE2  GLN  48          1HE2      GLN  48   5.876   8.532  -3.303
  205    HA   PRO  49           HA       PRO  49   5.896   2.401  -7.722
  206   1HB   PRO  49          2HB       PRO  49   8.401   3.389  -9.102
  207   2HB   PRO  49          1HB       PRO  49   6.787   3.050  -9.808
  208   1HG   PRO  49          1HG       PRO  49   7.469   5.585  -9.201
  209   2HG   PRO  49          2HG       PRO  49   5.842   4.976  -8.751
  210   1HD   PRO  49          1HD       PRO  49   8.282   5.296  -7.006
  211   2HD   PRO  49          2HD       PRO  49   6.574   5.690  -6.666
  212    H    GLY  50           H        GLY  50   9.094   1.999  -6.308
  213   1HA   GLY  50          2HA       GLY  50  10.354  -0.026  -7.528
  214   2HA   GLY  50          1HA       GLY  50   8.954  -0.912  -6.925
  215    H    HIS  51           H        HIS  51   9.685   1.426  -4.619
  216    HA   HIS  51           HA       HIS  51  11.980   0.445  -3.317
  217   1HB   HIS  51          1HB       HIS  51  11.394   1.900  -1.580
  218   2HB   HIS  51          2HB       HIS  51  10.700   2.662  -3.002
  219    HD1  HIS  51           HD1      HIS  51   7.811   1.716  -3.239
  220    HD2  HIS  51           HD2      HIS  51   9.863   1.688   0.445
  221    HE1  HIS  51           HE1      HIS  51   6.070   1.311  -1.441
  222    H    PHE  52           H        PHE  52   8.708  -0.793  -3.167
  223    HA   PHE  52           HA       PHE  52   8.673  -1.839  -0.564
  224   1HB   PHE  52          1HB       PHE  52   6.745  -3.210  -1.468
  225   2HB   PHE  52          2HB       PHE  52   6.637  -1.473  -1.629
  226    HD1  PHE  52           HD1      PHE  52   6.603  -0.379  -3.801
  227    HD2  PHE  52           HD2      PHE  52   7.096  -4.655  -3.498
  228    HE1  PHE  52           HE1      PHE  52   6.168  -0.601  -6.224
  229    HE2  PHE  52           HE2      PHE  52   6.677  -4.867  -5.932
  230    HZ   PHE  52           HZ       PHE  52   6.218  -2.841  -7.304
  231    H    SER  53           H        SER  53   9.633  -3.509  -3.583
  232    HA   SER  53           HA       SER  53  10.010  -6.093  -2.526
  233   1HB   SER  53          1HB       SER  53  11.498  -4.742  -4.809
  234   2HB   SER  53          2HB       SER  53  11.383  -6.490  -4.525
  235    HG   SER  53           HG       SER  53   9.834  -5.773  -6.051
  236    H    LYS  54           H        LYS  54  11.864  -3.373  -1.720
  237    HA   LYS  54           HA       LYS  54  14.019  -5.081  -0.549
  238   1HB   LYS  54          1HB       LYS  54  15.664  -3.354  -1.064
  239   2HB   LYS  54          2HB       LYS  54  14.938  -4.006  -2.526
  240   1HG   LYS  54          1HG       LYS  54  13.563  -2.055  -2.853
  241   2HG   LYS  54          2HG       LYS  54  13.974  -1.397  -1.263
  242   1HD   LYS  54          1HD       LYS  54  16.028  -1.844  -3.466
  243   2HD   LYS  54          2HD       LYS  54  15.133  -0.332  -3.245
  244   1HE   LYS  54          1HE       LYS  54  15.995  -0.126  -0.934
  245   2HE   LYS  54          2HE       LYS  54  16.906  -1.627  -1.126
  246   1HZ   LYS  54          2HZ       LYS  54  17.330   0.830  -2.744
  247   2HZ   LYS  54          3HZ       LYS  54  18.296   0.325  -1.532
  248   3HZ   LYS  54          1HZ       LYS  54  18.182  -0.557  -2.899
  249    H    GLN  55           H        GLN  55  11.447  -3.445   0.377
  250    HA   GLN  55           HA       GLN  55  12.631  -2.812   3.003
  251   1HB   GLN  55          1HB       GLN  55  12.814  -0.703   1.673
  252   2HB   GLN  55          2HB       GLN  55  11.068  -0.697   1.451
  253   1HG   GLN  55          1HG       GLN  55  10.817  -0.608   3.974
  254   2HG   GLN  55          2HG       GLN  55  12.576  -0.528   4.103
  255   1HE2  GLN  55          1HE2      GLN  55   9.653   1.262   3.330
  256   2HE2  GLN  55          2HE2      GLN  55  10.448   2.822   3.140
  257    H    CYS  56           H        CYS  56   9.469  -1.815   1.687
  258    HA   CYS  56           HA       CYS  56   8.161  -2.677   4.017
  259   1HB   CYS  56          1HB       CYS  56   7.043  -1.724   1.343
  260   2HB   CYS  56          2HB       CYS  56   6.189  -1.724   2.898
  261    H    ARG  57           H        ARG  57   8.659  -4.456   1.100
  262    HA   ARG  57           HA       ARG  57   6.831  -6.643   1.987
  263   1HB   ARG  57          1HB       ARG  57   6.191  -4.877  -0.073
  264   2HB   ARG  57          2HB       ARG  57   7.020  -6.136  -0.956
  265   1HG   ARG  57          1HG       ARG  57   4.975  -7.115  -1.022
  266   2HG   ARG  57          2HG       ARG  57   5.325  -7.658   0.616
  267   1HD   ARG  57          1HD       ARG  57   3.716  -5.229  -0.271
  268   2HD   ARG  57          2HD       ARG  57   3.108  -6.669   0.556
  269    HE   ARG  57           HE       ARG  57   5.088  -5.413   2.207
  270   1HH1  ARG  57          2HH1      ARG  57   1.864  -4.645   1.077
  271   2HH1  ARG  57          1HH1      ARG  57   1.642  -3.460   2.339
  272   1HH2  ARG  57          2HH2      ARG  57   4.683  -4.049   3.809
  273   2HH2  ARG  57          1HH2      ARG  57   3.098  -3.309   3.994
  274    H    SER  58           H        SER  58   9.837  -6.067   1.828
  275    HA   SER  58           HA       SER  58  11.202  -7.816   0.065
  276   1HB   SER  58          1HB       SER  58  12.168  -5.988   1.506
  277   2HB   SER  58          2HB       SER  58  12.002  -7.071   2.903
  278    HG   SER  58           HG       SER  58  14.093  -7.263   1.959

  No H/Q in entry =         278
  Start of MODEL   20
    1    H1   GLN  22           H2       GLN  22  -8.109  -0.567  -6.214
    2    H2   GLN  22           H1       GLN  22  -7.193   0.699  -5.734
    3    H3   GLN  22           H3       GLN  22  -7.099   0.158  -7.288
    4    HA   GLN  22           HA       GLN  22  -6.157  -1.942  -6.556
    5   1HB   GLN  22          1HB       GLN  22  -4.690   0.510  -5.476
    6   2HB   GLN  22          2HB       GLN  22  -4.003  -1.117  -5.576
    7   1HG   GLN  22          1HG       GLN  22  -4.329  -1.104  -8.049
    8   2HG   GLN  22          2HG       GLN  22  -4.942   0.551  -7.946
    9   1HE2  GLN  22          1HE2      GLN  22  -3.034   0.795  -9.554
   10   2HE2  GLN  22          2HE2      GLN  22  -1.481   1.164  -8.812
   11    H    THR  23           H        THR  23  -6.269  -3.479  -4.981
   12    HA   THR  23           HA       THR  23  -7.781  -3.218  -2.712
   13    HB   THR  23           HB       THR  23  -5.476  -5.174  -3.003
   14    HG1  THR  23           HG1      THR  23  -6.961  -6.401  -4.170
   15   1HG2  THR  23          3HG2      THR  23  -8.226  -5.442  -1.695
   16   2HG2  THR  23          1HG2      THR  23  -7.024  -6.739  -1.860
   17   3HG2  THR  23          2HG2      THR  23  -6.670  -5.350  -0.829
   18    H    CYS  24           H        CYS  24  -7.604  -2.660  -0.647
   19    HA   CYS  24           HA       CYS  24  -5.659  -0.962   0.361
   20   1HB   CYS  24          1HB       CYS  24  -8.045  -1.434   1.126
   21   2HB   CYS  24          2HB       CYS  24  -7.417  -2.849   1.971
   22    H    TYR  25           H        TYR  25  -4.027  -1.117   1.924
   23    HA   TYR  25           HA       TYR  25  -2.475  -3.556   2.195
   24   1HB   TYR  25          1HB       TYR  25  -0.977  -2.332   3.373
   25   2HB   TYR  25          2HB       TYR  25  -1.658  -1.088   2.352
   26    HD1  TYR  25           HD1      TYR  25  -0.551  -1.802   5.563
   27    HD2  TYR  25           HD2      TYR  25  -3.878   0.121   3.592
   28    HE1  TYR  25           HE1      TYR  25  -1.022  -0.500   7.625
   29    HE2  TYR  25           HE2      TYR  25  -4.363   1.392   5.677
   30    HH   TYR  25           HH       TYR  25  -2.382   1.014   8.636
   31    H    ASN  26           H        ASN  26  -5.300  -2.460   3.766
   32    HA   ASN  26           HA       ASN  26  -4.913  -4.307   6.108
   33   1HB   ASN  26          1HB       ASN  26  -4.428  -2.022   6.767
   34   2HB   ASN  26          2HB       ASN  26  -5.878  -1.413   5.973
   35   1HD2  ASN  26          2HD2      ASN  26  -7.923  -1.615   7.034
   36   2HD2  ASN  26          1HD2      ASN  26  -8.003  -2.158   8.703
   37    H    CYS  27           H        CYS  27  -7.370  -2.487   4.214
   38    HA   CYS  27           HA       CYS  27  -9.545  -3.745   5.574
   39   1HB   CYS  27          1HB       CYS  27  -9.525  -1.954   3.114
   40   2HB   CYS  27          2HB       CYS  27 -10.895  -2.261   4.187
   41    H    GLY  28           H        GLY  28  -7.777  -4.973   2.956
   42   1HA   GLY  28          2HA       GLY  28  -9.397  -7.225   2.487
   43   2HA   GLY  28          1HA       GLY  28  -8.117  -6.647   1.414
   44    H    LYS  29           H        LYS  29  -9.384  -4.140   0.759
   45    HA   LYS  29           HA       LYS  29 -11.883  -4.909  -0.707
   46   1HB   LYS  29          1HB       LYS  29 -12.265  -3.668   1.370
   47   2HB   LYS  29          2HB       LYS  29 -11.179  -2.408   0.848
   48   1HG   LYS  29          1HG       LYS  29 -13.436  -1.642   0.551
   49   2HG   LYS  29          2HG       LYS  29 -12.713  -1.840  -1.033
   50   1HD   LYS  29          1HD       LYS  29 -15.033  -2.634  -1.018
   51   2HD   LYS  29          2HD       LYS  29 -13.924  -3.944  -1.384
   52   1HE   LYS  29          1HE       LYS  29 -15.621  -4.784   0.093
   53   2HE   LYS  29          2HE       LYS  29 -14.094  -4.757   0.971
   54   1HZ   LYS  29          3HZ       LYS  29 -16.241  -2.708   1.211
   55   2HZ   LYS  29          1HZ       LYS  29 -15.934  -3.876   2.303
   56   3HZ   LYS  29          2HZ       LYS  29 -14.842  -2.693   2.059
   57    HA   PRO  30           HA       PRO  30  -9.232  -3.767  -4.219
   58   1HB   PRO  30          2HB       PRO  30 -11.942  -3.876  -5.547
   59   2HB   PRO  30          1HB       PRO  30 -10.360  -4.459  -6.158
   60   1HG   PRO  30          1HG       PRO  30 -12.084  -6.208  -5.048
   61   2HG   PRO  30          2HG       PRO  30 -10.348  -6.276  -4.596
   62   1HD   PRO  30          1HD       PRO  30 -12.647  -5.061  -3.064
   63   2HD   PRO  30          2HD       PRO  30 -11.275  -6.045  -2.471
   64    H    GLY  31           H        GLY  31 -12.200  -1.946  -3.509
   65   1HA   GLY  31          2HA       GLY  31 -12.909   0.185  -3.993
   66   2HA   GLY  31          1HA       GLY  31 -11.695   0.269  -5.268
   67    H    HIS  32           H        HIS  32  -9.386  -0.100  -3.536
   68    HA   HIS  32           HA       HIS  32  -9.431   2.357  -1.853
   69   1HB   HIS  32          1HB       HIS  32  -8.004  -0.262  -1.635
   70   2HB   HIS  32          2HB       HIS  32  -7.160   1.175  -1.072
   71    HD1  HIS  32           HD1      HIS  32 -10.552  -0.578  -0.449
   72    HD2  HIS  32           HD2      HIS  32  -7.710   1.940   1.324
   73    HE1  HIS  32           HE1      HIS  32 -11.326  -0.213   1.975
   74    H    LEU  33           H        LEU  33  -7.570   3.580  -1.687
   75    HA   LEU  33           HA       LEU  33  -5.737   4.008  -3.924
   76   1HB   LEU  33          1HB       LEU  33  -7.990   5.937  -3.151
   77   2HB   LEU  33          2HB       LEU  33  -6.608   6.406  -4.129
   78    HG   LEU  33           HG       LEU  33  -8.712   4.370  -4.965
   79   1HD1  LEU  33          3HD1      LEU  33  -9.577   6.664  -4.840
   80   2HD1  LEU  33          1HD1      LEU  33  -8.231   7.241  -5.847
   81   3HD1  LEU  33          2HD1      LEU  33  -9.438   6.119  -6.519
   82   1HD2  LEU  33          3HD2      LEU  33  -6.399   5.632  -6.517
   83   2HD2  LEU  33          1HD2      LEU  33  -6.523   3.923  -6.045
   84   3HD2  LEU  33          2HD2      LEU  33  -7.669   4.599  -7.207
   85    H    SER  34           H        SER  34  -4.398   6.022  -3.337
   86    HA   SER  34           HA       SER  34  -3.435   6.104  -0.647
   87   1HB   SER  34          1HB       SER  34  -2.311   8.199  -1.440
   88   2HB   SER  34          2HB       SER  34  -2.056   6.793  -2.494
   89    HG   SER  34           HG       SER  34  -2.609   8.700  -3.677
   90    H    SER  35           H        SER  35  -6.242   7.607  -2.040
   91    HA   SER  35           HA       SER  35  -6.608   9.525   0.182
   92   1HB   SER  35          1HB       SER  35  -8.623  10.167  -1.122
   93   2HB   SER  35          2HB       SER  35  -7.121  10.286  -2.055
   94    HG   SER  35           HG       SER  35  -8.823   9.243  -3.221
   95    H    GLN  36           H        GLN  36  -7.319   6.237  -0.343
   96    HA   GLN  36           HA       GLN  36  -9.843   6.274   1.244
   97   1HB   GLN  36          1HB       GLN  36  -9.486   5.012  -1.027
   98   2HB   GLN  36          2HB       GLN  36  -8.565   3.867  -0.059
   99   1HG   GLN  36          1HG       GLN  36 -10.696   2.913  -0.084
  100   2HG   GLN  36          2HG       GLN  36 -10.723   3.765   1.451
  101   1HE2  GLN  36          2HE2      GLN  36 -12.094   3.541  -1.797
  102   2HE2  GLN  36          1HE2      GLN  36 -13.279   4.823  -1.561
  103    H    CYS  37           H        CYS  37  -6.572   4.856   1.210
  104    HA   CYS  37           HA       CYS  37  -6.421   4.911   4.141
  105   1HB   CYS  37          1HB       CYS  37  -6.034   2.379   2.488
  106   2HB   CYS  37          2HB       CYS  37  -5.171   2.620   3.988
  107    H    ARG  38           H        ARG  38  -4.103   4.417   4.776
  108    HA   ARG  38           HA       ARG  38  -2.349   6.331   3.701
  109   1HB   ARG  38          1HB       ARG  38  -1.522   3.852   5.271
  110   2HB   ARG  38          2HB       ARG  38  -0.613   5.351   5.088
  111   1HG   ARG  38          1HG       ARG  38  -1.530   5.903   7.083
  112   2HG   ARG  38          2HG       ARG  38  -2.935   6.361   6.119
  113   1HD   ARG  38          1HD       ARG  38  -3.686   3.865   6.456
  114   2HD   ARG  38          2HD       ARG  38  -2.427   3.812   7.696
  115    HE   ARG  38           HE       ARG  38  -4.069   6.091   8.174
  116   1HH1  ARG  38          1HH1      ARG  38  -4.312   2.595   8.423
  117   2HH1  ARG  38          2HH1      ARG  38  -5.646   2.688   9.544
  118   1HH2  ARG  38          2HH2      ARG  38  -5.748   6.121   9.633
  119   2HH2  ARG  38          1HH2      ARG  38  -6.411   4.628  10.227
  120    H    ALA  39           H        ALA  39  -2.574   2.930   2.759
  121    HA   ALA  39           HA       ALA  39  -1.373   3.573   0.209
  122   1HB   ALA  39          3HB       ALA  39   0.011   1.557   2.041
  123   2HB   ALA  39          1HB       ALA  39   0.433   1.847   0.349
  124   3HB   ALA  39          2HB       ALA  39   0.685   3.130   1.547
  125    HA   PRO  40           HA       PRO  40  -3.667  -0.305  -0.797
  126   1HB   PRO  40          2HB       PRO  40  -2.616  -0.923  -3.224
  127   2HB   PRO  40          1HB       PRO  40  -3.710   0.474  -2.997
  128   1HG   PRO  40          1HG       PRO  40  -0.675   0.484  -3.085
  129   2HG   PRO  40          2HG       PRO  40  -1.810   1.539  -3.986
  130   1HD   PRO  40          1HD       PRO  40  -0.614   2.294  -1.637
  131   2HD   PRO  40          2HD       PRO  40  -2.254   2.840  -2.089
  132    H    LYS  41           H        LYS  41  -2.967  -2.583  -1.415
  133    HA   LYS  41           HA       LYS  41  -1.251  -3.727   0.457
  134   1HB   LYS  41          1HB       LYS  41  -3.202  -4.699  -0.887
  135   2HB   LYS  41          2HB       LYS  41  -2.047  -5.007  -2.184
  136   1HG   LYS  41          1HG       LYS  41  -0.769  -6.510  -0.694
  137   2HG   LYS  41          2HG       LYS  41  -1.821  -6.078   0.672
  138   1HD   LYS  41          1HD       LYS  41  -3.762  -7.065  -0.520
  139   2HD   LYS  41          2HD       LYS  41  -2.709  -7.478  -1.894
  140   1HE   LYS  41          1HE       LYS  41  -1.314  -8.887  -0.381
  141   2HE   LYS  41          2HE       LYS  41  -2.382  -8.490   0.970
  142   1HZ   LYS  41          2HZ       LYS  41  -3.212  -9.944  -1.489
  143   2HZ   LYS  41          3HZ       LYS  41  -2.970 -10.624  -0.027
  144   3HZ   LYS  41          1HZ       LYS  41  -4.202  -9.578  -0.240
  145    H    VAL  42           H        VAL  42  -0.166  -2.243  -2.374
  146    HA   VAL  42           HA       VAL  42   2.353  -3.493  -2.877
  147    HB   VAL  42           HB       VAL  42   1.556  -0.552  -2.992
  148   1HG1  VAL  42          2HG1      VAL  42   3.829  -2.031  -4.370
  149   2HG1  VAL  42          3HG1      VAL  42   3.335  -0.360  -4.718
  150   3HG1  VAL  42          1HG1      VAL  42   3.989  -0.762  -3.132
  151   1HG2  VAL  42          1HG2      VAL  42   1.472  -2.707  -5.152
  152   2HG2  VAL  42          2HG2      VAL  42   0.065  -1.910  -4.417
  153   3HG2  VAL  42          3HG2      VAL  42   1.175  -0.976  -5.413
  154    H    CYS  43           H        CYS  43   1.318  -1.277  -0.286
  155    HA   CYS  43           HA       CYS  43   3.922  -1.506   1.115
  156   1HB   CYS  43          1HB       CYS  43   4.001   0.328  -0.622
  157   2HB   CYS  43          2HB       CYS  43   2.703   1.153   0.248
  158    H    PHE  44           H        PHE  44   3.303   0.695   2.789
  159    HA   PHE  44           HA       PHE  44   0.657   0.250   4.038
  160   1HB   PHE  44          1HB       PHE  44   1.452  -0.063   6.220
  161   2HB   PHE  44          2HB       PHE  44   2.380  -1.183   5.244
  162    HD1  PHE  44           HD1      PHE  44   2.484   1.648   7.518
  163    HD2  PHE  44           HD2      PHE  44   4.812  -0.543   4.619
  164    HE1  PHE  44           HE1      PHE  44   4.560   2.689   8.396
  165    HE2  PHE  44           HE2      PHE  44   6.883   0.503   5.501
  166    HZ   PHE  44           HZ       PHE  44   6.762   2.125   7.382
  167    H    LYS  45           H        LYS  45   3.315   2.383   3.253
  168    HA   LYS  45           HA       LYS  45   1.708   4.751   3.955
  169   1HB   LYS  45          1HB       LYS  45   2.824   4.116   6.092
  170   2HB   LYS  45          2HB       LYS  45   4.401   4.235   5.308
  171   1HG   LYS  45          1HG       LYS  45   3.995   6.663   4.899
  172   2HG   LYS  45          2HG       LYS  45   2.393   6.513   5.650
  173   1HD   LYS  45          1HD       LYS  45   3.474   5.804   7.780
  174   2HD   LYS  45          2HD       LYS  45   5.070   5.969   7.016
  175   1HE   LYS  45          1HE       LYS  45   4.607   8.380   6.596
  176   2HE   LYS  45          2HE       LYS  45   3.026   8.210   7.368
  177   1HZ   LYS  45          1HZ       LYS  45   4.179   7.613   9.437
  178   2HZ   LYS  45          2HZ       LYS  45   5.640   7.780   8.721
  179   3HZ   LYS  45          3HZ       LYS  45   4.674   9.078   8.922
  180    H    CYS  46           H        CYS  46   5.127   3.893   3.106
  181    HA   CYS  46           HA       CYS  46   5.505   6.390   1.791
  182   1HB   CYS  46          1HB       CYS  46   7.763   5.229   1.219
  183   2HB   CYS  46          2HB       CYS  46   7.356   5.656   2.878
  184    H    LYS  47           H        LYS  47   4.721   3.230   0.477
  185    HA   LYS  47           HA       LYS  47   4.229   2.502  -1.646
  186   1HB   LYS  47          1HB       LYS  47   2.209   3.602  -2.433
  187   2HB   LYS  47          2HB       LYS  47   2.246   3.412  -0.686
  188   1HG   LYS  47          1HG       LYS  47   2.885   5.790  -0.420
  189   2HG   LYS  47          2HG       LYS  47   2.838   6.012  -2.170
  190   1HD   LYS  47          1HD       LYS  47   0.470   5.649  -2.236
  191   2HD   LYS  47          2HD       LYS  47   0.424   5.033  -0.575
  192   1HE   LYS  47          1HE       LYS  47   1.347   7.858  -1.246
  193   2HE   LYS  47          2HE       LYS  47  -0.350   7.467  -0.960
  194   1HZ   LYS  47          3HZ       LYS  47   1.805   6.952   1.028
  195   2HZ   LYS  47          1HZ       LYS  47   0.759   8.216   1.081
  196   3HZ   LYS  47          2HZ       LYS  47   0.221   6.674   1.247
  197    H    GLN  48           H        GLN  48   6.716   4.082  -1.948
  198    HA   GLN  48           HA       GLN  48   6.574   5.499  -4.430
  199   1HB   GLN  48          1HB       GLN  48   8.960   4.165  -3.083
  200   2HB   GLN  48          2HB       GLN  48   9.065   5.300  -4.421
  201   1HG   GLN  48          1HG       GLN  48   8.057   5.900  -1.612
  202   2HG   GLN  48          2HG       GLN  48   9.563   6.431  -2.335
  203   1HE2  GLN  48          2HE2      GLN  48   6.253   7.255  -1.861
  204   2HE2  GLN  48          1HE2      GLN  48   6.240   8.652  -2.945
  205    HA   PRO  49           HA       PRO  49   6.074   2.755  -7.628
  206   1HB   PRO  49          2HB       PRO  49   8.647   3.692  -8.914
  207   2HB   PRO  49          1HB       PRO  49   7.033   3.464  -9.664
  208   1HG   PRO  49          1HG       PRO  49   7.819   5.931  -8.915
  209   2HG   PRO  49          2HG       PRO  49   6.157   5.377  -8.526
  210   1HD   PRO  49          1HD       PRO  49   8.573   5.499  -6.724
  211   2HD   PRO  49          2HD       PRO  49   6.876   5.946  -6.393
  212    H    GLY  50           H        GLY  50   9.252   2.153  -6.227
  213   1HA   GLY  50          2HA       GLY  50  10.413   0.114  -7.514
  214   2HA   GLY  50          1HA       GLY  50   8.974  -0.726  -6.942
  215    H    HIS  51           H        HIS  51   9.729   1.460  -4.533
  216    HA   HIS  51           HA       HIS  51  12.005   0.369  -3.262
  217   1HB   HIS  51          1HB       HIS  51  11.447   1.771  -1.474
  218   2HB   HIS  51          2HB       HIS  51  10.771   2.607  -2.863
  219    HD1  HIS  51           HD1      HIS  51   7.865   1.792  -3.143
  220    HD2  HIS  51           HD2      HIS  51   9.911   1.382   0.520
  221    HE1  HIS  51           HE1      HIS  51   6.110   1.279  -1.385
  222    H    PHE  52           H        PHE  52   8.697  -0.784  -3.217
  223    HA   PHE  52           HA       PHE  52   8.581  -1.906  -0.653
  224   1HB   PHE  52          1HB       PHE  52   6.667  -3.258  -1.670
  225   2HB   PHE  52          2HB       PHE  52   6.565  -1.513  -1.705
  226    HD1  PHE  52           HD1      PHE  52   7.067  -4.544  -3.804
  227    HD2  PHE  52           HD2      PHE  52   6.556  -0.259  -3.780
  228    HE1  PHE  52           HE1      PHE  52   6.689  -4.566  -6.254
  229    HE2  PHE  52           HE2      PHE  52   6.160  -0.292  -6.219
  230    HZ   PHE  52           HZ       PHE  52   6.240  -2.440  -7.471
  231    H    SER  53           H        SER  53   9.555  -3.522  -3.694
  232    HA   SER  53           HA       SER  53   9.944  -6.123  -2.668
  233   1HB   SER  53          1HB       SER  53  11.400  -4.739  -4.952
  234   2HB   SER  53          2HB       SER  53  11.291  -6.491  -4.687
  235    HG   SER  53           HG       SER  53   9.722  -5.762  -6.186
  236    H    LYS  54           H        LYS  54  11.731  -3.430  -1.729
  237    HA   LYS  54           HA       LYS  54  13.920  -5.137  -0.643
  238   1HB   LYS  54          1HB       LYS  54  15.572  -3.428  -1.182
  239   2HB   LYS  54          2HB       LYS  54  14.817  -4.073  -2.631
  240   1HG   LYS  54          1HG       LYS  54  13.452  -2.107  -2.931
  241   2HG   LYS  54          2HG       LYS  54  13.918  -1.447  -1.357
  242   1HD   LYS  54          1HD       LYS  54  15.896  -1.938  -3.621
  243   2HD   LYS  54          2HD       LYS  54  15.036  -0.407  -3.373
  244   1HE   LYS  54          1HE       LYS  54  15.980  -0.219  -1.090
  245   2HE   LYS  54          2HE       LYS  54  16.860  -1.735  -1.314
  246   1HZ   LYS  54          2HZ       LYS  54  17.268   0.716  -2.944
  247   2HZ   LYS  54          3HZ       LYS  54  18.269   0.192  -1.767
  248   3HZ   LYS  54          1HZ       LYS  54  18.091  -0.685  -3.131
  249    H    GLN  55           H        GLN  55  11.370  -3.559   0.402
  250    HA   GLN  55           HA       GLN  55  12.679  -2.834   2.944
  251   1HB   GLN  55          1HB       GLN  55  12.776  -0.754   1.519
  252   2HB   GLN  55          2HB       GLN  55  11.012  -0.760   1.453
  253   1HG   GLN  55          1HG       GLN  55  10.990  -0.631   3.990
  254   2HG   GLN  55          2HG       GLN  55  12.751  -0.511   3.953
  255   1HE2  GLN  55          1HE2      GLN  55   9.715   1.165   3.359
  256   2HE2  GLN  55          2HE2      GLN  55  10.434   2.752   3.105
  257    H    CYS  56           H        CYS  56   9.490  -2.500   1.293
  258    HA   CYS  56           HA       CYS  56   8.163  -2.955   3.887
  259   1HB   CYS  56          1HB       CYS  56   7.163  -1.799   1.253
  260   2HB   CYS  56          2HB       CYS  56   6.252  -1.871   2.768
  261    H    ARG  57           H        ARG  57   8.568  -4.667   0.920
  262    HA   ARG  57           HA       ARG  57   6.638  -6.779   1.764
  263   1HB   ARG  57          1HB       ARG  57   6.049  -4.939  -0.249
  264   2HB   ARG  57          2HB       ARG  57   6.818  -6.216  -1.166
  265   1HG   ARG  57          1HG       ARG  57   4.735  -7.106  -1.234
  266   2HG   ARG  57          2HG       ARG  57   5.084  -7.706   0.383
  267   1HD   ARG  57          1HD       ARG  57   3.556  -5.199  -0.416
  268   2HD   ARG  57          2HD       ARG  57   2.908  -6.638   0.381
  269    HE   ARG  57           HE       ARG  57   4.956  -5.480   2.030
  270   1HH1  ARG  57          1HH1      ARG  57   1.735  -4.623   0.983
  271   2HH1  ARG  57          2HH1      ARG  57   1.556  -3.457   2.271
  272   1HH2  ARG  57          2HH2      ARG  57   4.610  -4.145   3.672
  273   2HH2  ARG  57          1HH2      ARG  57   3.045  -3.378   3.906
  274    H    SER  58           H        SER  58   9.742  -6.196   1.252
  275    HA   SER  58           HA       SER  58  10.804  -8.255  -0.394
  276   1HB   SER  58          1HB       SER  58  12.841  -7.924   1.115
  277   2HB   SER  58          2HB       SER  58  12.247  -6.525   0.216
  278    HG   SER  58           HG       SER  58  11.634  -7.103   2.943

  No H/Q in entry =         278
  Start of MODEL   21
    1    H1   GLN  22           H1       GLN  22  -6.947   0.545  -5.793
    2    H2   GLN  22           H3       GLN  22  -6.966  -0.029  -7.339
    3    H3   GLN  22           H2       GLN  22  -8.029  -0.603  -6.223
    4    HA   GLN  22           HA       GLN  22  -6.348  -2.230  -6.570
    5   1HB   GLN  22          1HB       GLN  22  -4.570  -0.688  -7.330
    6   2HB   GLN  22          2HB       GLN  22  -4.429  -0.024  -5.705
    7   1HG   GLN  22          1HG       GLN  22  -2.612  -1.566  -6.152
    8   2HG   GLN  22          2HG       GLN  22  -3.612  -2.210  -4.863
    9   1HE2  GLN  22          2HE2      GLN  22  -1.930  -3.205  -7.552
   10   2HE2  GLN  22          1HE2      GLN  22  -2.924  -4.598  -7.961
   11    H    THR  23           H        THR  23  -6.218  -3.687  -4.909
   12    HA   THR  23           HA       THR  23  -7.772  -3.309  -2.684
   13    HB   THR  23           HB       THR  23  -5.492  -5.304  -2.864
   14    HG1  THR  23           HG1      THR  23  -7.000  -6.559  -3.969
   15   1HG2  THR  23          3HG2      THR  23  -8.236  -5.431  -1.526
   16   2HG2  THR  23          1HG2      THR  23  -7.097  -6.787  -1.660
   17   3HG2  THR  23          2HG2      THR  23  -6.665  -5.379  -0.686
   18    H    CYS  24           H        CYS  24  -7.635  -2.691  -0.627
   19    HA   CYS  24           HA       CYS  24  -5.664  -0.995   0.381
   20   1HB   CYS  24          1HB       CYS  24  -8.082  -1.368   1.105
   21   2HB   CYS  24          2HB       CYS  24  -7.520  -2.787   1.984
   22    H    TYR  25           H        TYR  25  -4.073  -1.174   1.978
   23    HA   TYR  25           HA       TYR  25  -2.619  -3.659   2.325
   24   1HB   TYR  25          1HB       TYR  25  -1.099  -2.463   3.523
   25   2HB   TYR  25          2HB       TYR  25  -1.716  -1.225   2.453
   26    HD1  TYR  25           HD1      TYR  25  -0.663  -1.819   5.689
   27    HD2  TYR  25           HD2      TYR  25  -3.978   0.023   3.623
   28    HE1  TYR  25           HE1      TYR  25  -1.149  -0.433   7.694
   29    HE2  TYR  25           HE2      TYR  25  -4.486   1.360   5.647
   30    HH   TYR  25           HH       TYR  25  -2.546   1.117   8.640
   31    H    ASN  26           H        ASN  26  -5.443  -2.444   3.875
   32    HA   ASN  26           HA       ASN  26  -5.159  -4.438   6.093
   33   1HB   ASN  26          1HB       ASN  26  -4.370  -2.172   6.784
   34   2HB   ASN  26          2HB       ASN  26  -5.946  -1.503   6.369
   35   1HD2  ASN  26          1HD2      ASN  26  -4.233  -3.714   8.584
   36   2HD2  ASN  26          2HD2      ASN  26  -5.487  -3.680   9.815
   37    H    CYS  27           H        CYS  27  -7.507  -2.287   4.374
   38    HA   CYS  27           HA       CYS  27  -9.802  -3.450   5.613
   39   1HB   CYS  27          1HB       CYS  27  -9.587  -1.836   3.035
   40   2HB   CYS  27          2HB       CYS  27 -11.044  -2.095   3.999
   41    H    GLY  28           H        GLY  28  -7.962  -4.508   2.843
   42   1HA   GLY  28          2HA       GLY  28  -9.544  -6.849   2.339
   43   2HA   GLY  28          1HA       GLY  28  -8.205  -6.249   1.364
   44    H    LYS  29           H        LYS  29 -10.200  -3.664   1.288
   45    HA   LYS  29           HA       LYS  29 -12.194  -4.562  -0.709
   46   1HB   LYS  29          1HB       LYS  29 -11.612  -2.025   0.793
   47   2HB   LYS  29          2HB       LYS  29 -12.431  -1.900  -0.755
   48   1HG   LYS  29          1HG       LYS  29 -14.049  -1.885   0.956
   49   2HG   LYS  29          2HG       LYS  29 -14.249  -3.355   0.015
   50   1HD   LYS  29          1HD       LYS  29 -12.681  -3.366   2.618
   51   2HD   LYS  29          2HD       LYS  29 -14.445  -3.387   2.630
   52   1HE   LYS  29          1HE       LYS  29 -14.519  -5.435   1.310
   53   2HE   LYS  29          2HE       LYS  29 -12.760  -5.446   1.155
   54   1HZ   LYS  29          2HZ       LYS  29 -14.224  -5.679   3.725
   55   2HZ   LYS  29          3HZ       LYS  29 -13.485  -6.909   2.946
   56   3HZ   LYS  29          1HZ       LYS  29 -12.592  -5.679   3.560
   57    HA   PRO  30           HA       PRO  30  -9.280  -3.928  -4.147
   58   1HB   PRO  30          2HB       PRO  30 -11.903  -3.872  -5.634
   59   2HB   PRO  30          1HB       PRO  30 -10.372  -4.695  -6.070
   60   1HG   PRO  30          1HG       PRO  30 -12.397  -6.106  -4.972
   61   2HG   PRO  30          2HG       PRO  30 -10.716  -6.368  -4.396
   62   1HD   PRO  30          1HD       PRO  30 -12.903  -4.711  -3.122
   63   2HD   PRO  30          2HD       PRO  30 -11.755  -5.859  -2.369
   64    H    GLY  31           H        GLY  31 -12.139  -1.867  -3.660
   65   1HA   GLY  31          2HA       GLY  31 -12.704   0.254  -4.345
   66   2HA   GLY  31          1HA       GLY  31 -11.419   0.180  -5.549
   67    H    HIS  32           H        HIS  32  -9.310  -0.254  -3.463
   68    HA   HIS  32           HA       HIS  32  -9.322   2.310  -1.985
   69   1HB   HIS  32          1HB       HIS  32  -7.911  -0.298  -1.687
   70   2HB   HIS  32          2HB       HIS  32  -7.029   1.144  -1.197
   71    HD1  HIS  32           HD1      HIS  32 -10.551  -0.355  -0.515
   72    HD2  HIS  32           HD2      HIS  32  -7.493   1.946   1.195
   73    HE1  HIS  32           HE1      HIS  32 -11.289   0.146   1.892
   74    H    LEU  33           H        LEU  33  -7.422   3.533  -1.827
   75    HA   LEU  33           HA       LEU  33  -5.732   3.982  -4.189
   76   1HB   LEU  33          1HB       LEU  33  -7.876   5.924  -3.171
   77   2HB   LEU  33          2HB       LEU  33  -6.590   6.382  -4.276
   78    HG   LEU  33           HG       LEU  33  -8.777   4.365  -4.929
   79   1HD1  LEU  33          3HD1      LEU  33  -9.640   6.650  -4.668
   80   2HD1  LEU  33          1HD1      LEU  33  -8.403   7.259  -5.788
   81   3HD1  LEU  33          2HD1      LEU  33  -9.665   6.144  -6.364
   82   1HD2  LEU  33          1HD2      LEU  33  -6.644   5.676  -6.681
   83   2HD2  LEU  33          2HD2      LEU  33  -6.710   3.956  -6.234
   84   3HD2  LEU  33          3HD2      LEU  33  -7.974   4.646  -7.258
   85    H    SER  34           H        SER  34  -4.317   5.926  -3.710
   86    HA   SER  34           HA       SER  34  -3.013   5.887  -1.184
   87   1HB   SER  34          1HB       SER  34  -1.913   7.964  -2.076
   88   2HB   SER  34          2HB       SER  34  -1.877   6.582  -3.188
   89    HG   SER  34           HG       SER  34  -2.501   8.551  -4.227
   90    H    SER  35           H        SER  35  -5.951   7.476  -2.017
   91    HA   SER  35           HA       SER  35  -5.859   9.255   0.374
   92   1HB   SER  35          1HB       SER  35  -7.785  10.368  -0.717
   93   2HB   SER  35          2HB       SER  35  -6.331  10.371  -1.729
   94    HG   SER  35           HG       SER  35  -8.236   9.757  -2.895
   95    H    GLN  36           H        GLN  36  -7.105   6.214  -0.553
   96    HA   GLN  36           HA       GLN  36  -9.600   6.381   1.017
   97   1HB   GLN  36          1HB       GLN  36  -9.150   5.038  -1.195
   98   2HB   GLN  36          2HB       GLN  36  -8.358   3.878  -0.137
   99   1HG   GLN  36          1HG       GLN  36 -10.529   3.026  -0.273
  100   2HG   GLN  36          2HG       GLN  36 -10.636   3.951   1.215
  101   1HE2  GLN  36          1HE2      GLN  36 -11.721   3.682  -2.163
  102   2HE2  GLN  36          2HE2      GLN  36 -12.857   5.016  -2.056
  103    H    CYS  37           H        CYS  37  -6.385   4.920   1.231
  104    HA   CYS  37           HA       CYS  37  -6.400   4.990   4.160
  105   1HB   CYS  37          1HB       CYS  37  -6.005   2.439   2.540
  106   2HB   CYS  37          2HB       CYS  37  -5.144   2.672   4.039
  107    H    ARG  38           H        ARG  38  -4.086   4.405   4.888
  108    HA   ARG  38           HA       ARG  38  -2.178   6.216   3.850
  109   1HB   ARG  38          1HB       ARG  38  -1.879   3.733   5.586
  110   2HB   ARG  38          2HB       ARG  38  -0.548   4.835   5.250
  111   1HG   ARG  38          1HG       ARG  38  -1.236   6.385   6.704
  112   2HG   ARG  38          2HG       ARG  38  -2.902   6.342   6.153
  113   1HD   ARG  38          1HD       ARG  38  -1.651   4.319   8.059
  114   2HD   ARG  38          2HD       ARG  38  -2.597   5.715   8.568
  115    HE   ARG  38           HE       ARG  38  -3.589   3.184   7.594
  116   1HH1  ARG  38          2HH1      ARG  38  -4.522   6.566   7.817
  117   2HH1  ARG  38          1HH1      ARG  38  -6.214   6.194   7.650
  118   1HH2  ARG  38          1HH2      ARG  38  -5.749   2.804   7.342
  119   2HH2  ARG  38          2HH2      ARG  38  -6.877   4.122   7.323
  120    H    ALA  39           H        ALA  39  -2.639   2.825   2.883
  121    HA   ALA  39           HA       ALA  39  -1.353   3.442   0.375
  122   1HB   ALA  39          1HB       ALA  39   0.665   2.888   1.724
  123   2HB   ALA  39          2HB       ALA  39  -0.083   1.337   2.185
  124   3HB   ALA  39          3HB       ALA  39   0.376   1.639   0.505
  125    HA   PRO  40           HA       PRO  40  -3.671  -0.390  -0.782
  126   1HB   PRO  40          2HB       PRO  40  -2.496  -0.985  -3.156
  127   2HB   PRO  40          1HB       PRO  40  -3.626   0.392  -2.984
  128   1HG   PRO  40          1HG       PRO  40  -0.590   0.447  -2.933
  129   2HG   PRO  40          2HG       PRO  40  -1.698   1.491  -3.878
  130   1HD   PRO  40          1HD       PRO  40  -0.614   2.250  -1.477
  131   2HD   PRO  40          2HD       PRO  40  -2.243   2.776  -1.990
  132    H    LYS  41           H        LYS  41  -2.980  -2.667  -1.259
  133    HA   LYS  41           HA       LYS  41  -1.296  -3.692   0.707
  134   1HB   LYS  41          1HB       LYS  41  -3.239  -4.732  -0.656
  135   2HB   LYS  41          2HB       LYS  41  -2.013  -5.198  -1.835
  136   1HG   LYS  41          1HG       LYS  41  -0.856  -6.535  -0.099
  137   2HG   LYS  41          2HG       LYS  41  -2.004  -5.957   1.128
  138   1HD   LYS  41          1HD       LYS  41  -3.869  -7.000  -0.177
  139   2HD   LYS  41          2HD       LYS  41  -2.693  -7.660  -1.319
  140   1HE   LYS  41          1HE       LYS  41  -2.779  -8.252   1.679
  141   2HE   LYS  41          2HE       LYS  41  -3.498  -9.273   0.435
  142   1HZ   LYS  41          2HZ       LYS  41  -1.269  -9.588  -0.511
  143   2HZ   LYS  41          3HZ       LYS  41  -0.597  -8.680   0.676
  144   3HZ   LYS  41          1HZ       LYS  41  -1.318 -10.096   1.036
  145    H    VAL  42           H        VAL  42  -0.178  -2.520  -2.286
  146    HA   VAL  42           HA       VAL  42   2.312  -3.847  -2.655
  147    HB   VAL  42           HB       VAL  42   1.614  -0.907  -3.055
  148   1HG1  VAL  42          3HG1      VAL  42   3.804  -2.611  -4.312
  149   2HG1  VAL  42          1HG1      VAL  42   3.359  -0.972  -4.834
  150   3HG1  VAL  42          2HG1      VAL  42   4.033  -1.220  -3.226
  151   1HG2  VAL  42          3HG2      VAL  42   1.390  -3.265  -4.978
  152   2HG2  VAL  42          1HG2      VAL  42   0.035  -2.329  -4.305
  153   3HG2  VAL  42          2HG2      VAL  42   1.166  -1.559  -5.415
  154    H    CYS  43           H        CYS  43   1.316  -1.496  -0.222
  155    HA   CYS  43           HA       CYS  43   3.916  -1.637   1.187
  156   1HB   CYS  43          1HB       CYS  43   3.922   0.191  -0.565
  157   2HB   CYS  43          2HB       CYS  43   2.595   0.969   0.306
  158    H    PHE  44           H        PHE  44   3.273   0.469   2.890
  159    HA   PHE  44           HA       PHE  44   0.622   0.006   4.129
  160   1HB   PHE  44          1HB       PHE  44   1.440  -0.286   6.310
  161   2HB   PHE  44          2HB       PHE  44   2.369  -1.400   5.325
  162    HD1  PHE  44           HD1      PHE  44   2.475   1.429   7.600
  163    HD2  PHE  44           HD2      PHE  44   4.785  -0.730   4.660
  164    HE1  PHE  44           HE1      PHE  44   4.552   2.494   8.445
  165    HE2  PHE  44           HE2      PHE  44   6.855   0.345   5.508
  166    HZ   PHE  44           HZ       PHE  44   6.744   1.960   7.394
  167    H    LYS  45           H        LYS  45   3.257   2.181   3.353
  168    HA   LYS  45           HA       LYS  45   1.621   4.527   4.055
  169   1HB   LYS  45          1HB       LYS  45   2.710   3.899   6.200
  170   2HB   LYS  45          2HB       LYS  45   4.297   4.021   5.439
  171   1HG   LYS  45          1HG       LYS  45   3.917   6.447   5.043
  172   2HG   LYS  45          2HG       LYS  45   2.290   6.305   5.745
  173   1HD   LYS  45          1HD       LYS  45   3.291   5.596   7.906
  174   2HD   LYS  45          2HD       LYS  45   4.916   5.724   7.197
  175   1HE   LYS  45          1HE       LYS  45   4.532   8.139   6.758
  176   2HE   LYS  45          2HE       LYS  45   2.913   8.015   7.459
  177   1HZ   LYS  45          1HZ       LYS  45   3.952   7.400   9.580
  178   2HZ   LYS  45          2HZ       LYS  45   5.449   7.519   8.933
  179   3HZ   LYS  45          3HZ       LYS  45   4.516   8.846   9.081
  180    H    CYS  46           H        CYS  46   5.043   3.681   3.190
  181    HA   CYS  46           HA       CYS  46   5.451   6.197   1.926
  182   1HB   CYS  46          1HB       CYS  46   7.634   4.908   1.196
  183   2HB   CYS  46          2HB       CYS  46   7.352   5.436   2.849
  184    H    LYS  47           H        LYS  47   4.562   3.090   0.552
  185    HA   LYS  47           HA       LYS  47   3.974   2.417  -1.555
  186   1HB   LYS  47          1HB       LYS  47   1.928   3.530  -2.228
  187   2HB   LYS  47          2HB       LYS  47   2.044   3.347  -0.485
  188   1HG   LYS  47          1HG       LYS  47   2.717   5.723  -0.265
  189   2HG   LYS  47          2HG       LYS  47   2.589   5.936  -2.011
  190   1HD   LYS  47          1HD       LYS  47   0.223   5.601  -1.970
  191   2HD   LYS  47          2HD       LYS  47   0.246   4.969  -0.319
  192   1HE   LYS  47          1HE       LYS  47   1.103   7.810  -1.018
  193   2HE   LYS  47          2HE       LYS  47  -0.560   7.384  -0.595
  194   1HZ   LYS  47          3HZ       LYS  47   1.756   6.894   1.206
  195   2HZ   LYS  47          1HZ       LYS  47   0.687   8.134   1.357
  196   3HZ   LYS  47          2HZ       LYS  47   0.205   6.574   1.538
  197    H    GLN  48           H        GLN  48   6.446   4.071  -1.924
  198    HA   GLN  48           HA       GLN  48   6.166   5.466  -4.411
  199   1HB   GLN  48          1HB       GLN  48   8.637   4.196  -3.171
  200   2HB   GLN  48          2HB       GLN  48   8.653   5.336  -4.509
  201   1HG   GLN  48          1HG       GLN  48   7.788   5.894  -1.645
  202   2HG   GLN  48          2HG       GLN  48   9.225   6.482  -2.456
  203   1HE2  GLN  48          2HE2      GLN  48   5.931   7.190  -1.760
  204   2HE2  GLN  48          1HE2      GLN  48   5.797   8.589  -2.830
  205    HA   PRO  49           HA       PRO  49   5.558   2.649  -7.535
  206   1HB   PRO  49          2HB       PRO  49   8.032   3.641  -8.967
  207   2HB   PRO  49          1HB       PRO  49   6.394   3.345  -9.631
  208   1HG   PRO  49          1HG       PRO  49   7.133   5.853  -8.970
  209   2HG   PRO  49          2HG       PRO  49   5.509   5.255  -8.494
  210   1HD   PRO  49          1HD       PRO  49   7.995   5.505  -6.803
  211   2HD   PRO  49          2HD       PRO  49   6.294   5.884  -6.404
  212    H    GLY  50           H        GLY  50   8.904   2.276  -6.416
  213   1HA   GLY  50          2HA       GLY  50  10.041   0.246  -7.702
  214   2HA   GLY  50          1HA       GLY  50   8.730  -0.655  -6.941
  215    H    HIS  51           H        HIS  51   9.271   1.471  -4.582
  216    HA   HIS  51           HA       HIS  51  11.821   0.720  -3.492
  217   1HB   HIS  51          1HB       HIS  51  11.210   2.004  -1.636
  218   2HB   HIS  51          2HB       HIS  51  10.402   2.796  -2.976
  219    HD1  HIS  51           HD1      HIS  51   7.560   1.780  -3.133
  220    HD2  HIS  51           HD2      HIS  51   9.805   1.429   0.420
  221    HE1  HIS  51           HE1      HIS  51   5.928   1.131  -1.309
  222    H    PHE  52           H        PHE  52   8.644  -0.753  -3.250
  223    HA   PHE  52           HA       PHE  52   8.780  -1.829  -0.702
  224   1HB   PHE  52          1HB       PHE  52   6.920  -3.319  -1.446
  225   2HB   PHE  52          2HB       PHE  52   6.697  -1.615  -1.769
  226    HD1  PHE  52           HD1      PHE  52   7.221  -4.932  -3.316
  227    HD2  PHE  52           HD2      PHE  52   6.642  -0.720  -4.060
  228    HE1  PHE  52           HE1      PHE  52   6.750  -5.414  -5.702
  229    HE2  PHE  52           HE2      PHE  52   6.170  -1.212  -6.443
  230    HZ   PHE  52           HZ       PHE  52   6.227  -3.554  -7.272
  231    H    SER  53           H        SER  53   9.769  -3.506  -3.725
  232    HA   SER  53           HA       SER  53  10.493  -5.979  -2.602
  233   1HB   SER  53          1HB       SER  53  11.790  -4.543  -4.946
  234   2HB   SER  53          2HB       SER  53  11.855  -6.284  -4.612
  235    HG   SER  53           HG       SER  53  10.218  -5.762  -6.132
  236    H    LYS  54           H        LYS  54  11.965  -3.059  -1.787
  237    HA   LYS  54           HA       LYS  54  14.408  -4.428  -0.730
  238   1HB   LYS  54          1HB       LYS  54  14.238  -1.607  -1.879
  239   2HB   LYS  54          2HB       LYS  54  15.636  -2.329  -1.093
  240   1HG   LYS  54          1HG       LYS  54  16.295  -2.777  -3.191
  241   2HG   LYS  54          2HG       LYS  54  15.332  -4.221  -2.946
  242   1HD   LYS  54          1HD       LYS  54  14.776  -3.411  -5.099
  243   2HD   LYS  54          2HD       LYS  54  13.391  -2.960  -4.097
  244   1HE   LYS  54          1HE       LYS  54  14.289  -0.659  -3.873
  245   2HE   LYS  54          2HE       LYS  54  15.718  -1.121  -4.806
  246   1HZ   LYS  54          2HZ       LYS  54  14.235  -1.584  -6.699
  247   2HZ   LYS  54          3HZ       LYS  54  12.927  -1.102  -5.835
  248   3HZ   LYS  54          1HZ       LYS  54  14.098  -0.029  -6.224
  249    H    GLN  55           H        GLN  55  11.565  -3.300   0.353
  250    HA   GLN  55           HA       GLN  55  12.703  -2.621   2.985
  251   1HB   GLN  55          1HB       GLN  55  12.612  -0.446   1.656
  252   2HB   GLN  55          2HB       GLN  55  10.856  -0.623   1.618
  253   1HG   GLN  55          1HG       GLN  55  10.933  -0.693   4.186
  254   2HG   GLN  55          2HG       GLN  55  12.649  -0.298   4.070
  255   1HE2  GLN  55          1HE2      GLN  55   9.351   0.856   3.517
  256   2HE2  GLN  55          2HE2      GLN  55   9.766   2.557   3.383
  257    H    CYS  56           H        CYS  56   9.609  -2.698   1.149
  258    HA   CYS  56           HA       CYS  56   8.148  -3.394   3.641
  259   1HB   CYS  56          1HB       CYS  56   7.184  -2.153   1.033
  260   2HB   CYS  56          2HB       CYS  56   6.219  -2.414   2.488
  261    H    ARG  57           H        ARG  57   9.217  -4.919   0.870
  262    HA   ARG  57           HA       ARG  57   7.567  -7.318   1.355
  263   1HB   ARG  57          1HB       ARG  57   6.715  -5.611  -0.561
  264   2HB   ARG  57          2HB       ARG  57   7.974  -6.378  -1.504
  265   1HG   ARG  57          1HG       ARG  57   5.710  -7.334  -1.851
  266   2HG   ARG  57          2HG       ARG  57   6.864  -8.547  -1.308
  267   1HD   ARG  57          1HD       ARG  57   4.569  -8.686  -0.240
  268   2HD   ARG  57          2HD       ARG  57   5.916  -8.637   0.878
  269    HE   ARG  57           HE       ARG  57   5.369  -6.432   1.550
  270   1HH1  ARG  57          1HH1      ARG  57   3.070  -7.421  -0.935
  271   2HH1  ARG  57          2HH1      ARG  57   2.010  -6.076  -0.527
  272   1HH2  ARG  57          2HH2      ARG  57   3.939  -4.825   1.955
  273   2HH2  ARG  57          1HH2      ARG  57   2.464  -4.711   1.004
  274    H    SER  58           H        SER  58  10.551  -6.161   1.200
  275    HA   SER  58           HA       SER  58  12.115  -7.952  -0.377
  276   1HB   SER  58          1HB       SER  58  13.916  -7.274   1.318
  277   2HB   SER  58          2HB       SER  58  13.177  -6.008   0.336
  278    HG   SER  58           HG       SER  58  12.440  -6.669   3.014

  No H/Q in entry =         278
  Start of MODEL   22
    1    H1   GLN  22           H2       GLN  22  -7.096   0.598  -5.724
    2    H2   GLN  22           H1       GLN  22  -7.134   0.051  -7.278
    3    H3   GLN  22           H3       GLN  22  -8.163  -0.564  -6.152
    4    HA   GLN  22           HA       GLN  22  -6.432  -2.148  -6.563
    5   1HB   GLN  22          1HB       GLN  22  -4.745  -0.439  -7.285
    6   2HB   GLN  22          2HB       GLN  22  -4.536   0.037  -5.591
    7   1HG   GLN  22          1HG       GLN  22  -3.737  -2.270  -5.055
    8   2HG   GLN  22          2HG       GLN  22  -4.047  -2.759  -6.724
    9   1HE2  GLN  22          1HE2      GLN  22  -1.867  -3.278  -7.266
   10   2HE2  GLN  22          2HE2      GLN  22  -0.620  -2.041  -7.303
   11    H    THR  23           H        THR  23  -6.436  -3.635  -4.920
   12    HA   THR  23           HA       THR  23  -7.827  -3.249  -2.618
   13    HB   THR  23           HB       THR  23  -5.604  -5.292  -2.900
   14    HG1  THR  23           HG1      THR  23  -7.158  -6.497  -3.998
   15   1HG2  THR  23          2HG2      THR  23  -8.333  -5.405  -1.522
   16   2HG2  THR  23          3HG2      THR  23  -7.200  -6.762  -1.686
   17   3HG2  THR  23          1HG2      THR  23  -6.752  -5.368  -0.700
   18    H    CYS  24           H        CYS  24  -7.579  -2.676  -0.567
   19    HA   CYS  24           HA       CYS  24  -5.578  -1.011   0.387
   20   1HB   CYS  24          1HB       CYS  24  -7.958  -1.447   1.207
   21   2HB   CYS  24          2HB       CYS  24  -7.323  -2.856   2.052
   22    H    TYR  25           H        TYR  25  -3.939  -1.204   1.953
   23    HA   TYR  25           HA       TYR  25  -2.430  -3.677   2.188
   24   1HB   TYR  25          1HB       TYR  25  -0.902  -2.491   3.364
   25   2HB   TYR  25          2HB       TYR  25  -1.579  -1.214   2.381
   26    HD1  TYR  25           HD1      TYR  25  -0.429  -1.997   5.554
   27    HD2  TYR  25           HD2      TYR  25  -3.788  -0.039   3.678
   28    HE1  TYR  25           HE1      TYR  25  -0.913  -0.782   7.673
   29    HE2  TYR  25           HE2      TYR  25  -4.299   1.123   5.804
   30    HH   TYR  25           HH       TYR  25  -3.735   1.387   8.034
   31    H    ASN  26           H        ASN  26  -5.239  -2.548   3.776
   32    HA   ASN  26           HA       ASN  26  -4.909  -4.463   6.070
   33   1HB   ASN  26          1HB       ASN  26  -4.307  -2.233   6.803
   34   2HB   ASN  26          2HB       ASN  26  -5.723  -1.521   6.035
   35   1HD2  ASN  26          1HD2      ASN  26  -7.766  -1.625   7.104
   36   2HD2  ASN  26          2HD2      ASN  26  -7.873  -2.217   8.754
   37    H    CYS  27           H        CYS  27  -7.305  -2.442   4.301
   38    HA   CYS  27           HA       CYS  27  -9.510  -3.600   5.676
   39   1HB   CYS  27          1HB       CYS  27  -9.439  -1.809   3.220
   40   2HB   CYS  27          2HB       CYS  27 -10.806  -2.038   4.319
   41    H    GLY  28           H        GLY  28  -7.894  -4.886   2.977
   42   1HA   GLY  28          2HA       GLY  28  -9.675  -7.032   2.546
   43   2HA   GLY  28          1HA       GLY  28  -8.367  -6.548   1.463
   44    H    LYS  29           H        LYS  29  -9.612  -3.894   0.948
   45    HA   LYS  29           HA       LYS  29 -12.041  -4.616  -0.644
   46   1HB   LYS  29          1HB       LYS  29 -11.368  -2.373   1.191
   47   2HB   LYS  29          2HB       LYS  29 -12.235  -1.912  -0.268
   48   1HG   LYS  29          1HG       LYS  29 -13.201  -4.156   1.541
   49   2HG   LYS  29          2HG       LYS  29 -13.636  -2.458   1.783
   50   1HD   LYS  29          1HD       LYS  29 -14.593  -2.345  -0.500
   51   2HD   LYS  29          2HD       LYS  29 -14.207  -4.059  -0.758
   52   1HE   LYS  29          1HE       LYS  29 -15.657  -4.684   1.145
   53   2HE   LYS  29          2HE       LYS  29 -16.018  -2.979   1.446
   54   1HZ   LYS  29          2HZ       LYS  29 -16.715  -4.443  -1.046
   55   2HZ   LYS  29          3HZ       LYS  29 -17.767  -4.034   0.131
   56   3HZ   LYS  29          1HZ       LYS  29 -17.051  -2.870  -0.756
   57    HA   PRO  30           HA       PRO  30  -9.326  -3.780  -4.178
   58   1HB   PRO  30          2HB       PRO  30 -12.045  -3.809  -5.496
   59   2HB   PRO  30          1HB       PRO  30 -10.501  -4.510  -6.077
   60   1HG   PRO  30          1HG       PRO  30 -12.331  -6.100  -4.893
   61   2HG   PRO  30          2HG       PRO  30 -10.600  -6.258  -4.445
   62   1HD   PRO  30          1HD       PRO  30 -12.808  -4.834  -2.957
   63   2HD   PRO  30          2HD       PRO  30 -11.501  -5.883  -2.328
   64    H    GLY  31           H        GLY  31 -12.217  -1.813  -3.509
   65   1HA   GLY  31          2HA       GLY  31 -12.823   0.338  -4.052
   66   2HA   GLY  31          1HA       GLY  31 -11.613   0.329  -5.331
   67    H    HIS  32           H        HIS  32  -9.403  -0.216  -3.343
   68    HA   HIS  32           HA       HIS  32  -9.318   2.309  -1.806
   69   1HB   HIS  32          1HB       HIS  32  -7.920  -0.322  -1.627
   70   2HB   HIS  32          2HB       HIS  32  -7.021   1.103  -1.119
   71    HD1  HIS  32           HD1      HIS  32 -10.419  -0.568  -0.320
   72    HD2  HIS  32           HD2      HIS  32  -7.487   1.971   1.261
   73    HE1  HIS  32           HE1      HIS  32 -11.112  -0.095   2.111
   74    H    LEU  33           H        LEU  33  -7.488   3.558  -1.716
   75    HA   LEU  33           HA       LEU  33  -5.681   3.960  -3.978
   76   1HB   LEU  33          1HB       LEU  33  -7.956   5.877  -3.236
   77   2HB   LEU  33          2HB       LEU  33  -6.586   6.344  -4.229
   78    HG   LEU  33           HG       LEU  33  -8.666   4.265  -5.017
   79   1HD1  LEU  33          2HD1      LEU  33  -9.556   6.553  -4.934
   80   2HD1  LEU  33          3HD1      LEU  33  -8.217   7.124  -5.956
   81   3HD1  LEU  33          1HD1      LEU  33  -9.414   5.978  -6.603
   82   1HD2  LEU  33          1HD2      LEU  33  -6.370   5.522  -6.597
   83   2HD2  LEU  33          2HD2      LEU  33  -6.475   3.821  -6.095
   84   3HD2  LEU  33          3HD2      LEU  33  -7.631   4.463  -7.265
   85    H    SER  34           H        SER  34  -4.320   5.952  -3.444
   86    HA   SER  34           HA       SER  34  -3.310   6.172  -0.827
   87   1HB   SER  34          1HB       SER  34  -3.394   8.277  -3.023
   88   2HB   SER  34          2HB       SER  34  -2.280   8.256  -1.646
   89    HG   SER  34           HG       SER  34  -1.456   7.343  -3.674
   90    H    SER  35           H        SER  35  -6.261   7.546  -2.057
   91    HA   SER  35           HA       SER  35  -6.578   9.469   0.176
   92   1HB   SER  35          1HB       SER  35  -8.605  10.130  -1.117
   93   2HB   SER  35          2HB       SER  35  -7.099  10.274  -2.040
   94    HG   SER  35           HG       SER  35  -8.787   9.243  -3.237
   95    H    GLN  36           H        GLN  36  -7.206   6.196  -0.288
   96    HA   GLN  36           HA       GLN  36  -9.748   6.194   1.286
   97   1HB   GLN  36          1HB       GLN  36  -9.413   5.005  -1.032
   98   2HB   GLN  36          2HB       GLN  36  -8.495   3.826  -0.105
   99   1HG   GLN  36          1HG       GLN  36 -10.626   2.876  -0.116
  100   2HG   GLN  36          2HG       GLN  36 -10.658   3.721   1.422
  101   1HE2  GLN  36          2HE2      GLN  36 -11.928   3.615  -1.903
  102   2HE2  GLN  36          1HE2      GLN  36 -13.148   4.854  -1.635
  103    H    CYS  37           H        CYS  37  -6.458   4.807   1.192
  104    HA   CYS  37           HA       CYS  37  -6.319   4.913   4.102
  105   1HB   CYS  37          1HB       CYS  37  -5.964   2.317   2.560
  106   2HB   CYS  37          2HB       CYS  37  -4.958   2.616   3.945
  107    H    ARG  38           H        ARG  38  -4.061   4.499   4.803
  108    HA   ARG  38           HA       ARG  38  -2.150   6.245   3.801
  109   1HB   ARG  38          1HB       ARG  38  -1.689   3.642   5.328
  110   2HB   ARG  38          2HB       ARG  38  -0.548   4.970   5.171
  111   1HG   ARG  38          1HG       ARG  38  -1.333   5.739   7.085
  112   2HG   ARG  38          2HG       ARG  38  -2.744   6.304   6.213
  113   1HD   ARG  38          1HD       ARG  38  -2.531   3.531   7.479
  114   2HD   ARG  38          2HD       ARG  38  -3.067   4.927   8.385
  115    HE   ARG  38           HE       ARG  38  -4.650   3.374   6.539
  116   1HH1  ARG  38          1HH2      ARG  38  -4.446   6.530   8.042
  117   2HH1  ARG  38          2HH2      ARG  38  -6.152   6.820   7.850
  118   1HH2  ARG  38          2HH1      ARG  38  -6.791   3.894   6.156
  119   2HH2  ARG  38          1HH1      ARG  38  -7.432   5.352   6.854
  120    H    ALA  39           H        ALA  39  -2.543   2.832   2.830
  121    HA   ALA  39           HA       ALA  39  -1.390   3.466   0.263
  122   1HB   ALA  39          1HB       ALA  39   0.701   2.991   1.541
  123   2HB   ALA  39          2HB       ALA  39   0.022   1.419   2.037
  124   3HB   ALA  39          3HB       ALA  39   0.404   1.724   0.339
  125    HA   PRO  40           HA       PRO  40  -3.685  -0.410  -0.749
  126   1HB   PRO  40          2HB       PRO  40  -2.652  -0.990  -3.193
  127   2HB   PRO  40          1HB       PRO  40  -3.768   0.385  -2.941
  128   1HG   PRO  40          1HG       PRO  40  -0.736   0.447  -3.069
  129   2HG   PRO  40          2HG       PRO  40  -1.901   1.491  -3.944
  130   1HD   PRO  40          1HD       PRO  40  -0.684   2.243  -1.605
  131   2HD   PRO  40          2HD       PRO  40  -2.340   2.766  -2.026
  132    H    LYS  41           H        LYS  41  -2.962  -2.679  -1.399
  133    HA   LYS  41           HA       LYS  41  -1.202  -3.798   0.450
  134   1HB   LYS  41          1HB       LYS  41  -3.149  -4.814  -0.844
  135   2HB   LYS  41          2HB       LYS  41  -2.031  -5.080  -2.183
  136   1HG   LYS  41          1HG       LYS  41  -0.670  -6.571  -0.777
  137   2HG   LYS  41          2HG       LYS  41  -1.646  -6.165   0.650
  138   1HD   LYS  41          1HD       LYS  41  -3.634  -7.186  -0.421
  139   2HD   LYS  41          2HD       LYS  41  -2.664  -7.573  -1.861
  140   1HE   LYS  41          1HE       LYS  41  -1.153  -8.967  -0.461
  141   2HE   LYS  41          2HE       LYS  41  -2.116  -8.581   0.969
  142   1HZ   LYS  41          1HZ       LYS  41  -3.120 -10.052  -1.413
  143   2HZ   LYS  41          2HZ       LYS  41  -2.750 -10.726   0.025
  144   3HZ   LYS  41          3HZ       LYS  41  -4.010  -9.697  -0.086
  145    H    VAL  42           H        VAL  42  -0.187  -2.317  -2.424
  146    HA   VAL  42           HA       VAL  42   2.344  -3.519  -2.953
  147    HB   VAL  42           HB       VAL  42   1.513  -0.587  -3.056
  148   1HG1  VAL  42          2HG1      VAL  42   3.795  -2.038  -4.454
  149   2HG1  VAL  42          3HG1      VAL  42   3.267  -0.378  -4.811
  150   3HG1  VAL  42          1HG1      VAL  42   3.945  -0.755  -3.230
  151   1HG2  VAL  42          2HG2      VAL  42   1.437  -2.745  -5.213
  152   2HG2  VAL  42          3HG2      VAL  42   0.026  -1.973  -4.455
  153   3HG2  VAL  42          1HG2      VAL  42   1.104  -1.016  -5.467
  154    H    CYS  43           H        CYS  43   1.311  -1.376  -0.307
  155    HA   CYS  43           HA       CYS  43   3.953  -1.565   1.027
  156   1HB   CYS  43          1HB       CYS  43   3.941   0.296  -0.686
  157   2HB   CYS  43          2HB       CYS  43   2.653   1.078   0.235
  158    H    PHE  44           H        PHE  44   3.298   0.624   2.726
  159    HA   PHE  44           HA       PHE  44   0.705   0.073   4.040
  160   1HB   PHE  44          1HB       PHE  44   1.557  -0.195   6.202
  161   2HB   PHE  44          2HB       PHE  44   2.536  -1.263   5.215
  162    HD1  PHE  44           HD1      PHE  44   2.508   1.575   7.479
  163    HD2  PHE  44           HD2      PHE  44   4.913  -0.473   4.540
  164    HE1  PHE  44           HE1      PHE  44   4.528   2.751   8.313
  165    HE2  PHE  44           HE2      PHE  44   6.929   0.710   5.376
  166    HZ   PHE  44           HZ       PHE  44   6.741   2.326   7.257
  167    H    LYS  45           H        LYS  45   3.304   2.297   3.248
  168    HA   LYS  45           HA       LYS  45   1.575   4.609   3.812
  169   1HB   LYS  45          1HB       LYS  45   2.632   4.113   6.013
  170   2HB   LYS  45          2HB       LYS  45   4.230   4.263   5.283
  171   1HG   LYS  45          1HG       LYS  45   3.753   6.652   4.753
  172   2HG   LYS  45          2HG       LYS  45   2.128   6.474   5.450
  173   1HD   LYS  45          1HD       LYS  45   3.141   5.922   7.651
  174   2HD   LYS  45          2HD       LYS  45   4.765   6.081   6.943
  175   1HE   LYS  45          1HE       LYS  45   4.272   8.453   6.365
  176   2HE   LYS  45          2HE       LYS  45   2.664   8.293   7.084
  177   1HZ   LYS  45          2HZ       LYS  45   3.743   7.843   9.227
  178   2HZ   LYS  45          3HZ       LYS  45   5.228   7.995   8.561
  179   3HZ   LYS  45          1HZ       LYS  45   4.235   9.286   8.646
  180    H    CYS  46           H        CYS  46   5.038   3.825   3.084
  181    HA   CYS  46           HA       CYS  46   5.440   6.303   1.765
  182   1HB   CYS  46          1HB       CYS  46   7.676   5.065   1.159
  183   2HB   CYS  46          2HB       CYS  46   7.304   5.575   2.800
  184    H    LYS  47           H        LYS  47   4.691   3.141   0.420
  185    HA   LYS  47           HA       LYS  47   4.245   2.407  -1.707
  186   1HB   LYS  47          1HB       LYS  47   2.176   3.387  -2.476
  187   2HB   LYS  47          2HB       LYS  47   2.232   3.236  -0.726
  188   1HG   LYS  47          1HG       LYS  47   2.784   5.663  -0.540
  189   2HG   LYS  47          2HG       LYS  47   2.644   5.822  -2.293
  190   1HD   LYS  47          1HD       LYS  47   0.300   5.271  -2.227
  191   2HD   LYS  47          2HD       LYS  47   0.382   4.768  -0.533
  192   1HE   LYS  47          1HE       LYS  47   1.029   7.598  -1.452
  193   2HE   LYS  47          2HE       LYS  47  -0.600   7.084  -1.000
  194   1HZ   LYS  47          3HZ       LYS  47   1.724   6.867   0.845
  195   2HZ   LYS  47          1HZ       LYS  47   0.615   8.081   0.885
  196   3HZ   LYS  47          2HZ       LYS  47   0.183   6.529   1.195
  197    H    GLN  48           H        GLN  48   6.652   4.117  -1.994
  198    HA   GLN  48           HA       GLN  48   6.457   5.516  -4.480
  199   1HB   GLN  48          1HB       GLN  48   8.893   4.274  -3.136
  200   2HB   GLN  48          2HB       GLN  48   8.951   5.416  -4.471
  201   1HG   GLN  48          1HG       GLN  48   7.931   5.964  -1.656
  202   2HG   GLN  48          2HG       GLN  48   9.407   6.564  -2.386
  203   1HE2  GLN  48          2HE2      GLN  48   6.067   7.238  -1.888
  204   2HE2  GLN  48          1HE2      GLN  48   5.985   8.636  -2.966
  205    HA   PRO  49           HA       PRO  49   6.025   2.763  -7.668
  206   1HB   PRO  49          2HB       PRO  49   8.572   3.764  -8.960
  207   2HB   PRO  49          1HB       PRO  49   6.967   3.488  -9.710
  208   1HG   PRO  49          1HG       PRO  49   7.678   5.978  -8.968
  209   2HG   PRO  49          2HG       PRO  49   6.031   5.376  -8.578
  210   1HD   PRO  49          1HD       PRO  49   8.441   5.583  -6.775
  211   2HD   PRO  49          2HD       PRO  49   6.729   5.968  -6.446
  212    H    GLY  50           H        GLY  50   9.231   2.245  -6.291
  213   1HA   GLY  50          2HA       GLY  50  10.424   0.222  -7.571
  214   2HA   GLY  50          1HA       GLY  50   9.007  -0.643  -6.978
  215    H    HIS  51           H        HIS  51   9.699   1.562  -4.581
  216    HA   HIS  51           HA       HIS  51  12.022   0.536  -3.323
  217   1HB   HIS  51          1HB       HIS  51  11.448   1.929  -1.538
  218   2HB   HIS  51          2HB       HIS  51  10.729   2.746  -2.917
  219    HD1  HIS  51           HD1      HIS  51   7.848   1.878  -3.151
  220    HD2  HIS  51           HD2      HIS  51   9.955   1.464   0.476
  221    HE1  HIS  51           HE1      HIS  51   6.130   1.296  -1.375
  222    H    PHE  52           H        PHE  52   8.729  -0.653  -3.239
  223    HA   PHE  52           HA       PHE  52   8.625  -1.704  -0.660
  224   1HB   PHE  52          1HB       PHE  52   6.709  -3.092  -1.620
  225   2HB   PHE  52          2HB       PHE  52   6.599  -1.350  -1.716
  226    HD1  PHE  52           HD1      PHE  52   6.551  -0.177  -3.835
  227    HD2  PHE  52           HD2      PHE  52   7.130  -4.453  -3.709
  228    HE1  PHE  52           HE1      PHE  52   6.160  -0.303  -6.273
  229    HE2  PHE  52           HE2      PHE  52   6.758  -4.568  -6.157
  230    HZ   PHE  52           HZ       PHE  52   6.277  -2.493  -7.448
  231    H    SER  53           H        SER  53   9.596  -3.438  -3.638
  232    HA   SER  53           HA       SER  53   9.967  -6.007  -2.527
  233   1HB   SER  53          1HB       SER  53  11.511  -4.681  -4.791
  234   2HB   SER  53          2HB       SER  53  11.375  -6.426  -4.490
  235    HG   SER  53           HG       SER  53   9.874  -5.703  -6.070
  236    H    LYS  54           H        LYS  54  11.731  -3.250  -1.692
  237    HA   LYS  54           HA       LYS  54  14.070  -4.818  -0.660
  238   1HB   LYS  54          1HB       LYS  54  14.045  -1.950  -1.684
  239   2HB   LYS  54          2HB       LYS  54  15.453  -2.847  -1.132
  240   1HG   LYS  54          1HG       LYS  54  13.826  -3.478  -3.634
  241   2HG   LYS  54          2HG       LYS  54  15.362  -2.622  -3.579
  242   1HD   LYS  54          1HD       LYS  54  16.515  -4.606  -2.719
  243   2HD   LYS  54          2HD       LYS  54  14.988  -5.507  -2.658
  244   1HE   LYS  54          1HE       LYS  54  14.708  -5.189  -5.113
  245   2HE   LYS  54          2HE       LYS  54  16.258  -4.341  -5.172
  246   1HZ   LYS  54          1HZ       LYS  54  15.895  -7.171  -4.326
  247   2HZ   LYS  54          2HZ       LYS  54  16.500  -6.688  -5.762
  248   3HZ   LYS  54          3HZ       LYS  54  17.330  -6.388  -4.389
  249    H    GLN  55           H        GLN  55  11.347  -3.429   0.469
  250    HA   GLN  55           HA       GLN  55  12.598  -2.699   3.052
  251   1HB   GLN  55          1HB       GLN  55  12.574  -0.622   1.579
  252   2HB   GLN  55          2HB       GLN  55  10.812  -0.719   1.583
  253   1HG   GLN  55          1HG       GLN  55  10.925  -0.597   4.142
  254   2HG   GLN  55          2HG       GLN  55  12.658  -0.307   3.981
  255   1HE2  GLN  55          1HE2      GLN  55   9.425   1.000   3.454
  256   2HE2  GLN  55          2HE2      GLN  55   9.935   2.661   3.188
  257    H    CYS  56           H        CYS  56   9.475  -2.886   1.272
  258    HA   CYS  56           HA       CYS  56   8.050  -3.189   3.873
  259   1HB   CYS  56          1HB       CYS  56   7.105  -2.141   1.174
  260   2HB   CYS  56          2HB       CYS  56   6.149  -2.211   2.658
  261    H    ARG  57           H        ARG  57   8.455  -4.729   0.759
  262    HA   ARG  57           HA       ARG  57   6.704  -7.050   1.533
  263   1HB   ARG  57          1HB       ARG  57   7.322  -5.962  -1.247
  264   2HB   ARG  57          2HB       ARG  57   6.335  -7.372  -0.903
  265   1HG   ARG  57          1HG       ARG  57   5.608  -4.503  -0.185
  266   2HG   ARG  57          2HG       ARG  57   5.025  -5.425  -1.563
  267   1HD   ARG  57          1HD       ARG  57   3.258  -5.722  -0.179
  268   2HD   ARG  57          2HD       ARG  57   4.194  -7.141   0.281
  269    HE   ARG  57           HE       ARG  57   5.083  -5.774   2.206
  270   1HH1  ARG  57          1HH2      ARG  57   2.011  -4.674   0.875
  271   2HH1  ARG  57          2HH2      ARG  57   1.780  -3.572   2.205
  272   1HH2  ARG  57          1HH1      ARG  57   4.650  -4.504   3.848
  273   2HH2  ARG  57          2HH1      ARG  57   3.124  -3.649   3.961
  274    H    SER  58           H        SER  58   9.835  -6.132   1.284
  275    HA   SER  58           HA       SER  58  11.240  -8.152  -0.117
  276   1HB   SER  58          1HB       SER  58  13.102  -7.523   1.508
  277   2HB   SER  58          2HB       SER  58  12.432  -6.236   0.501
  278    HG   SER  58           HG       SER  58  11.658  -6.773   3.195

  No H/Q in entry =         278
  Start of MODEL   23
    1    H1   GLN  22           H1       GLN  22  -8.059  -0.026  -7.095
    2    H2   GLN  22           H3       GLN  22  -7.317   1.127  -6.194
    3    H3   GLN  22           H2       GLN  22  -6.769   0.775  -7.709
    4    HA   GLN  22           HA       GLN  22  -6.076  -1.396  -7.053
    5   1HB   GLN  22          1HB       GLN  22  -5.037   0.572  -4.978
    6   2HB   GLN  22          2HB       GLN  22  -4.228  -0.865  -5.578
    7   1HG   GLN  22          1HG       GLN  22  -4.718   1.702  -7.143
    8   2HG   GLN  22          2HG       GLN  22  -3.206   1.136  -6.462
    9   1HE2  GLN  22          2HE2      GLN  22  -1.844   0.346  -8.081
   10   2HE2  GLN  22          1HE2      GLN  22  -2.429  -0.555  -9.476
   11    H    THR  23           H        THR  23  -5.243  -2.293  -4.578
   12    HA   THR  23           HA       THR  23  -7.788  -2.817  -3.075
   13    HB   THR  23           HB       THR  23  -5.495  -4.713  -3.720
   14    HG1  THR  23           HG1      THR  23  -6.847  -4.456  -5.455
   15   1HG2  THR  23          1HG2      THR  23  -8.084  -5.268  -2.209
   16   2HG2  THR  23          2HG2      THR  23  -6.911  -6.482  -2.751
   17   3HG2  THR  23          3HG2      THR  23  -6.441  -5.306  -1.521
   18    H    CYS  24           H        CYS  24  -7.659  -2.829  -0.851
   19    HA   CYS  24           HA       CYS  24  -5.809  -1.082   0.319
   20   1HB   CYS  24          1HB       CYS  24  -8.208  -1.719   0.995
   21   2HB   CYS  24          2HB       CYS  24  -7.496  -3.111   1.824
   22    H    TYR  25           H        TYR  25  -4.232  -1.261   1.869
   23    HA   TYR  25           HA       TYR  25  -2.607  -3.676   2.111
   24   1HB   TYR  25          1HB       TYR  25  -1.124  -2.400   3.284
   25   2HB   TYR  25          2HB       TYR  25  -1.802  -1.211   2.195
   26    HD1  TYR  25           HD1      TYR  25  -0.725  -1.742   5.450
   27    HD2  TYR  25           HD2      TYR  25  -4.061   0.020   3.350
   28    HE1  TYR  25           HE1      TYR  25  -1.242  -0.342   7.438
   29    HE2  TYR  25           HE2      TYR  25  -4.594   1.379   5.354
   30    HH   TYR  25           HH       TYR  25  -2.675   1.187   8.364
   31    H    ASN  26           H        ASN  26  -5.419  -2.556   3.727
   32    HA   ASN  26           HA       ASN  26  -4.914  -4.292   6.132
   33   1HB   ASN  26          1HB       ASN  26  -4.343  -1.997   6.653
   34   2HB   ASN  26          2HB       ASN  26  -5.828  -1.388   5.925
   35   1HD2  ASN  26          1HD2      ASN  26  -7.785  -1.457   7.132
   36   2HD2  ASN  26          2HD2      ASN  26  -7.778  -1.939   8.821
   37    H    CYS  27           H        CYS  27  -7.473  -2.499   4.331
   38    HA   CYS  27           HA       CYS  27  -9.610  -3.646   5.814
   39   1HB   CYS  27          1HB       CYS  27  -9.630  -2.211   3.125
   40   2HB   CYS  27          2HB       CYS  27 -11.008  -2.435   4.208
   41    H    GLY  28           H        GLY  28  -7.847  -4.998   3.177
   42   1HA   GLY  28          2HA       GLY  28  -9.361  -7.400   2.958
   43   2HA   GLY  28          1HA       GLY  28  -8.166  -6.816   1.790
   44    H    LYS  29           H        LYS  29  -9.298  -4.521   0.820
   45    HA   LYS  29           HA       LYS  29 -11.794  -5.377  -0.543
   46   1HB   LYS  29          1HB       LYS  29 -11.653  -3.454   1.603
   47   2HB   LYS  29          2HB       LYS  29 -11.834  -2.523   0.149
   48   1HG   LYS  29          1HG       LYS  29 -13.991  -2.952   1.159
   49   2HG   LYS  29          2HG       LYS  29 -13.899  -3.663  -0.444
   50   1HD   LYS  29          1HD       LYS  29 -15.064  -5.163   1.105
   51   2HD   LYS  29          2HD       LYS  29 -13.573  -5.907   0.543
   52   1HE   LYS  29          1HE       LYS  29 -12.541  -4.838   2.735
   53   2HE   LYS  29          2HE       LYS  29 -14.219  -4.720   3.265
   54   1HZ   LYS  29          1HZ       LYS  29 -12.809  -7.194   2.414
   55   2HZ   LYS  29          2HZ       LYS  29 -13.157  -6.797   3.958
   56   3HZ   LYS  29          3HZ       LYS  29 -14.376  -7.152   2.920
   57    HA   PRO  30           HA       PRO  30  -9.863  -3.137  -4.031
   58   1HB   PRO  30          2HB       PRO  30 -11.937  -3.167  -5.787
   59   2HB   PRO  30          1HB       PRO  30 -11.037  -4.650  -5.363
   60   1HG   PRO  30          1HG       PRO  30 -13.652  -3.668  -4.170
   61   2HG   PRO  30          2HG       PRO  30 -13.292  -5.285  -4.859
   62   1HD   PRO  30          1HD       PRO  30 -13.137  -4.778  -2.192
   63   2HD   PRO  30          2HD       PRO  30 -12.000  -5.897  -2.991
   64    H    GLY  31           H        GLY  31 -11.084  -1.217  -5.525
   65   1HA   GLY  31          2HA       GLY  31 -12.846   0.590  -4.175
   66   2HA   GLY  31          1HA       GLY  31 -11.805   0.977  -5.552
   67    H    HIS  32           H        HIS  32  -9.346   0.224  -4.058
   68    HA   HIS  32           HA       HIS  32  -9.189   2.391  -2.012
   69   1HB   HIS  32          1HB       HIS  32  -8.103  -0.401  -2.166
   70   2HB   HIS  32          2HB       HIS  32  -7.118   0.824  -1.375
   71    HD1  HIS  32           HD1      HIS  32 -10.730  -0.598  -1.011
   72    HD2  HIS  32           HD2      HIS  32  -7.699   1.477   1.038
   73    HE1  HIS  32           HE1      HIS  32 -11.502  -0.399   1.421
   74    H    LEU  33           H        LEU  33  -7.460   3.644  -1.831
   75    HA   LEU  33           HA       LEU  33  -5.382   3.980  -3.870
   76   1HB   LEU  33          1HB       LEU  33  -7.729   5.906  -3.444
   77   2HB   LEU  33          2HB       LEU  33  -6.258   6.351  -4.296
   78    HG   LEU  33           HG       LEU  33  -8.238   4.244  -5.243
   79   1HD1  LEU  33          2HD1      LEU  33  -9.134   6.526  -5.323
   80   2HD1  LEU  33          3HD1      LEU  33  -7.696   7.074  -6.211
   81   3HD1  LEU  33          1HD1      LEU  33  -8.813   5.904  -6.949
   82   1HD2  LEU  33          1HD2      LEU  33  -5.790   5.465  -6.607
   83   2HD2  LEU  33          2HD2      LEU  33  -5.935   3.782  -6.056
   84   3HD2  LEU  33          3HD2      LEU  33  -6.966   4.370  -7.368
   85    H    SER  34           H        SER  34  -4.114   6.020  -3.261
   86    HA   SER  34           HA       SER  34  -3.383   6.348  -0.568
   87   1HB   SER  34          1HB       SER  34  -3.327   8.436  -2.778
   88   2HB   SER  34          2HB       SER  34  -2.300   8.398  -1.332
   89    HG   SER  34           HG       SER  34  -1.363   7.524  -3.338
   90    H    SER  35           H        SER  35  -6.212   7.639  -2.167
   91    HA   SER  35           HA       SER  35  -6.814   9.631  -0.075
   92   1HB   SER  35          1HB       SER  35  -8.772  10.093  -1.549
   93   2HB   SER  35          2HB       SER  35  -7.211  10.259  -2.369
   94    HG   SER  35           HG       SER  35  -8.751   9.063  -3.609
   95    H    GLN  36           H        GLN  36  -7.291   6.301  -0.393
   96    HA   GLN  36           HA       GLN  36  -9.875   6.291   1.117
   97   1HB   GLN  36          1HB       GLN  36  -9.554   5.022  -1.122
   98   2HB   GLN  36          2HB       GLN  36  -8.490   3.945  -0.216
   99   1HG   GLN  36          1HG       GLN  36 -10.571   2.857  -0.214
  100   2HG   GLN  36          2HG       GLN  36 -10.489   3.573   1.389
  101   1HE2  GLN  36          2HE2      GLN  36 -12.110   3.604  -1.758
  102   2HE2  GLN  36          1HE2      GLN  36 -13.378   4.731  -1.276
  103    H    CYS  37           H        CYS  37  -6.565   4.971   1.091
  104    HA   CYS  37           HA       CYS  37  -6.481   4.778   4.040
  105   1HB   CYS  37          1HB       CYS  37  -6.085   2.488   2.075
  106   2HB   CYS  37          2HB       CYS  37  -5.228   2.508   3.600
  107    H    ARG  38           H        ARG  38  -4.192   4.309   4.730
  108    HA   ARG  38           HA       ARG  38  -2.376   6.268   3.766
  109   1HB   ARG  38          1HB       ARG  38  -1.959   3.798   5.500
  110   2HB   ARG  38          2HB       ARG  38  -0.693   4.984   5.188
  111   1HG   ARG  38          1HG       ARG  38  -1.471   6.419   6.698
  112   2HG   ARG  38          2HG       ARG  38  -3.089   6.410   6.020
  113   1HD   ARG  38          1HD       ARG  38  -1.992   4.350   7.979
  114   2HD   ARG  38          2HD       ARG  38  -2.999   5.723   8.425
  115    HE   ARG  38           HE       ARG  38  -3.860   3.195   7.341
  116   1HH1  ARG  38          1HH1      ARG  38  -4.868   6.557   7.509
  117   2HH1  ARG  38          2HH1      ARG  38  -6.536   6.157   7.211
  118   1HH2  ARG  38          2HH2      ARG  38  -5.993   2.778   6.932
  119   2HH2  ARG  38          1HH2      ARG  38  -7.137   4.075   6.833
  120    H    ALA  39           H        ALA  39  -2.649   2.896   2.750
  121    HA   ALA  39           HA       ALA  39  -1.345   3.608   0.278
  122   1HB   ALA  39          3HB       ALA  39   0.669   3.056   1.639
  123   2HB   ALA  39          1HB       ALA  39  -0.060   1.486   2.063
  124   3HB   ALA  39          2HB       ALA  39   0.414   1.823   0.395
  125    HA   PRO  40           HA       PRO  40  -3.659  -0.184  -0.956
  126   1HB   PRO  40          2HB       PRO  40  -2.530  -0.735  -3.361
  127   2HB   PRO  40          1HB       PRO  40  -3.604   0.677  -3.123
  128   1HG   PRO  40          1HG       PRO  40  -0.568   0.633  -3.096
  129   2HG   PRO  40          2HG       PRO  40  -1.648   1.731  -4.014
  130   1HD   PRO  40          1HD       PRO  40  -0.546   2.402  -1.595
  131   2HD   PRO  40          2HD       PRO  40  -2.160   2.982  -2.096
  132    H    LYS  41           H        LYS  41  -3.002  -2.449  -1.537
  133    HA   LYS  41           HA       LYS  41  -1.420  -3.640   0.384
  134   1HB   LYS  41          1HB       LYS  41  -3.268  -4.563  -1.153
  135   2HB   LYS  41          2HB       LYS  41  -1.993  -4.903  -2.322
  136   1HG   LYS  41          1HG       LYS  41  -0.896  -6.411  -0.700
  137   2HG   LYS  41          2HG       LYS  41  -2.080  -5.960   0.545
  138   1HD   LYS  41          1HD       LYS  41  -3.905  -6.866  -0.894
  139   2HD   LYS  41          2HD       LYS  41  -2.710  -7.390  -2.084
  140   1HE   LYS  41          1HE       LYS  41  -2.824  -8.316   0.827
  141   2HE   LYS  41          2HE       LYS  41  -3.544  -9.187  -0.528
  142   1HZ   LYS  41          1HZ       LYS  41  -1.315  -9.407  -1.497
  143   2HZ   LYS  41          2HZ       LYS  41  -0.640  -8.644  -0.214
  144   3HZ   LYS  41          3HZ       LYS  41  -1.372 -10.085  -0.017
  145    H    VAL  42           H        VAL  42  -0.134  -2.308  -2.492
  146    HA   VAL  42           HA       VAL  42   2.358  -3.619  -2.819
  147    HB   VAL  42           HB       VAL  42   1.688  -0.656  -3.087
  148   1HG1  VAL  42          3HG1      VAL  42   3.918  -2.297  -4.352
  149   2HG1  VAL  42          1HG1      VAL  42   3.499  -0.629  -4.795
  150   3HG1  VAL  42          2HG1      VAL  42   4.113  -0.972  -3.182
  151   1HG2  VAL  42          1HG2      VAL  42   1.533  -2.906  -5.141
  152   2HG2  VAL  42          2HG2      VAL  42   0.157  -2.002  -4.471
  153   3HG2  VAL  42          3HG2      VAL  42   1.330  -1.177  -5.493
  154    H    CYS  43           H        CYS  43   1.316  -1.345  -0.319
  155    HA   CYS  43           HA       CYS  43   3.875  -1.563   1.156
  156   1HB   CYS  43          1HB       CYS  43   3.983   0.276  -0.586
  157   2HB   CYS  43          2HB       CYS  43   2.655   1.084   0.256
  158    H    PHE  44           H        PHE  44   3.279   0.525   2.872
  159    HA   PHE  44           HA       PHE  44   0.564   0.187   4.022
  160   1HB   PHE  44          1HB       PHE  44   1.320  -0.137   6.228
  161   2HB   PHE  44          2HB       PHE  44   2.208  -1.300   5.261
  162    HD1  PHE  44           HD1      PHE  44   2.427   1.496   7.558
  163    HD2  PHE  44           HD2      PHE  44   4.667  -0.744   4.628
  164    HE1  PHE  44           HE1      PHE  44   4.542   2.427   8.461
  165    HE2  PHE  44           HE2      PHE  44   6.777   0.200   5.528
  166    HZ   PHE  44           HZ       PHE  44   6.723   1.785   7.443
  167    H    LYS  45           H        LYS  45   3.227   2.243   3.198
  168    HA   LYS  45           HA       LYS  45   1.817   4.683   4.092
  169   1HB   LYS  45          1HB       LYS  45   2.993   3.937   6.124
  170   2HB   LYS  45          2HB       LYS  45   4.509   3.812   5.232
  171   1HG   LYS  45          1HG       LYS  45   4.428   6.312   4.850
  172   2HG   LYS  45          2HG       LYS  45   2.924   6.366   5.779
  173   1HD   LYS  45          1HD       LYS  45   4.756   7.039   7.196
  174   2HD   LYS  45          2HD       LYS  45   4.160   5.474   7.767
  175   1HE   LYS  45          1HE       LYS  45   6.032   4.328   6.611
  176   2HE   LYS  45          2HE       LYS  45   6.585   5.869   5.948
  177   1HZ   LYS  45          2HZ       LYS  45   6.495   5.203   8.844
  178   2HZ   LYS  45          3HZ       LYS  45   7.846   5.251   7.930
  179   3HZ   LYS  45          1HZ       LYS  45   7.015   6.621   8.224
  180    H    CYS  46           H        CYS  46   5.146   3.710   3.095
  181    HA   CYS  46           HA       CYS  46   5.601   6.205   1.824
  182   1HB   CYS  46          1HB       CYS  46   7.762   4.802   1.118
  183   2HB   CYS  46          2HB       CYS  46   7.500   5.451   2.731
  184    H    LYS  47           H        LYS  47   4.725   3.089   0.458
  185    HA   LYS  47           HA       LYS  47   4.210   2.392  -1.667
  186   1HB   LYS  47          1HB       LYS  47   2.160   3.464  -2.390
  187   2HB   LYS  47          2HB       LYS  47   2.241   3.270  -0.645
  188   1HG   LYS  47          1HG       LYS  47   2.869   5.666  -0.405
  189   2HG   LYS  47          2HG       LYS  47   2.731   5.879  -2.152
  190   1HD   LYS  47          1HD       LYS  47   0.372   5.422  -2.095
  191   2HD   LYS  47          2HD       LYS  47   0.436   4.853  -0.421
  192   1HE   LYS  47          1HE       LYS  47   1.198   7.689  -1.218
  193   2HE   LYS  47          2HE       LYS  47  -0.458   7.226  -0.810
  194   1HZ   LYS  47          1HZ       LYS  47   1.830   6.839   1.052
  195   2HZ   LYS  47          2HZ       LYS  47   0.767   8.090   1.128
  196   3HZ   LYS  47          3HZ       LYS  47   0.267   6.547   1.369
  197    H    GLN  48           H        GLN  48   6.662   4.042  -1.976
  198    HA   GLN  48           HA       GLN  48   6.456   5.436  -4.473
  199   1HB   GLN  48          1HB       GLN  48   8.888   4.182  -3.137
  200   2HB   GLN  48          2HB       GLN  48   8.948   5.313  -4.482
  201   1HG   GLN  48          1HG       GLN  48   7.979   5.890  -1.656
  202   2HG   GLN  48          2HG       GLN  48   9.443   6.474  -2.419
  203   1HE2  GLN  48          2HE2      GLN  48   6.125   7.180  -1.848
  204   2HE2  GLN  48          1HE2      GLN  48   6.027   8.572  -2.934
  205    HA   PRO  49           HA       PRO  49   5.999   2.606  -7.611
  206   1HB   PRO  49          2HB       PRO  49   8.537   3.589  -8.933
  207   2HB   PRO  49          1HB       PRO  49   6.928   3.294  -9.670
  208   1HG   PRO  49          1HG       PRO  49   7.642   5.802  -8.984
  209   2HG   PRO  49          2HG       PRO  49   6.000   5.207  -8.574
  210   1HD   PRO  49          1HD       PRO  49   8.415   5.450  -6.784
  211   2HD   PRO  49          2HD       PRO  49   6.704   5.847  -6.457
  212    H    GLY  50           H        GLY  50   9.240   2.179  -6.266
  213   1HA   GLY  50          2HA       GLY  50  10.456   0.146  -7.476
  214   2HA   GLY  50          1HA       GLY  50   9.061  -0.739  -6.862
  215    H    HIS  51           H        HIS  51   9.661   1.508  -4.497
  216    HA   HIS  51           HA       HIS  51  12.016   0.596  -3.212
  217   1HB   HIS  51          1HB       HIS  51  11.359   1.950  -1.423
  218   2HB   HIS  51          2HB       HIS  51  10.644   2.744  -2.815
  219    HD1  HIS  51           HD1      HIS  51   7.791   1.759  -3.105
  220    HD2  HIS  51           HD2      HIS  51   9.841   1.464   0.568
  221    HE1  HIS  51           HE1      HIS  51   6.063   1.135  -1.357
  222    H    PHE  52           H        PHE  52   8.772  -0.756  -3.141
  223    HA   PHE  52           HA       PHE  52   8.796  -1.935  -0.602
  224   1HB   PHE  52          1HB       PHE  52   6.920  -3.335  -1.483
  225   2HB   PHE  52          2HB       PHE  52   6.742  -1.608  -1.689
  226    HD1  PHE  52           HD1      PHE  52   6.743  -0.553  -3.907
  227    HD2  PHE  52           HD2      PHE  52   7.248  -4.818  -3.462
  228    HE1  PHE  52           HE1      PHE  52   6.315  -0.862  -6.325
  229    HE2  PHE  52           HE2      PHE  52   6.824  -5.114  -5.887
  230    HZ   PHE  52           HZ       PHE  52   6.361  -3.137  -7.325
  231    H    SER  53           H        SER  53   9.844  -3.401  -3.699
  232    HA   SER  53           HA       SER  53  10.438  -5.989  -2.805
  233   1HB   SER  53          1HB       SER  53  11.897  -4.354  -4.914
  234   2HB   SER  53          2HB       SER  53  11.901  -6.124  -4.767
  235    HG   SER  53           HG       SER  53  10.360  -5.391  -6.303
  236    H    LYS  54           H        LYS  54  12.013  -3.197  -1.695
  237    HA   LYS  54           HA       LYS  54  14.193  -4.821  -0.492
  238   1HB   LYS  54          1HB       LYS  54  15.831  -3.072  -0.932
  239   2HB   LYS  54          2HB       LYS  54  15.152  -3.699  -2.429
  240   1HG   LYS  54          1HG       LYS  54  13.714  -1.707  -2.665
  241   2HG   LYS  54          2HG       LYS  54  14.252  -1.104  -1.091
  242   1HD   LYS  54          1HD       LYS  54  15.409   0.108  -2.804
  243   2HD   LYS  54          2HD       LYS  54  16.578  -0.928  -1.972
  244   1HE   LYS  54          1HE       LYS  54  16.407  -2.589  -3.829
  245   2HE   LYS  54          2HE       LYS  54  15.224  -1.554  -4.641
  246   1HZ   LYS  54          3HZ       LYS  54  16.951   0.162  -4.813
  247   2HZ   LYS  54          1HZ       LYS  54  18.042  -0.800  -4.064
  248   3HZ   LYS  54          2HZ       LYS  54  17.457  -1.212  -5.530
  249    H    GLN  55           H        GLN  55  11.532  -3.475   0.422
  250    HA   GLN  55           HA       GLN  55  12.633  -2.761   3.049
  251   1HB   GLN  55          1HB       GLN  55  12.600  -0.593   1.717
  252   2HB   GLN  55          2HB       GLN  55  10.843  -0.741   1.640
  253   1HG   GLN  55          1HG       GLN  55  10.863  -0.827   4.209
  254   2HG   GLN  55          2HG       GLN  55  12.586  -0.452   4.132
  255   1HE2  GLN  55          1HE2      GLN  55   9.317   0.754   3.573
  256   2HE2  GLN  55          2HE2      GLN  55   9.758   2.449   3.436
  257    H    CYS  56           H        CYS  56   9.541  -2.667   1.205
  258    HA   CYS  56           HA       CYS  56   8.066  -3.445   3.649
  259   1HB   CYS  56          1HB       CYS  56   7.115  -2.204   1.036
  260   2HB   CYS  56          2HB       CYS  56   6.150  -2.453   2.492
  261    H    ARG  57           H        ARG  57   9.192  -4.997   0.930
  262    HA   ARG  57           HA       ARG  57   7.466  -7.358   1.283
  263   1HB   ARG  57          1HB       ARG  57   6.659  -5.544  -0.549
  264   2HB   ARG  57          2HB       ARG  57   7.905  -6.281  -1.528
  265   1HG   ARG  57          1HG       ARG  57   5.641  -7.189  -1.940
  266   2HG   ARG  57          2HG       ARG  57   6.755  -8.450  -1.424
  267   1HD   ARG  57          1HD       ARG  57   4.452  -8.585  -0.395
  268   2HD   ARG  57          2HD       ARG  57   5.773  -8.578   0.754
  269    HE   ARG  57           HE       ARG  57   5.228  -6.388   1.469
  270   1HH1  ARG  57          2HH2      ARG  57   3.009  -7.273  -1.124
  271   2HH1  ARG  57          1HH2      ARG  57   1.953  -5.923  -0.720
  272   1HH2  ARG  57          2HH1      ARG  57   3.799  -4.766   1.866
  273   2HH2  ARG  57          1HH1      ARG  57   2.365  -4.606   0.860
  274    H    SER  58           H        SER  58  10.356  -6.564   1.644
  275    HA   SER  58           HA       SER  58  12.187  -7.663  -0.116
  276   1HB   SER  58          1HB       SER  58  12.305  -7.794   2.916
  277   2HB   SER  58          2HB       SER  58  13.677  -7.878   1.796
  278    HG   SER  58           HG       SER  58  13.337  -5.744   2.645

  No H/Q in entry =         278
  Start of MODEL   24
    1    H1   GLN  22           H2       GLN  22  -8.097  -0.428  -6.217
    2    H2   GLN  22           H1       GLN  22  -7.051   0.740  -5.752
    3    H3   GLN  22           H3       GLN  22  -7.055   0.218  -7.313
    4    HA   GLN  22           HA       GLN  22  -6.347  -1.980  -6.625
    5   1HB   GLN  22          1HB       GLN  22  -4.635  -0.321  -7.305
    6   2HB   GLN  22          2HB       GLN  22  -4.528   0.265  -5.648
    7   1HG   GLN  22          1HG       GLN  22  -2.646  -1.171  -6.142
    8   2HG   GLN  22          2HG       GLN  22  -3.639  -1.943  -4.918
    9   1HE2  GLN  22          2HE2      GLN  22  -1.877  -2.672  -7.645
   10   2HE2  GLN  22          1HE2      GLN  22  -2.796  -4.080  -8.158
   11    H    THR  23           H        THR  23  -6.226  -3.501  -5.020
   12    HA   THR  23           HA       THR  23  -7.755  -3.229  -2.754
   13    HB   THR  23           HB       THR  23  -5.453  -5.184  -3.066
   14    HG1  THR  23           HG1      THR  23  -6.967  -6.412  -4.186
   15   1HG2  THR  23          3HG2      THR  23  -8.163  -5.433  -1.675
   16   2HG2  THR  23          1HG2      THR  23  -6.980  -6.741  -1.876
   17   3HG2  THR  23          2HG2      THR  23  -6.581  -5.354  -0.858
   18    H    CYS  24           H        CYS  24  -7.596  -2.676  -0.700
   19    HA   CYS  24           HA       CYS  24  -5.663  -0.971   0.338
   20   1HB   CYS  24          1HB       CYS  24  -8.074  -1.426   1.037
   21   2HB   CYS  24          2HB       CYS  24  -7.477  -2.836   1.909
   22    H    TYR  25           H        TYR  25  -4.075  -1.130   1.930
   23    HA   TYR  25           HA       TYR  25  -2.563  -3.586   2.292
   24   1HB   TYR  25          1HB       TYR  25  -1.072  -2.346   3.479
   25   2HB   TYR  25          2HB       TYR  25  -1.710  -1.130   2.394
   26    HD1  TYR  25           HD1      TYR  25  -0.648  -1.674   5.633
   27    HD2  TYR  25           HD2      TYR  25  -4.002   0.081   3.556
   28    HE1  TYR  25           HE1      TYR  25  -1.168  -0.292   7.631
   29    HE2  TYR  25           HE2      TYR  25  -4.543   1.415   5.576
   30    HH   TYR  25           HH       TYR  25  -2.606   1.224   8.573
   31    H    ASN  26           H        ASN  26  -5.405  -2.424   3.778
   32    HA   ASN  26           HA       ASN  26  -5.070  -4.214   6.173
   33   1HB   ASN  26          1HB       ASN  26  -4.598  -1.910   6.782
   34   2HB   ASN  26          2HB       ASN  26  -6.035  -1.326   5.949
   35   1HD2  ASN  26          2HD2      ASN  26  -8.103  -1.519   6.977
   36   2HD2  ASN  26          1HD2      ASN  26  -8.206  -2.017   8.659
   37    H    CYS  27           H        CYS  27  -7.479  -2.438   4.184
   38    HA   CYS  27           HA       CYS  27  -9.692  -3.706   5.491
   39   1HB   CYS  27          1HB       CYS  27  -9.609  -1.926   3.026
   40   2HB   CYS  27          2HB       CYS  27 -11.006  -2.232   4.064
   41    H    GLY  28           H        GLY  28  -7.817  -4.868   2.907
   42   1HA   GLY  28          2HA       GLY  28  -9.352  -7.164   2.383
   43   2HA   GLY  28          1HA       GLY  28  -8.060  -6.541   1.353
   44    H    LYS  29           H        LYS  29  -9.486  -4.040   0.742
   45    HA   LYS  29           HA       LYS  29 -11.838  -4.966  -0.860
   46   1HB   LYS  29          1HB       LYS  29 -12.369  -3.711   1.193
   47   2HB   LYS  29          2HB       LYS  29 -11.378  -2.376   0.643
   48   1HG   LYS  29          1HG       LYS  29 -13.641  -1.786   0.242
   49   2HG   LYS  29          2HG       LYS  29 -12.939  -2.110  -1.343
   50   1HD   LYS  29          1HD       LYS  29 -14.004  -4.361  -1.354
   51   2HD   LYS  29          2HD       LYS  29 -14.630  -4.072   0.282
   52   1HE   LYS  29          1HE       LYS  29 -15.906  -2.107  -0.569
   53   2HE   LYS  29          2HE       LYS  29 -15.310  -2.432  -2.202
   54   1HZ   LYS  29          2HZ       LYS  29 -16.994  -4.288  -0.598
   55   2HZ   LYS  29          3HZ       LYS  29 -17.517  -3.389  -1.854
   56   3HZ   LYS  29          1HZ       LYS  29 -16.448  -4.594  -2.108
   57    HA   PRO  30           HA       PRO  30  -9.203  -3.705  -4.317
   58   1HB   PRO  30          2HB       PRO  30 -11.894  -3.755  -5.688
   59   2HB   PRO  30          1HB       PRO  30 -10.310  -4.344  -6.286
   60   1HG   PRO  30          1HG       PRO  30 -12.077  -6.093  -5.243
   61   2HG   PRO  30          2HG       PRO  30 -10.349  -6.197  -4.771
   62   1HD   PRO  30          1HD       PRO  30 -12.650  -4.986  -3.240
   63   2HD   PRO  30          2HD       PRO  30 -11.301  -6.005  -2.654
   64    H    GLY  31           H        GLY  31 -12.155  -1.869  -3.585
   65   1HA   GLY  31          2HA       GLY  31 -12.852   0.270  -4.051
   66   2HA   GLY  31          1HA       GLY  31 -11.639   0.356  -5.326
   67    H    HIS  32           H        HIS  32  -9.326  -0.028  -3.599
   68    HA   HIS  32           HA       HIS  32  -9.374   2.417  -1.896
   69   1HB   HIS  32          1HB       HIS  32  -7.944  -0.206  -1.685
   70   2HB   HIS  32          2HB       HIS  32  -7.132   1.232  -1.079
   71    HD1  HIS  32           HD1      HIS  32 -10.499  -0.602  -0.553
   72    HD2  HIS  32           HD2      HIS  32  -7.784   2.006   1.293
   73    HE1  HIS  32           HE1      HIS  32 -11.359  -0.241   1.842
   74    H    LEU  33           H        LEU  33  -7.532   3.657  -1.716
   75    HA   LEU  33           HA       LEU  33  -5.707   4.111  -3.961
   76   1HB   LEU  33          1HB       LEU  33  -7.997   5.998  -3.183
   77   2HB   LEU  33          2HB       LEU  33  -6.635   6.483  -4.185
   78    HG   LEU  33           HG       LEU  33  -8.702   4.390  -4.977
   79   1HD1  LEU  33          1HD1      LEU  33  -9.634   6.655  -4.851
   80   2HD1  LEU  33          2HD1      LEU  33  -8.314   7.271  -5.874
   81   3HD1  LEU  33          3HD1      LEU  33  -9.494   6.112  -6.529
   82   1HD2  LEU  33          2HD2      LEU  33  -6.450   5.712  -6.569
   83   2HD2  LEU  33          3HD2      LEU  33  -6.512   4.004  -6.084
   84   3HD2  LEU  33          1HD2      LEU  33  -7.696   4.633  -7.232
   85    H    SER  34           H        SER  34  -4.351   6.071  -3.403
   86    HA   SER  34           HA       SER  34  -3.305   6.214  -0.806
   87   1HB   SER  34          1HB       SER  34  -3.339   8.343  -2.979
   88   2HB   SER  34          2HB       SER  34  -2.220   8.287  -1.605
   89    HG   SER  34           HG       SER  34  -1.421   7.352  -3.627
   90    H    SER  35           H        SER  35  -6.284   7.587  -1.819
   91    HA   SER  35           HA       SER  35  -6.426   9.381   0.572
   92   1HB   SER  35          1HB       SER  35  -8.114   9.416  -1.954
   93   2HB   SER  35          2HB       SER  35  -8.206  10.561  -0.602
   94    HG   SER  35           HG       SER  35  -6.936  11.375  -2.333
   95    H    GLN  36           H        GLN  36  -7.286   6.296  -0.231
   96    HA   GLN  36           HA       GLN  36  -9.890   6.319   1.235
   97   1HB   GLN  36          1HB       GLN  36  -9.486   5.096  -1.045
   98   2HB   GLN  36          2HB       GLN  36  -8.567   3.942  -0.086
   99   1HG   GLN  36          1HG       GLN  36 -10.688   2.965  -0.163
  100   2HG   GLN  36          2HG       GLN  36 -10.747   3.783   1.388
  101   1HE2  GLN  36          2HE2      GLN  36 -12.080   3.599  -1.870
  102   2HE2  GLN  36          1HE2      GLN  36 -13.278   4.868  -1.633
  103    H    CYS  37           H        CYS  37  -6.609   4.949   1.254
  104    HA   CYS  37           HA       CYS  37  -6.514   4.919   4.187
  105   1HB   CYS  37          1HB       CYS  37  -6.102   2.453   2.445
  106   2HB   CYS  37          2HB       CYS  37  -5.218   2.645   3.937
  107    H    ARG  38           H        ARG  38  -4.179   4.418   4.838
  108    HA   ARG  38           HA       ARG  38  -2.368   6.319   3.771
  109   1HB   ARG  38          1HB       ARG  38  -1.932   3.857   5.510
  110   2HB   ARG  38          2HB       ARG  38  -0.659   5.018   5.151
  111   1HG   ARG  38          1HG       ARG  38  -1.383   6.511   6.641
  112   2HG   ARG  38          2HG       ARG  38  -3.041   6.445   6.076
  113   1HD   ARG  38          1HD       ARG  38  -1.770   4.431   7.976
  114   2HD   ARG  38          2HD       ARG  38  -2.748   5.802   8.487
  115    HE   ARG  38           HE       ARG  38  -3.682   3.261   7.494
  116   1HH1  ARG  38          2HH1      ARG  38  -4.686   6.620   7.728
  117   2HH1  ARG  38          1HH1      ARG  38  -6.370   6.212   7.559
  118   1HH2  ARG  38          1HH2      ARG  38  -5.831   2.835   7.239
  119   2HH2  ARG  38          2HH2      ARG  38  -6.988   4.127   7.227
  120    H    ALA  39           H        ALA  39  -2.715   2.918   2.817
  121    HA   ALA  39           HA       ALA  39  -1.400   3.545   0.320
  122   1HB   ALA  39          2HB       ALA  39   0.599   3.048   1.722
  123   2HB   ALA  39          3HB       ALA  39  -0.128   1.490   2.190
  124   3HB   ALA  39          1HB       ALA  39   0.365   1.772   0.517
  125    HA   PRO  40           HA       PRO  40  -3.654  -0.301  -0.865
  126   1HB   PRO  40          2HB       PRO  40  -2.426  -0.897  -3.214
  127   2HB   PRO  40          1HB       PRO  40  -3.564   0.478  -3.065
  128   1HG   PRO  40          1HG       PRO  40  -0.530   0.538  -2.954
  129   2HG   PRO  40          2HG       PRO  40  -1.621   1.583  -3.920
  130   1HD   PRO  40          1HD       PRO  40  -0.586   2.339  -1.497
  131   2HD   PRO  40          2HD       PRO  40  -2.205   2.863  -2.042
  132    H    LYS  41           H        LYS  41  -2.960  -2.571  -1.348
  133    HA   LYS  41           HA       LYS  41  -1.346  -3.670   0.619
  134   1HB   LYS  41          1HB       LYS  41  -3.204  -4.696  -0.799
  135   2HB   LYS  41          2HB       LYS  41  -1.989  -5.003  -2.041
  136   1HG   LYS  41          1HG       LYS  41  -0.748  -6.462  -0.479
  137   2HG   LYS  41          2HG       LYS  41  -1.871  -6.041   0.831
  138   1HD   LYS  41          1HD       LYS  41  -3.737  -7.073  -0.443
  139   2HD   LYS  41          2HD       LYS  41  -2.610  -7.481  -1.759
  140   1HE   LYS  41          1HE       LYS  41  -1.270  -8.854  -0.166
  141   2HE   LYS  41          2HE       LYS  41  -2.405  -8.457   1.130
  142   1HZ   LYS  41          1HZ       LYS  41  -4.153  -9.585  -0.148
  143   2HZ   LYS  41          2HZ       LYS  41  -3.102  -9.952  -1.346
  144   3HZ   LYS  41          3HZ       LYS  41  -2.917 -10.611   0.134
  145    H    VAL  42           H        VAL  42  -0.136  -2.441  -2.342
  146    HA   VAL  42           HA       VAL  42   2.367  -3.718  -2.659
  147    HB   VAL  42           HB       VAL  42   1.685  -0.768  -3.010
  148   1HG1  VAL  42          1HG1      VAL  42   3.861  -2.470  -4.290
  149   2HG1  VAL  42          2HG1      VAL  42   3.444  -0.811  -4.771
  150   3HG1  VAL  42          3HG1      VAL  42   4.105  -1.110  -3.168
  151   1HG2  VAL  42          3HG2      VAL  42   1.447  -3.087  -4.979
  152   2HG2  VAL  42          1HG2      VAL  42   0.101  -2.139  -4.304
  153   3HG2  VAL  42          2HG2      VAL  42   1.254  -1.369  -5.388
  154    H    CYS  43           H        CYS  43   1.342  -1.390  -0.206
  155    HA   CYS  43           HA       CYS  43   3.919  -1.567   1.240
  156   1HB   CYS  43          1HB       CYS  43   3.990   0.249  -0.527
  157   2HB   CYS  43          2HB       CYS  43   2.676   1.065   0.331
  158    H    PHE  44           H        PHE  44   3.304   0.576   2.908
  159    HA   PHE  44           HA       PHE  44   0.612   0.214   4.099
  160   1HB   PHE  44          1HB       PHE  44   1.387  -0.067   6.303
  161   2HB   PHE  44          2HB       PHE  44   2.277  -1.236   5.346
  162    HD1  PHE  44           HD1      PHE  44   2.485   1.614   7.583
  163    HD2  PHE  44           HD2      PHE  44   4.726  -0.684   4.699
  164    HE1  PHE  44           HE1      PHE  44   4.599   2.592   8.444
  165    HE2  PHE  44           HE2      PHE  44   6.836   0.301   5.561
  166    HZ   PHE  44           HZ       PHE  44   6.777   1.942   7.429
  167    H    LYS  45           H        LYS  45   3.277   2.294   3.265
  168    HA   LYS  45           HA       LYS  45   1.765   4.704   4.050
  169   1HB   LYS  45          1HB       LYS  45   2.936   4.070   6.130
  170   2HB   LYS  45          2HB       LYS  45   4.469   3.990   5.277
  171   1HG   LYS  45          1HG       LYS  45   4.365   6.003   6.574
  172   2HG   LYS  45          2HG       LYS  45   4.377   6.441   4.867
  173   1HD   LYS  45          1HD       LYS  45   1.936   6.867   4.939
  174   2HD   LYS  45          2HD       LYS  45   1.884   6.319   6.633
  175   1HE   LYS  45          1HE       LYS  45   3.493   8.130   7.242
  176   2HE   LYS  45          2HE       LYS  45   3.492   8.689   5.565
  177   1HZ   LYS  45          3HZ       LYS  45   1.105   9.158   5.799
  178   2HZ   LYS  45          1HZ       LYS  45   1.115   8.643   7.353
  179   3HZ   LYS  45          2HZ       LYS  45   1.951   9.974   6.929
  180    H    CYS  46           H        CYS  46   5.137   3.809   3.075
  181    HA   CYS  46           HA       CYS  46   5.474   6.298   1.720
  182   1HB   CYS  46          1HB       CYS  46   7.725   5.162   1.124
  183   2HB   CYS  46          2HB       CYS  46   7.343   5.557   2.798
  184    H    LYS  47           H        LYS  47   4.709   3.101   0.488
  185    HA   LYS  47           HA       LYS  47   4.175   2.315  -1.601
  186   1HB   LYS  47          1HB       LYS  47   2.093   3.319  -2.327
  187   2HB   LYS  47          2HB       LYS  47   2.203   3.201  -0.576
  188   1HG   LYS  47          1HG       LYS  47   2.784   5.610  -0.437
  189   2HG   LYS  47          2HG       LYS  47   2.644   5.754  -2.192
  190   1HD   LYS  47          1HD       LYS  47   0.288   5.268  -2.116
  191   2HD   LYS  47          2HD       LYS  47   0.364   4.767  -0.420
  192   1HE   LYS  47          1HE       LYS  47   1.083   7.577  -1.340
  193   2HE   LYS  47          2HE       LYS  47  -0.562   7.107  -0.897
  194   1HZ   LYS  47          2HZ       LYS  47   1.750   6.832   0.959
  195   2HZ   LYS  47          3HZ       LYS  47   0.669   8.071   0.994
  196   3HZ   LYS  47          1HZ       LYS  47   0.193   6.532   1.304
  197    H    GLN  48           H        GLN  48   6.593   3.976  -2.024
  198    HA   GLN  48           HA       GLN  48   6.310   5.314  -4.541
  199   1HB   GLN  48          1HB       GLN  48   8.781   4.090  -3.250
  200   2HB   GLN  48          2HB       GLN  48   8.803   5.190  -4.623
  201   1HG   GLN  48          1HG       GLN  48   7.897   5.834  -1.789
  202   2HG   GLN  48          2HG       GLN  48   9.350   6.397  -2.595
  203   1HE2  GLN  48          2HE2      GLN  48   6.037   7.119  -1.986
  204   2HE2  GLN  48          1HE2      GLN  48   5.925   8.486  -3.099
  205    HA   PRO  49           HA       PRO  49   5.740   2.429  -7.606
  206   1HB   PRO  49          2HB       PRO  49   8.212   3.407  -9.051
  207   2HB   PRO  49          1HB       PRO  49   6.576   3.089  -9.712
  208   1HG   PRO  49          1HG       PRO  49   7.302   5.612  -9.099
  209   2HG   PRO  49          2HG       PRO  49   5.680   5.015  -8.614
  210   1HD   PRO  49          1HD       PRO  49   8.163   5.309  -6.926
  211   2HD   PRO  49          2HD       PRO  49   6.462   5.692  -6.538
  212    H    GLY  50           H        GLY  50   9.068   2.077  -6.437
  213   1HA   GLY  50          2HA       GLY  50  10.241   0.043  -7.675
  214   2HA   GLY  50          1HA       GLY  50   8.909  -0.859  -6.954
  215    H    HIS  51           H        HIS  51   9.431   1.323  -4.609
  216    HA   HIS  51           HA       HIS  51  11.924   0.524  -3.434
  217   1HB   HIS  51          1HB       HIS  51  11.305   1.873  -1.633
  218   2HB   HIS  51          2HB       HIS  51  10.523   2.646  -2.999
  219    HD1  HIS  51           HD1      HIS  51   7.675   1.662  -3.170
  220    HD2  HIS  51           HD2      HIS  51   9.875   1.325   0.412
  221    HE1  HIS  51           HE1      HIS  51   6.021   1.020  -1.360
  222    H    PHE  52           H        PHE  52   8.708  -0.879  -3.260
  223    HA   PHE  52           HA       PHE  52   8.773  -1.889  -0.670
  224   1HB   PHE  52          1HB       PHE  52   6.874  -3.329  -1.392
  225   2HB   PHE  52          2HB       PHE  52   6.708  -1.628  -1.762
  226    HD1  PHE  52           HD1      PHE  52   6.736  -0.792  -4.088
  227    HD2  PHE  52           HD2      PHE  52   7.097  -5.003  -3.204
  228    HE1  PHE  52           HE1      PHE  52   6.266  -1.336  -6.458
  229    HE2  PHE  52           HE2      PHE  52   6.628  -5.536  -5.580
  230    HZ   PHE  52           HZ       PHE  52   6.215  -3.703  -7.213
  231    H    SER  53           H        SER  53   9.694  -3.678  -3.649
  232    HA   SER  53           HA       SER  53  10.352  -6.149  -2.496
  233   1HB   SER  53          1HB       SER  53  11.732  -4.759  -4.823
  234   2HB   SER  53          2HB       SER  53  11.720  -6.501  -4.493
  235    HG   SER  53           HG       SER  53  10.137  -5.900  -6.047
  236    H    LYS  54           H        LYS  54  11.886  -3.259  -1.729
  237    HA   LYS  54           HA       LYS  54  14.388  -4.584  -0.757
  238   1HB   LYS  54          1HB       LYS  54  14.042  -1.814  -1.980
  239   2HB   LYS  54          2HB       LYS  54  15.547  -2.453  -1.319
  240   1HG   LYS  54          1HG       LYS  54  15.633  -4.205  -3.017
  241   2HG   LYS  54          2HG       LYS  54  14.094  -3.682  -3.709
  242   1HD   LYS  54          1HD       LYS  54  16.590  -1.945  -3.592
  243   2HD   LYS  54          2HD       LYS  54  16.083  -2.915  -4.984
  244   1HE   LYS  54          1HE       LYS  54  13.913  -1.664  -5.051
  245   2HE   LYS  54          2HE       LYS  54  14.481  -0.644  -3.722
  246   1HZ   LYS  54          3HZ       LYS  54  15.785  -0.851  -6.385
  247   2HZ   LYS  54          1HZ       LYS  54  14.879   0.406  -5.875
  248   3HZ   LYS  54          2HZ       LYS  54  16.311   0.091  -5.159
  249    H    GLN  55           H        GLN  55  11.591  -3.381   0.399
  250    HA   GLN  55           HA       GLN  55  12.816  -2.609   2.961
  251   1HB   GLN  55          1HB       GLN  55  12.727  -0.482   1.585
  252   2HB   GLN  55          2HB       GLN  55  10.969  -0.643   1.543
  253   1HG   GLN  55          1HG       GLN  55  11.015  -0.615   4.104
  254   2HG   GLN  55          2HG       GLN  55  12.742  -0.266   4.001
  255   1HE2  GLN  55          1HE2      GLN  55   9.486   0.968   3.440
  256   2HE2  GLN  55          2HE2      GLN  55   9.955   2.649   3.216
  257    H    CYS  56           H        CYS  56   9.651  -2.607   1.240
  258    HA   CYS  56           HA       CYS  56   8.269  -3.265   3.776
  259   1HB   CYS  56          1HB       CYS  56   7.244  -2.107   1.152
  260   2HB   CYS  56          2HB       CYS  56   6.308  -2.320   2.636
  261    H    ARG  57           H        ARG  57   9.293  -4.933   1.091
  262    HA   ARG  57           HA       ARG  57   7.570  -7.265   1.613
  263   1HB   ARG  57          1HB       ARG  57   6.723  -5.544  -0.290
  264   2HB   ARG  57          2HB       ARG  57   7.938  -6.343  -1.261
  265   1HG   ARG  57          1HG       ARG  57   5.660  -7.258  -1.564
  266   2HG   ARG  57          2HG       ARG  57   6.782  -8.494  -1.006
  267   1HD   ARG  57          1HD       ARG  57   4.512  -8.569   0.089
  268   2HD   ARG  57          2HD       ARG  57   5.860  -8.487   1.206
  269    HE   ARG  57           HE       ARG  57   5.323  -6.254   1.791
  270   1HH1  ARG  57          2HH2      ARG  57   3.038  -7.341  -0.664
  271   2HH1  ARG  57          1HH2      ARG  57   1.993  -5.961  -0.348
  272   1HH2  ARG  57          1HH1      ARG  57   3.894  -4.603   2.098
  273   2HH2  ARG  57          2HH1      ARG  57   2.442  -4.520   1.108
  274    H    SER  58           H        SER  58  10.476  -6.460   1.839
  275    HA   SER  58           HA       SER  58  12.241  -7.687   0.086
  276   1HB   SER  58          1HB       SER  58  12.473  -7.591   3.114
  277   2HB   SER  58          2HB       SER  58  13.800  -7.769   1.952
  278    HG   SER  58           HG       SER  58  13.513  -5.575   2.637

  No H/Q in entry =         278
  Start of MODEL   25
    1    H1   GLN  22           H2       GLN  22  -7.824  -0.239  -7.233
    2    H2   GLN  22           H1       GLN  22  -7.090   0.904  -6.313
    3    H3   GLN  22           H3       GLN  22  -6.502   0.554  -7.805
    4    HA   GLN  22           HA       GLN  22  -5.921  -1.679  -7.100
    5   1HB   GLN  22          1HB       GLN  22  -4.731   0.574  -5.404
    6   2HB   GLN  22          2HB       GLN  22  -4.118  -1.065  -5.428
    7   1HG   GLN  22          1HG       GLN  22  -2.691  -0.020  -6.852
    8   2HG   GLN  22          2HG       GLN  22  -3.792  -0.835  -7.949
    9   1HE2  GLN  22          1HE2      GLN  22  -2.206   2.110  -7.395
   10   2HE2  GLN  22          2HE2      GLN  22  -3.289   3.123  -8.341
   11    H    THR  23           H        THR  23  -5.083  -2.373  -4.490
   12    HA   THR  23           HA       THR  23  -7.686  -2.857  -3.084
   13    HB   THR  23           HB       THR  23  -5.366  -4.768  -3.562
   14    HG1  THR  23           HG1      THR  23  -6.823  -5.803  -4.910
   15   1HG2  THR  23          2HG2      THR  23  -8.092  -5.306  -2.301
   16   2HG2  THR  23          3HG2      THR  23  -6.856  -6.520  -2.683
   17   3HG2  THR  23          1HG2      THR  23  -6.533  -5.310  -1.440
   18    H    CYS  24           H        CYS  24  -7.636  -2.834  -0.846
   19    HA   CYS  24           HA       CYS  24  -5.806  -1.068   0.340
   20   1HB   CYS  24          1HB       CYS  24  -8.235  -1.642   0.949
   21   2HB   CYS  24          2HB       CYS  24  -7.580  -3.028   1.834
   22    H    TYR  25           H        TYR  25  -4.248  -1.224   1.896
   23    HA   TYR  25           HA       TYR  25  -2.675  -3.641   2.258
   24   1HB   TYR  25          1HB       TYR  25  -1.220  -2.352   3.461
   25   2HB   TYR  25          2HB       TYR  25  -1.866  -1.180   2.333
   26    HD1  TYR  25           HD1      TYR  25  -0.858  -1.610   5.611
   27    HD2  TYR  25           HD2      TYR  25  -4.196   0.023   3.413
   28    HE1  TYR  25           HE1      TYR  25  -1.456  -0.191   7.563
   29    HE2  TYR  25           HE2      TYR  25  -4.822   1.382   5.386
   30    HH   TYR  25           HH       TYR  25  -2.963   1.313   8.434
   31    H    ASN  26           H        ASN  26  -5.531  -2.461   3.804
   32    HA   ASN  26           HA       ASN  26  -5.137  -4.288   6.158
   33   1HB   ASN  26          1HB       ASN  26  -4.410  -2.018   6.721
   34   2HB   ASN  26          2HB       ASN  26  -5.929  -1.341   6.131
   35   1HD2  ASN  26          1HD2      ASN  26  -7.653  -1.210   7.580
   36   2HD2  ASN  26          2HD2      ASN  26  -7.596  -1.918   9.187
   37    H    CYS  27           H        CYS  27  -7.588  -2.356   4.331
   38    HA   CYS  27           HA       CYS  27  -9.816  -3.374   5.771
   39   1HB   CYS  27          1HB       CYS  27  -9.665  -2.084   3.013
   40   2HB   CYS  27          2HB       CYS  27 -11.126  -2.279   3.985
   41    H    GLY  28           H        GLY  28  -7.992  -4.921   3.278
   42   1HA   GLY  28          2HA       GLY  28  -9.638  -7.262   3.090
   43   2HA   GLY  28          1HA       GLY  28  -8.314  -6.820   2.003
   44    H    LYS  29           H        LYS  29  -9.391  -4.366   1.044
   45    HA   LYS  29           HA       LYS  29 -11.889  -5.125  -0.413
   46   1HB   LYS  29          1HB       LYS  29 -11.113  -2.656   1.159
   47   2HB   LYS  29          2HB       LYS  29 -12.236  -2.485  -0.166
   48   1HG   LYS  29          1HG       LYS  29 -12.676  -4.412   2.148
   49   2HG   LYS  29          2HG       LYS  29 -13.253  -2.750   2.134
   50   1HD   LYS  29          1HD       LYS  29 -14.088  -4.921   0.160
   51   2HD   LYS  29          2HD       LYS  29 -15.024  -4.332   1.536
   52   1HE   LYS  29          1HE       LYS  29 -15.020  -2.031   0.529
   53   2HE   LYS  29          2HE       LYS  29 -14.190  -2.675  -0.892
   54   1HZ   LYS  29          2HZ       LYS  29 -16.119  -4.145  -1.254
   55   2HZ   LYS  29          3HZ       LYS  29 -16.882  -3.513   0.046
   56   3HZ   LYS  29          1HZ       LYS  29 -16.578  -2.580  -1.254
   57    HA   PRO  30           HA       PRO  30  -9.778  -3.260  -4.032
   58   1HB   PRO  30          2HB       PRO  30 -11.818  -3.357  -5.809
   59   2HB   PRO  30          1HB       PRO  30 -11.009  -4.843  -5.244
   60   1HG   PRO  30          1HG       PRO  30 -13.589  -3.628  -4.200
   61   2HG   PRO  30          2HG       PRO  30 -13.300  -5.319  -4.729
   62   1HD   PRO  30          1HD       PRO  30 -13.158  -4.525  -2.109
   63   2HD   PRO  30          2HD       PRO  30 -12.125  -5.828  -2.765
   64    H    GLY  31           H        GLY  31 -10.916  -1.405  -5.658
   65   1HA   GLY  31          2HA       GLY  31 -12.666   0.524  -4.482
   66   2HA   GLY  31          1HA       GLY  31 -11.562   0.805  -5.836
   67    H    HIS  32           H        HIS  32  -9.173   0.107  -4.255
   68    HA   HIS  32           HA       HIS  32  -9.051   2.312  -2.251
   69   1HB   HIS  32          1HB       HIS  32  -8.159  -0.537  -2.252
   70   2HB   HIS  32          2HB       HIS  32  -7.058   0.623  -1.520
   71    HD1  HIS  32           HD1      HIS  32 -10.757  -0.490  -1.089
   72    HD2  HIS  32           HD2      HIS  32  -7.595   1.493   0.845
   73    HE1  HIS  32           HE1      HIS  32 -11.514  -0.098   1.331
   74    H    LEU  33           H        LEU  33  -7.285   3.484  -1.981
   75    HA   LEU  33           HA       LEU  33  -5.061   3.684  -3.877
   76   1HB   LEU  33          1HB       LEU  33  -7.356   5.703  -3.657
   77   2HB   LEU  33          2HB       LEU  33  -5.805   6.097  -4.383
   78    HG   LEU  33           HG       LEU  33  -7.761   4.044  -5.485
   79   1HD1  LEU  33          3HD1      LEU  33  -8.566   6.354  -5.665
   80   2HD1  LEU  33          1HD1      LEU  33  -7.034   6.843  -6.422
   81   3HD1  LEU  33          2HD1      LEU  33  -8.120   5.703  -7.252
   82   1HD2  LEU  33          2HD2      LEU  33  -5.155   5.161  -6.623
   83   2HD2  LEU  33          3HD2      LEU  33  -5.421   3.486  -6.087
   84   3HD2  LEU  33          1HD2      LEU  33  -6.298   4.110  -7.488
   85    H    SER  34           H        SER  34  -3.827   5.773  -3.251
   86    HA   SER  34           HA       SER  34  -3.270   6.094  -0.467
   87   1HB   SER  34          1HB       SER  34  -2.102   8.159  -1.257
   88   2HB   SER  34          2HB       SER  34  -1.672   6.694  -2.164
   89    HG   SER  34           HG       SER  34  -2.104   8.496  -3.544
   90    H    SER  35           H        SER  35  -5.870   7.400  -2.389
   91    HA   SER  35           HA       SER  35  -6.607   9.479  -0.429
   92   1HB   SER  35          1HB       SER  35  -8.409   9.947  -2.069
   93   2HB   SER  35          2HB       SER  35  -6.788  10.013  -2.777
   94    HG   SER  35           HG       SER  35  -8.291   8.830  -4.075
   95    H    GLN  36           H        GLN  36  -7.050   6.173  -0.523
   96    HA   GLN  36           HA       GLN  36  -9.752   6.272   0.776
   97   1HB   GLN  36          1HB       GLN  36  -9.369   4.978  -1.446
   98   2HB   GLN  36          2HB       GLN  36  -8.423   3.855  -0.470
   99   1HG   GLN  36          1HG       GLN  36 -10.550   2.877  -0.579
  100   2HG   GLN  36          2HG       GLN  36 -10.539   3.616   1.015
  101   1HE2  GLN  36          2HE2      GLN  36 -11.969   3.639  -2.211
  102   2HE2  GLN  36          1HE2      GLN  36 -13.196   4.852  -1.843
  103    H    CYS  37           H        CYS  37  -6.475   4.892   0.967
  104    HA   CYS  37           HA       CYS  37  -6.598   4.816   3.910
  105   1HB   CYS  37          1HB       CYS  37  -6.175   2.426   2.100
  106   2HB   CYS  37          2HB       CYS  37  -5.225   2.531   3.561
  107    H    ARG  38           H        ARG  38  -4.348   4.351   4.765
  108    HA   ARG  38           HA       ARG  38  -2.458   6.270   3.923
  109   1HB   ARG  38          1HB       ARG  38  -2.108   3.736   5.586
  110   2HB   ARG  38          2HB       ARG  38  -0.862   4.960   5.382
  111   1HG   ARG  38          1HG       ARG  38  -1.688   6.157   7.045
  112   2HG   ARG  38          2HG       ARG  38  -3.183   6.422   6.166
  113   1HD   ARG  38          1HD       ARG  38  -2.608   4.024   7.960
  114   2HD   ARG  38          2HD       ARG  38  -3.447   5.470   8.490
  115    HE   ARG  38           HE       ARG  38  -4.544   3.260   7.001
  116   1HH1  ARG  38          2HH2      ARG  38  -5.075   6.633   7.782
  117   2HH1  ARG  38          1HH2      ARG  38  -6.761   6.567   7.354
  118   1HH2  ARG  38          2HH1      ARG  38  -6.697   3.332   6.221
  119   2HH2  ARG  38          1HH1      ARG  38  -7.637   4.745   6.546
  120    H    ALA  39           H        ALA  39  -2.713   2.915   2.848
  121    HA   ALA  39           HA       ALA  39  -1.361   3.646   0.409
  122   1HB   ALA  39          2HB       ALA  39   0.628   3.079   1.807
  123   2HB   ALA  39          3HB       ALA  39  -0.108   1.503   2.194
  124   3HB   ALA  39          1HB       ALA  39   0.394   1.867   0.537
  125    HA   PRO  40           HA       PRO  40  -3.667  -0.159  -0.858
  126   1HB   PRO  40          2HB       PRO  40  -2.507  -0.695  -3.253
  127   2HB   PRO  40          1HB       PRO  40  -3.624   0.685  -3.034
  128   1HG   PRO  40          1HG       PRO  40  -0.589   0.723  -2.999
  129   2HG   PRO  40          2HG       PRO  40  -1.697   1.800  -3.908
  130   1HD   PRO  40          1HD       PRO  40  -0.596   2.477  -1.482
  131   2HD   PRO  40          2HD       PRO  40  -2.218   3.039  -1.983
  132    H    LYS  41           H        LYS  41  -2.986  -2.423  -1.356
  133    HA   LYS  41           HA       LYS  41  -1.351  -3.499   0.602
  134   1HB   LYS  41          1HB       LYS  41  -3.238  -4.527  -0.807
  135   2HB   LYS  41          2HB       LYS  41  -2.015  -4.902  -2.016
  136   1HG   LYS  41          1HG       LYS  41  -0.826  -6.334  -0.403
  137   2HG   LYS  41          2HG       LYS  41  -1.929  -5.823   0.894
  138   1HD   LYS  41          1HD       LYS  41  -3.831  -6.879  -0.297
  139   2HD   LYS  41          2HD       LYS  41  -2.766  -7.298  -1.642
  140   1HE   LYS  41          1HE       LYS  41  -3.064  -9.276  -0.344
  141   2HE   LYS  41          2HE       LYS  41  -1.402  -8.728  -0.117
  142   1HZ   LYS  41          1HZ       LYS  41  -3.629  -8.263   1.804
  143   2HZ   LYS  41          2HZ       LYS  41  -2.458  -9.380   1.983
  144   3HZ   LYS  41          3HZ       LYS  41  -2.076  -7.797   2.037
  145    H    VAL  42           H        VAL  42  -0.152  -2.304  -2.362
  146    HA   VAL  42           HA       VAL  42   2.347  -3.599  -2.693
  147    HB   VAL  42           HB       VAL  42   1.666  -0.646  -3.021
  148   1HG1  VAL  42          1HG1      VAL  42   3.854  -2.334  -4.300
  149   2HG1  VAL  42          2HG1      VAL  42   3.438  -0.671  -4.769
  150   3HG1  VAL  42          3HG1      VAL  42   4.088  -0.985  -3.163
  151   1HG2  VAL  42          2HG2      VAL  42   1.447  -2.947  -5.011
  152   2HG2  VAL  42          3HG2      VAL  42   0.094  -2.008  -4.338
  153   3HG2  VAL  42          1HG2      VAL  42   1.252  -1.227  -5.407
  154    H    CYS  43           H        CYS  43   1.311  -1.278  -0.241
  155    HA   CYS  43           HA       CYS  43   3.831  -1.547   1.275
  156   1HB   CYS  43          1HB       CYS  43   4.006   0.321  -0.439
  157   2HB   CYS  43          2HB       CYS  43   2.696   1.148   0.413
  158    H    PHE  44           H        PHE  44   3.271   0.481   3.025
  159    HA   PHE  44           HA       PHE  44   0.517   0.249   4.113
  160   1HB   PHE  44          1HB       PHE  44   1.248  -0.185   6.335
  161   2HB   PHE  44          2HB       PHE  44   1.977  -1.405   5.311
  162    HD1  PHE  44           HD1      PHE  44   2.574   1.273   7.687
  163    HD2  PHE  44           HD2      PHE  44   4.467  -1.144   4.654
  164    HE1  PHE  44           HE1      PHE  44   4.805   1.903   8.574
  165    HE2  PHE  44           HE2      PHE  44   6.694  -0.498   5.536
  166    HZ   PHE  44           HZ       PHE  44   6.869   1.023   7.494
  167    H    LYS  45           H        LYS  45   3.256   2.175   3.353
  168    HA   LYS  45           HA       LYS  45   2.096   4.648   4.502
  169   1HB   LYS  45          1HB       LYS  45   3.313   3.656   6.387
  170   2HB   LYS  45          2HB       LYS  45   4.748   3.431   5.390
  171   1HG   LYS  45          1HG       LYS  45   4.936   5.945   5.187
  172   2HG   LYS  45          2HG       LYS  45   3.512   6.095   6.224
  173   1HD   LYS  45          1HD       LYS  45   5.504   6.441   7.544
  174   2HD   LYS  45          2HD       LYS  45   4.755   4.919   8.050
  175   1HE   LYS  45          1HE       LYS  45   6.391   3.646   6.690
  176   2HE   LYS  45          2HE       LYS  45   7.089   5.154   6.088
  177   1HZ   LYS  45          1HZ       LYS  45   7.103   4.295   8.936
  178   2HZ   LYS  45          2HZ       LYS  45   8.386   4.244   7.929
  179   3HZ   LYS  45          3HZ       LYS  45   7.757   5.680   8.370
  180    H    CYS  46           H        CYS  46   5.276   3.515   3.268
  181    HA   CYS  46           HA       CYS  46   5.888   6.008   2.108
  182   1HB   CYS  46          1HB       CYS  46   7.715   4.150   1.074
  183   2HB   CYS  46          2HB       CYS  46   7.878   5.156   2.499
  184    H    LYS  47           H        LYS  47   4.698   3.054   0.609
  185    HA   LYS  47           HA       LYS  47   4.032   2.503  -1.512
  186   1HB   LYS  47          1HB       LYS  47   2.031   3.757  -2.107
  187   2HB   LYS  47          2HB       LYS  47   2.154   3.441  -0.382
  188   1HG   LYS  47          1HG       LYS  47   2.921   5.750   0.019
  189   2HG   LYS  47          2HG       LYS  47   2.831   6.107  -1.707
  190   1HD   LYS  47          1HD       LYS  47   0.457   5.894  -1.717
  191   2HD   LYS  47          2HD       LYS  47   0.417   5.138  -0.116
  192   1HE   LYS  47          1HE       LYS  47   1.465   7.963  -0.574
  193   2HE   LYS  47          2HE       LYS  47  -0.237   7.625  -0.239
  194   1HZ   LYS  47          3HZ       LYS  47   1.981   6.848   1.590
  195   2HZ   LYS  47          1HZ       LYS  47   0.986   8.135   1.803
  196   3HZ   LYS  47          2HZ       LYS  47   0.393   6.606   1.850
  197    H    GLN  48           H        GLN  48   6.565   4.086  -1.833
  198    HA   GLN  48           HA       GLN  48   6.306   5.547  -4.294
  199   1HB   GLN  48          1HB       GLN  48   8.759   4.210  -3.086
  200   2HB   GLN  48          2HB       GLN  48   8.784   5.382  -4.396
  201   1HG   GLN  48          1HG       GLN  48   7.956   5.880  -1.511
  202   2HG   GLN  48          2HG       GLN  48   9.388   6.474  -2.326
  203   1HE2  GLN  48          2HE2      GLN  48   6.123   7.209  -1.556
  204   2HE2  GLN  48          1HE2      GLN  48   5.988   8.634  -2.595
  205    HA   PRO  49           HA       PRO  49   5.657   2.749  -7.438
  206   1HB   PRO  49          2HB       PRO  49   8.134   3.733  -8.871
  207   2HB   PRO  49          1HB       PRO  49   6.489   3.461  -9.530
  208   1HG   PRO  49          1HG       PRO  49   7.256   5.954  -8.849
  209   2HG   PRO  49          2HG       PRO  49   5.630   5.367  -8.369
  210   1HD   PRO  49          1HD       PRO  49   8.131   5.569  -6.692
  211   2HD   PRO  49          2HD       PRO  49   6.439   5.973  -6.282
  212    H    GLY  50           H        GLY  50   8.964   2.307  -6.266
  213   1HA   GLY  50          2HA       GLY  50  10.137   0.312  -7.550
  214   2HA   GLY  50          1HA       GLY  50   8.771  -0.604  -6.915
  215    H    HIS  51           H        HIS  51   9.463   1.598  -4.515
  216    HA   HIS  51           HA       HIS  51  11.870   0.668  -3.361
  217   1HB   HIS  51          1HB       HIS  51  11.287   1.951  -1.496
  218   2HB   HIS  51          2HB       HIS  51  10.526   2.790  -2.833
  219    HD1  HIS  51           HD1      HIS  51   7.651   1.783  -3.037
  220    HD2  HIS  51           HD2      HIS  51   9.838   1.553   0.563
  221    HE1  HIS  51           HE1      HIS  51   5.981   1.248  -1.209
  222    H    PHE  52           H        PHE  52   8.642  -0.695  -3.142
  223    HA   PHE  52           HA       PHE  52   8.778  -1.945  -0.656
  224   1HB   PHE  52          1HB       PHE  52   6.871  -3.305  -1.458
  225   2HB   PHE  52          2HB       PHE  52   6.694  -1.584  -1.731
  226    HD1  PHE  52           HD1      PHE  52   6.706  -0.625  -4.014
  227    HD2  PHE  52           HD2      PHE  52   7.086  -4.876  -3.357
  228    HE1  PHE  52           HE1      PHE  52   6.224  -1.046  -6.406
  229    HE2  PHE  52           HE2      PHE  52   6.607  -5.284  -5.755
  230    HZ   PHE  52           HZ       PHE  52   6.180  -3.369  -7.286
  231    H    SER  53           H        SER  53   9.722  -3.357  -3.819
  232    HA   SER  53           HA       SER  53  10.374  -5.952  -2.983
  233   1HB   SER  53          1HB       SER  53  11.767  -4.263  -5.097
  234   2HB   SER  53          2HB       SER  53  11.797  -6.035  -4.980
  235    HG   SER  53           HG       SER  53  10.217  -5.290  -6.474
  236    H    LYS  54           H        LYS  54  11.964  -3.123  -1.952
  237    HA   LYS  54           HA       LYS  54  14.372  -4.630  -1.005
  238   1HB   LYS  54          1HB       LYS  54  14.240  -1.726  -1.925
  239   2HB   LYS  54          2HB       LYS  54  15.680  -2.574  -1.376
  240   1HG   LYS  54          1HG       LYS  54  14.125  -3.209  -3.921
  241   2HG   LYS  54          2HG       LYS  54  15.612  -2.275  -3.819
  242   1HD   LYS  54          1HD       LYS  54  16.860  -4.217  -3.004
  243   2HD   LYS  54          2HD       LYS  54  15.383  -5.199  -2.980
  244   1HE   LYS  54          1HE       LYS  54  15.107  -4.830  -5.430
  245   2HE   LYS  54          2HE       LYS  54  16.615  -3.907  -5.451
  246   1HZ   LYS  54          3HZ       LYS  54  16.382  -6.770  -4.678
  247   2HZ   LYS  54          1HZ       LYS  54  16.976  -6.223  -6.096
  248   3HZ   LYS  54          2HZ       LYS  54  17.778  -5.919  -4.708
  249    H    GLN  55           H        GLN  55  11.606  -3.464   0.187
  250    HA   GLN  55           HA       GLN  55  12.810  -2.947   2.821
  251   1HB   GLN  55          1HB       GLN  55  12.764  -0.703   1.667
  252   2HB   GLN  55          2HB       GLN  55  11.009  -0.832   1.560
  253   1HG   GLN  55          1HG       GLN  55  10.971  -1.046   4.107
  254   2HG   GLN  55          2HG       GLN  55  12.709  -0.736   4.096
  255   1HE2  GLN  55          1HE2      GLN  55   9.505   0.639   3.499
  256   2HE2  GLN  55          2HE2      GLN  55  10.023   2.317   3.500
  257    H    CYS  56           H        CYS  56   9.618  -2.553   1.192
  258    HA   CYS  56           HA       CYS  56   8.259  -3.488   3.608
  259   1HB   CYS  56          1HB       CYS  56   7.184  -2.278   1.027
  260   2HB   CYS  56          2HB       CYS  56   6.289  -2.516   2.531
  261    H    ARG  57           H        ARG  57   9.272  -5.026   0.818
  262    HA   ARG  57           HA       ARG  57   7.558  -7.392   1.234
  263   1HB   ARG  57          1HB       ARG  57   6.690  -5.546  -0.543
  264   2HB   ARG  57          2HB       ARG  57   7.877  -6.299  -1.581
  265   1HG   ARG  57          1HG       ARG  57   5.585  -7.170  -1.898
  266   2HG   ARG  57          2HG       ARG  57   6.695  -8.450  -1.428
  267   1HD   ARG  57          1HD       ARG  57   4.440  -8.552  -0.307
  268   2HD   ARG  57          2HD       ARG  57   5.801  -8.554   0.794
  269    HE   ARG  57           HE       ARG  57   5.306  -6.355   1.514
  270   1HH1  ARG  57          2HH1      ARG  57   2.964  -7.256  -0.965
  271   2HH1  ARG  57          1HH1      ARG  57   1.944  -5.885  -0.543
  272   1HH2  ARG  57          1HH2      ARG  57   3.907  -4.707   1.943
  273   2HH2  ARG  57          2HH2      ARG  57   2.441  -4.544   0.983
  274    H    SER  58           H        SER  58  10.482  -6.615   1.442
  275    HA   SER  58           HA       SER  58  12.194  -7.735  -0.422
  276   1HB   SER  58          1HB       SER  58  12.484  -7.862   2.598
  277   2HB   SER  58          2HB       SER  58  13.789  -7.983   1.402
  278    HG   SER  58           HG       SER  58  13.548  -5.837   2.250

  No H/Q in entry =         278
  Start of MODEL   26
    1    H1   GLN  22           H3       GLN  22  -8.378  -0.643  -6.186
    2    H2   GLN  22           H2       GLN  22  -7.361   0.573  -5.789
    3    H3   GLN  22           H1       GLN  22  -7.388  -0.001  -7.333
    4    HA   GLN  22           HA       GLN  22  -6.575  -2.150  -6.595
    5   1HB   GLN  22          1HB       GLN  22  -4.966  -0.373  -7.337
    6   2HB   GLN  22          2HB       GLN  22  -4.778   0.127  -5.651
    7   1HG   GLN  22          1HG       GLN  22  -3.882  -2.139  -5.090
    8   2HG   GLN  22          2HG       GLN  22  -4.167  -2.654  -6.755
    9   1HE2  GLN  22          1HE2      GLN  22  -1.971  -3.079  -7.304
   10   2HE2  GLN  22          2HE2      GLN  22  -0.772  -1.793  -7.340
   11    H    THR  23           H        THR  23  -6.546  -3.615  -4.950
   12    HA   THR  23           HA       THR  23  -7.923  -3.265  -2.633
   13    HB   THR  23           HB       THR  23  -5.638  -5.238  -2.936
   14    HG1  THR  23           HG1      THR  23  -7.152  -6.487  -4.038
   15   1HG2  THR  23          3HG2      THR  23  -8.362  -5.460  -1.571
   16   2HG2  THR  23          1HG2      THR  23  -7.172  -6.766  -1.726
   17   3HG2  THR  23          2HG2      THR  23  -6.791  -5.357  -0.735
   18    H    CYS  24           H        CYS  24  -7.655  -2.735  -0.565
   19    HA   CYS  24           HA       CYS  24  -5.682  -0.999   0.357
   20   1HB   CYS  24          1HB       CYS  24  -8.051  -1.482   1.193
   21   2HB   CYS  24          2HB       CYS  24  -7.380  -2.879   2.034
   22    H    TYR  25           H        TYR  25  -4.020  -1.163   1.901
   23    HA   TYR  25           HA       TYR  25  -2.471  -3.612   2.143
   24   1HB   TYR  25          1HB       TYR  25  -0.961  -2.400   3.338
   25   2HB   TYR  25          2HB       TYR  25  -1.623  -1.167   2.286
   26    HD1  TYR  25           HD1      TYR  25  -0.486  -1.743   5.494
   27    HD2  TYR  25           HD2      TYR  25  -3.896   0.010   3.511
   28    HE1  TYR  25           HE1      TYR  25  -0.958  -0.366   7.510
   29    HE2  TYR  25           HE2      TYR  25  -4.394   1.321   5.547
   30    HH   TYR  25           HH       TYR  25  -2.362   1.167   8.483
   31    H    ASN  26           H        ASN  26  -5.269  -2.489   3.755
   32    HA   ASN  26           HA       ASN  26  -4.860  -4.330   6.098
   33   1HB   ASN  26          1HB       ASN  26  -4.340  -2.045   6.731
   34   2HB   ASN  26          2HB       ASN  26  -5.799  -1.429   5.962
   35   1HD2  ASN  26          2HD2      ASN  26  -7.829  -1.610   7.060
   36   2HD2  ASN  26          1HD2      ASN  26  -7.878  -2.135   8.737
   37    H    CYS  27           H        CYS  27  -7.339  -2.481   4.262
   38    HA   CYS  27           HA       CYS  27  -9.498  -3.720   5.659
   39   1HB   CYS  27          1HB       CYS  27  -9.510  -1.945   3.187
   40   2HB   CYS  27          2HB       CYS  27 -10.861  -2.234   4.288
   41    H    GLY  28           H        GLY  28  -7.790  -4.952   2.998
   42   1HA   GLY  28          2HA       GLY  28  -9.411  -7.209   2.576
   43   2HA   GLY  28          1HA       GLY  28  -8.160  -6.629   1.471
   44    H    LYS  29           H        LYS  29  -9.501  -4.112   0.871
   45    HA   LYS  29           HA       LYS  29 -11.994  -4.950  -0.555
   46   1HB   LYS  29          1HB       LYS  29 -12.309  -3.644   1.528
   47   2HB   LYS  29          2HB       LYS  29 -11.337  -2.356   0.867
   48   1HG   LYS  29          1HG       LYS  29 -13.635  -1.733   0.643
   49   2HG   LYS  29          2HG       LYS  29 -13.009  -2.034  -0.971
   50   1HD   LYS  29          1HD       LYS  29 -15.264  -2.924  -0.738
   51   2HD   LYS  29          2HD       LYS  29 -14.136  -4.255  -0.999
   52   1HE   LYS  29          1HE       LYS  29 -14.132  -4.742   1.439
   53   2HE   LYS  29          2HE       LYS  29 -15.203  -3.364   1.722
   54   1HZ   LYS  29          3HZ       LYS  29 -15.907  -5.764   0.113
   55   2HZ   LYS  29          1HZ       LYS  29 -16.443  -5.447   1.620
   56   3HZ   LYS  29          2HZ       LYS  29 -16.898  -4.490   0.381
   57    HA   PRO  30           HA       PRO  30  -9.452  -3.861  -4.139
   58   1HB   PRO  30          2HB       PRO  30 -12.188  -3.925  -5.420
   59   2HB   PRO  30          1HB       PRO  30 -10.632  -4.555  -6.050
   60   1HG   PRO  30          1HG       PRO  30 -12.384  -6.243  -4.885
   61   2HG   PRO  30          2HG       PRO  30 -10.641  -6.353  -4.469
   62   1HD   PRO  30          1HD       PRO  30 -12.875  -5.060  -2.903
   63   2HD   PRO  30          2HD       PRO  30 -11.514  -6.073  -2.328
   64    H    GLY  31           H        GLY  31 -12.358  -1.953  -3.386
   65   1HA   GLY  31          2HA       GLY  31 -13.019   0.191  -3.884
   66   2HA   GLY  31          1HA       GLY  31 -11.859   0.204  -5.211
   67    H    HIS  32           H        HIS  32  -9.561  -0.287  -3.319
   68    HA   HIS  32           HA       HIS  32  -9.457   2.266  -1.815
   69   1HB   HIS  32          1HB       HIS  32  -8.031  -0.355  -1.609
   70   2HB   HIS  32          2HB       HIS  32  -7.171   1.092  -1.100
   71    HD1  HIS  32           HD1      HIS  32 -10.575  -0.600  -0.353
   72    HD2  HIS  32           HD2      HIS  32  -7.634   1.884   1.310
   73    HE1  HIS  32           HE1      HIS  32 -11.288  -0.167   2.077
   74    H    LEU  33           H        LEU  33  -7.440   3.386  -1.745
   75    HA   LEU  33           HA       LEU  33  -5.957   3.830  -4.240
   76   1HB   LEU  33          1HB       LEU  33  -7.966   5.807  -3.030
   77   2HB   LEU  33          2HB       LEU  33  -6.755   6.265  -4.212
   78    HG   LEU  33           HG       LEU  33  -9.029   4.316  -4.752
   79   1HD1  LEU  33          2HD1      LEU  33  -9.805   6.616  -4.388
   80   2HD1  LEU  33          3HD1      LEU  33  -8.628   7.217  -5.577
   81   3HD1  LEU  33          1HD1      LEU  33  -9.958   6.151  -6.089
   82   1HD2  LEU  33          2HD2      LEU  33  -6.979   5.605  -6.619
   83   2HD2  LEU  33          3HD2      LEU  33  -7.067   3.879  -6.206
   84   3HD2  LEU  33          1HD2      LEU  33  -8.374   4.628  -7.125
   85    H    SER  34           H        SER  34  -4.484   5.734  -3.876
   86    HA   SER  34           HA       SER  34  -2.905   5.689  -1.541
   87   1HB   SER  34          1HB       SER  34  -2.315   6.530  -3.832
   88   2HB   SER  34          2HB       SER  34  -3.280   7.981  -3.505
   89    HG   SER  34           HG       SER  34  -1.071   8.302  -3.063
   90    H    SER  35           H        SER  35  -5.970   7.234  -1.920
   91    HA   SER  35           HA       SER  35  -5.635   8.855   0.565
   92   1HB   SER  35          1HB       SER  35  -7.451  10.252  -0.384
   93   2HB   SER  35          2HB       SER  35  -6.006  10.206  -1.412
   94    HG   SER  35           HG       SER  35  -7.961   9.895  -2.609
   95    H    GLN  36           H        GLN  36  -7.250   6.054  -0.603
   96    HA   GLN  36           HA       GLN  36  -9.667   6.317   1.043
   97   1HB   GLN  36          1HB       GLN  36  -9.363   4.917  -1.124
   98   2HB   GLN  36          2HB       GLN  36  -8.495   3.770  -0.109
   99   1HG   GLN  36          1HG       GLN  36 -10.677   2.908  -0.122
  100   2HG   GLN  36          2HG       GLN  36 -10.666   3.801   1.385
  101   1HE2  GLN  36          2HE2      GLN  36 -12.013   3.593  -1.889
  102   2HE2  GLN  36          1HE2      GLN  36 -13.150   4.918  -1.669
  103    H    CYS  37           H        CYS  37  -6.505   4.795   1.270
  104    HA   CYS  37           HA       CYS  37  -6.522   4.926   4.189
  105   1HB   CYS  37          1HB       CYS  37  -6.046   2.370   2.608
  106   2HB   CYS  37          2HB       CYS  37  -5.172   2.656   4.091
  107    H    ARG  38           H        ARG  38  -4.082   4.362   4.855
  108    HA   ARG  38           HA       ARG  38  -2.371   6.355   3.819
  109   1HB   ARG  38          1HB       ARG  38  -1.671   3.783   5.309
  110   2HB   ARG  38          2HB       ARG  38  -0.533   5.064   4.925
  111   1HG   ARG  38          1HG       ARG  38  -0.973   5.680   7.014
  112   2HG   ARG  38          2HG       ARG  38  -2.216   6.638   6.229
  113   1HD   ARG  38          1HD       ARG  38  -2.756   3.853   7.340
  114   2HD   ARG  38          2HD       ARG  38  -2.732   5.262   8.393
  115    HE   ARG  38           HE       ARG  38  -4.519   6.245   6.873
  116   1HH1  ARG  38          1HH2      ARG  38  -4.389   2.772   7.519
  117   2HH1  ARG  38          2HH2      ARG  38  -6.104   2.612   7.238
  118   1HH2  ARG  38          1HH1      ARG  38  -6.701   5.916   6.642
  119   2HH2  ARG  38          2HH1      ARG  38  -7.331   4.296   6.684
  120    H    ALA  39           H        ALA  39  -2.575   2.945   2.805
  121    HA   ALA  39           HA       ALA  39  -1.475   3.651   0.205
  122   1HB   ALA  39          1HB       ALA  39  -0.033   1.639   1.998
  123   2HB   ALA  39          2HB       ALA  39   0.369   1.973   0.307
  124   3HB   ALA  39          3HB       ALA  39   0.601   3.235   1.531
  125    HA   PRO  40           HA       PRO  40  -3.759  -0.231  -0.809
  126   1HB   PRO  40          2HB       PRO  40  -2.748  -0.807  -3.262
  127   2HB   PRO  40          1HB       PRO  40  -3.845   0.578  -2.995
  128   1HG   PRO  40          1HG       PRO  40  -0.813   0.606  -3.137
  129   2HG   PRO  40          2HG       PRO  40  -1.969   1.667  -4.002
  130   1HD   PRO  40          1HD       PRO  40  -0.735   2.398  -1.667
  131   2HD   PRO  40          2HD       PRO  40  -2.391   2.935  -2.076
  132    H    LYS  41           H        LYS  41  -3.060  -2.497  -1.508
  133    HA   LYS  41           HA       LYS  41  -1.356  -3.693   0.321
  134   1HB   LYS  41          1HB       LYS  41  -3.266  -4.667  -1.030
  135   2HB   LYS  41          2HB       LYS  41  -2.175  -4.797  -2.399
  136   1HG   LYS  41          1HG       LYS  41  -2.506  -6.929  -1.272
  137   2HG   LYS  41          2HG       LYS  41  -0.813  -6.449  -1.185
  138   1HD   LYS  41          1HD       LYS  41  -1.060  -5.803   1.171
  139   2HD   LYS  41          2HD       LYS  41  -2.817  -5.970   1.065
  140   1HE   LYS  41          1HE       LYS  41  -1.971  -7.883   2.228
  141   2HE   LYS  41          2HE       LYS  41  -2.581  -8.402   0.655
  142   1HZ   LYS  41          2HZ       LYS  41   0.288  -7.967   1.317
  143   2HZ   LYS  41          3HZ       LYS  41  -0.437  -9.419   1.167
  144   3HZ   LYS  41          1HZ       LYS  41  -0.272  -8.464  -0.142
  145    H    VAL  42           H        VAL  42  -0.239  -2.128  -2.461
  146    HA   VAL  42           HA       VAL  42   2.281  -3.369  -2.977
  147    HB   VAL  42           HB       VAL  42   1.476  -0.429  -3.070
  148   1HG1  VAL  42          3HG1      VAL  42   3.760  -1.890  -4.453
  149   2HG1  VAL  42          1HG1      VAL  42   3.255  -0.220  -4.796
  150   3HG1  VAL  42          2HG1      VAL  42   3.909  -0.625  -3.212
  151   1HG2  VAL  42          3HG2      VAL  42   1.404  -2.569  -5.243
  152   2HG2  VAL  42          1HG2      VAL  42  -0.008  -1.786  -4.500
  153   3HG2  VAL  42          2HG2      VAL  42   1.095  -0.836  -5.490
  154    H    CYS  43           H        CYS  43   1.253  -1.171  -0.362
  155    HA   CYS  43           HA       CYS  43   3.875  -1.407   1.010
  156   1HB   CYS  43          1HB       CYS  43   3.920   0.453  -0.708
  157   2HB   CYS  43          2HB       CYS  43   2.641   1.264   0.202
  158    H    PHE  44           H        PHE  44   3.272   0.773   2.709
  159    HA   PHE  44           HA       PHE  44   0.646   0.329   3.989
  160   1HB   PHE  44          1HB       PHE  44   1.449  -0.065   6.151
  161   2HB   PHE  44          2HB       PHE  44   2.378  -1.157   5.143
  162    HD1  PHE  44           HD1      PHE  44   2.479   1.565   7.531
  163    HD2  PHE  44           HD2      PHE  44   4.809  -0.458   4.513
  164    HE1  PHE  44           HE1      PHE  44   4.551   2.579   8.447
  165    HE2  PHE  44           HE2      PHE  44   6.874   0.568   5.431
  166    HZ   PHE  44           HZ       PHE  44   6.751   2.089   7.393
  167    H    LYS  45           H        LYS  45   3.353   2.412   3.250
  168    HA   LYS  45           HA       LYS  45   1.836   4.820   3.984
  169   1HB   LYS  45          1HB       LYS  45   2.853   4.163   6.140
  170   2HB   LYS  45          2HB       LYS  45   4.439   4.063   5.390
  171   1HG   LYS  45          1HG       LYS  45   4.260   6.076   6.698
  172   2HG   LYS  45          2HG       LYS  45   4.429   6.507   4.999
  173   1HD   LYS  45          1HD       LYS  45   1.996   6.978   4.859
  174   2HD   LYS  45          2HD       LYS  45   1.793   6.450   6.547
  175   1HE   LYS  45          1HE       LYS  45   3.371   8.240   7.274
  176   2HE   LYS  45          2HE       LYS  45   3.544   8.767   5.596
  177   1HZ   LYS  45          1HZ       LYS  45   1.160   9.298   5.591
  178   2HZ   LYS  45          2HZ       LYS  45   1.006   8.811   7.147
  179   3HZ   LYS  45          3HZ       LYS  45   1.913  10.114   6.783
  180    H    CYS  46           H        CYS  46   5.198   3.784   3.178
  181    HA   CYS  46           HA       CYS  46   5.900   6.224   1.996
  182   1HB   CYS  46          1HB       CYS  46   7.725   4.336   1.020
  183   2HB   CYS  46          2HB       CYS  46   7.858   5.334   2.456
  184    H    LYS  47           H        LYS  47   4.711   3.297   0.441
  185    HA   LYS  47           HA       LYS  47   4.187   2.750  -1.720
  186   1HB   LYS  47          1HB       LYS  47   2.201   3.958  -2.397
  187   2HB   LYS  47          2HB       LYS  47   2.265   3.665  -0.667
  188   1HG   LYS  47          1HG       LYS  47   3.089   6.062  -0.376
  189   2HG   LYS  47          2HG       LYS  47   2.739   6.323  -2.088
  190   1HD   LYS  47          1HD       LYS  47   0.378   5.918  -1.712
  191   2HD   LYS  47          2HD       LYS  47   0.693   5.283  -0.082
  192   1HE   LYS  47          1HE       LYS  47   1.597   7.491   0.611
  193   2HE   LYS  47          2HE       LYS  47   1.187   8.153  -0.981
  194   1HZ   LYS  47          3HZ       LYS  47  -0.775   6.978   0.914
  195   2HZ   LYS  47          1HZ       LYS  47  -0.547   8.590   0.700
  196   3HZ   LYS  47          2HZ       LYS  47  -1.134   7.686  -0.530
  197    H    GLN  48           H        GLN  48   6.733   4.208  -1.898
  198    HA   GLN  48           HA       GLN  48   6.697   5.755  -4.316
  199   1HB   GLN  48          1HB       GLN  48   8.998   4.249  -3.004
  200   2HB   GLN  48          2HB       GLN  48   9.168   5.445  -4.280
  201   1HG   GLN  48          1HG       GLN  48   8.173   5.940  -1.448
  202   2HG   GLN  48          2HG       GLN  48   9.704   6.441  -2.137
  203   1HE2  GLN  48          2HE2      GLN  48   6.440   7.395  -1.615
  204   2HE2  GLN  48          1HE2      GLN  48   6.494   8.844  -2.623
  205    HA   PRO  49           HA       PRO  49   6.065   3.120  -7.587
  206   1HB   PRO  49          2HB       PRO  49   8.680   3.982  -8.843
  207   2HB   PRO  49          1HB       PRO  49   7.062   3.843  -9.602
  208   1HG   PRO  49          1HG       PRO  49   7.954   6.253  -8.784
  209   2HG   PRO  49          2HG       PRO  49   6.266   5.764  -8.423
  210   1HD   PRO  49          1HD       PRO  49   8.667   5.742  -6.597
  211   2HD   PRO  49          2HD       PRO  49   6.983   6.239  -6.269
  212    H    GLY  50           H        GLY  50   9.274   2.414  -6.268
  213   1HA   GLY  50          2HA       GLY  50  10.303   0.360  -7.668
  214   2HA   GLY  50          1HA       GLY  50   8.912  -0.454  -6.952
  215    H    HIS  51           H        HIS  51   9.438   1.410  -4.469
  216    HA   HIS  51           HA       HIS  51  11.959   0.467  -3.375
  217   1HB   HIS  51          1HB       HIS  51  11.435   1.790  -1.520
  218   2HB   HIS  51          2HB       HIS  51  10.741   2.669  -2.870
  219    HD1  HIS  51           HD1      HIS  51   7.812   1.914  -3.099
  220    HD2  HIS  51           HD2      HIS  51   9.938   1.479   0.521
  221    HE1  HIS  51           HE1      HIS  51   6.086   1.509  -1.290
  222    H    PHE  52           H        PHE  52   8.667  -0.699  -3.242
  223    HA   PHE  52           HA       PHE  52   8.568  -1.757  -0.681
  224   1HB   PHE  52          1HB       PHE  52   6.628  -3.134  -1.677
  225   2HB   PHE  52          2HB       PHE  52   6.547  -1.387  -1.693
  226    HD1  PHE  52           HD1      PHE  52   7.051  -4.394  -3.842
  227    HD2  PHE  52           HD2      PHE  52   6.497  -0.114  -3.743
  228    HE1  PHE  52           HE1      PHE  52   6.703  -4.374  -6.297
  229    HE2  PHE  52           HE2      PHE  52   6.134  -0.105  -6.190
  230    HZ   PHE  52           HZ       PHE  52   6.247  -2.229  -7.478
  231    H    SER  53           H        SER  53   9.486  -3.574  -3.638
  232    HA   SER  53           HA       SER  53   9.764  -6.117  -2.445
  233   1HB   SER  53          1HB       SER  53  11.338  -4.975  -4.783
  234   2HB   SER  53          2HB       SER  53  11.070  -6.692  -4.423
  235    HG   SER  53           HG       SER  53   9.599  -5.922  -5.997
  236    H    LYS  54           H        LYS  54  11.624  -3.457  -1.651
  237    HA   LYS  54           HA       LYS  54  13.947  -5.081  -0.672
  238   1HB   LYS  54          1HB       LYS  54  13.878  -2.318  -1.945
  239   2HB   LYS  54          2HB       LYS  54  15.293  -2.958  -1.127
  240   1HG   LYS  54          1HG       LYS  54  15.787  -4.522  -2.737
  241   2HG   LYS  54          2HG       LYS  54  14.138  -4.663  -3.332
  242   1HD   LYS  54          1HD       LYS  54  15.844  -2.181  -3.765
  243   2HD   LYS  54          2HD       LYS  54  15.715  -3.529  -4.913
  244   1HE   LYS  54          1HE       LYS  54  13.242  -3.231  -4.994
  245   2HE   LYS  54          2HE       LYS  54  13.369  -1.856  -3.897
  246   1HZ   LYS  54          1HZ       LYS  54  14.723  -0.729  -5.596
  247   2HZ   LYS  54          2HZ       LYS  54  14.541  -1.994  -6.620
  248   3HZ   LYS  54          3HZ       LYS  54  13.233  -1.119  -6.154
  249    H    GLN  55           H        GLN  55  11.286  -3.626   0.470
  250    HA   GLN  55           HA       GLN  55  12.535  -3.122   3.078
  251   1HB   GLN  55          1HB       GLN  55  12.708  -0.915   1.922
  252   2HB   GLN  55          2HB       GLN  55  10.959  -0.900   1.700
  253   1HG   GLN  55          1HG       GLN  55  10.703  -0.994   4.220
  254   2HG   GLN  55          2HG       GLN  55  12.461  -0.909   4.362
  255   1HE2  GLN  55          1HE2      GLN  55   9.522   0.872   3.501
  256   2HE2  GLN  55          2HE2      GLN  55  10.277   2.460   3.514
  257    H    CYS  56           H        CYS  56   9.382  -2.366   1.513
  258    HA   CYS  56           HA       CYS  56   7.992  -3.071   3.944
  259   1HB   CYS  56          1HB       CYS  56   6.988  -2.048   1.251
  260   2HB   CYS  56          2HB       CYS  56   6.083  -2.057   2.773
  261    H    ARG  57           H        ARG  57   8.555  -4.752   0.982
  262    HA   ARG  57           HA       ARG  57   6.563  -6.882   1.615
  263   1HB   ARG  57          1HB       ARG  57   6.079  -4.859  -0.241
  264   2HB   ARG  57          2HB       ARG  57   6.844  -6.059  -1.255
  265   1HG   ARG  57          1HG       ARG  57   4.756  -6.913  -1.456
  266   2HG   ARG  57          2HG       ARG  57   5.029  -7.639   0.123
  267   1HD   ARG  57          1HD       ARG  57   3.581  -5.051  -0.546
  268   2HD   ARG  57          2HD       ARG  57   2.881  -6.525   0.133
  269    HE   ARG  57           HE       ARG  57   4.883  -5.553   1.933
  270   1HH1  ARG  57          2HH1      ARG  57   1.747  -4.479   0.815
  271   2HH1  ARG  57          1HH1      ARG  57   1.577  -3.370   2.153
  272   1HH2  ARG  57          2HH2      ARG  57   4.545  -4.280   3.624
  273   2HH2  ARG  57          1HH2      ARG  57   3.017  -3.436   3.836
  274    H    SER  58           H        SER  58   9.621  -6.536   1.545
  275    HA   SER  58           HA       SER  58  10.980  -7.993  -0.349
  276   1HB   SER  58          1HB       SER  58  11.477  -8.098   2.644
  277   2HB   SER  58          2HB       SER  58  12.656  -8.399   1.354
  278    HG   SER  58           HG       SER  58  12.753  -6.233   2.197

  No H/Q in entry =         278
  Start of MODEL   27
    1    H1   GLN  22           H1       GLN  22  -7.814  -0.923  -6.308
    2    H2   GLN  22           H3       GLN  22  -6.894   0.357  -5.883
    3    H3   GLN  22           H2       GLN  22  -6.733  -0.306  -7.382
    4    HA   GLN  22           HA       GLN  22  -5.897  -2.365  -6.432
    5   1HB   GLN  22          1HB       GLN  22  -4.434   0.169  -5.576
    6   2HB   GLN  22          2HB       GLN  22  -3.758  -1.440  -5.361
    7   1HG   GLN  22          1HG       GLN  22  -4.535  -0.287  -8.081
    8   2HG   GLN  22          2HG       GLN  22  -2.929  -0.231  -7.371
    9   1HE2  GLN  22          1HE2      GLN  22  -2.116  -1.467  -9.234
   10   2HE2  GLN  22          2HE2      GLN  22  -2.400  -3.204  -9.279
   11    H    THR  23           H        THR  23  -6.140  -3.760  -4.782
   12    HA   THR  23           HA       THR  23  -7.773  -3.299  -2.642
   13    HB   THR  23           HB       THR  23  -5.527  -5.341  -2.649
   14    HG1  THR  23           HG1      THR  23  -6.976  -6.592  -3.833
   15   1HG2  THR  23          3HG2      THR  23  -8.366  -5.435  -1.523
   16   2HG2  THR  23          1HG2      THR  23  -7.201  -6.775  -1.515
   17   3HG2  THR  23          2HG2      THR  23  -6.873  -5.330  -0.555
   18    H    CYS  24           H        CYS  24  -7.712  -2.630  -0.600
   19    HA   CYS  24           HA       CYS  24  -5.827  -0.885   0.424
   20   1HB   CYS  24          1HB       CYS  24  -8.245  -1.326   1.104
   21   2HB   CYS  24          2HB       CYS  24  -7.656  -2.701   2.033
   22    H    TYR  25           H        TYR  25  -4.223  -0.953   2.032
   23    HA   TYR  25           HA       TYR  25  -2.705  -3.359   2.466
   24   1HB   TYR  25          1HB       TYR  25  -1.263  -2.132   3.688
   25   2HB   TYR  25          2HB       TYR  25  -1.904  -0.904   2.626
   26    HD1  TYR  25           HD1      TYR  25  -0.807  -1.439   5.818
   27    HD2  TYR  25           HD2      TYR  25  -4.269   0.198   3.824
   28    HE1  TYR  25           HE1      TYR  25  -1.374  -0.137   7.861
   29    HE2  TYR  25           HE2      TYR  25  -4.866   1.438   5.892
   30    HH   TYR  25           HH       TYR  25  -4.339   1.852   8.092
   31    H    ASN  26           H        ASN  26  -5.585  -2.225   3.931
   32    HA   ASN  26           HA       ASN  26  -5.337  -4.126   6.248
   33   1HB   ASN  26          1HB       ASN  26  -4.877  -1.862   6.978
   34   2HB   ASN  26          2HB       ASN  26  -6.268  -1.224   6.106
   35   1HD2  ASN  26          2HD2      ASN  26  -8.374  -1.401   7.036
   36   2HD2  ASN  26          1HD2      ASN  26  -8.567  -1.969   8.688
   37    H    CYS  27           H        CYS  27  -7.703  -2.249   4.279
   38    HA   CYS  27           HA       CYS  27  -9.942  -3.477   5.534
   39   1HB   CYS  27          1HB       CYS  27  -9.808  -1.753   3.029
   40   2HB   CYS  27          2HB       CYS  27 -11.222  -2.026   4.050
   41    H    GLY  28           H        GLY  28  -8.081  -4.749   2.988
   42   1HA   GLY  28          2HA       GLY  28  -9.695  -7.015   2.534
   43   2HA   GLY  28          1HA       GLY  28  -8.364  -6.482   1.503
   44    H    LYS  29           H        LYS  29  -9.691  -3.946   0.791
   45    HA   LYS  29           HA       LYS  29 -12.038  -4.840  -0.837
   46   1HB   LYS  29          1HB       LYS  29 -12.572  -3.462   1.124
   47   2HB   LYS  29          2HB       LYS  29 -11.481  -2.213   0.564
   48   1HG   LYS  29          1HG       LYS  29 -13.690  -1.508   0.052
   49   2HG   LYS  29          2HG       LYS  29 -12.946  -1.930  -1.490
   50   1HD   LYS  29          1HD       LYS  29 -14.142  -4.114  -1.470
   51   2HD   LYS  29          2HD       LYS  29 -14.817  -3.729   0.127
   52   1HE   LYS  29          1HE       LYS  29 -15.933  -1.723  -0.847
   53   2HE   LYS  29          2HE       LYS  29 -15.294  -2.145  -2.440
   54   1HZ   LYS  29          1HZ       LYS  29 -16.565  -4.230  -2.317
   55   2HZ   LYS  29          2HZ       LYS  29 -17.153  -3.833  -0.846
   56   3HZ   LYS  29          3HZ       LYS  29 -17.566  -2.953  -2.153
   57    HA   PRO  30           HA       PRO  30  -9.203  -3.927  -4.235
   58   1HB   PRO  30          2HB       PRO  30 -11.822  -3.932  -5.743
   59   2HB   PRO  30          1HB       PRO  30 -10.247  -4.645  -6.217
   60   1HG   PRO  30          1HG       PRO  30 -12.165  -6.218  -5.156
   61   2HG   PRO  30          2HG       PRO  30 -10.469  -6.387  -4.591
   62   1HD   PRO  30          1HD       PRO  30 -12.765  -4.955  -3.257
   63   2HD   PRO  30          2HD       PRO  30 -11.504  -6.003  -2.543
   64    H    GLY  31           H        GLY  31 -12.100  -1.909  -3.801
   65   1HA   GLY  31          2HA       GLY  31 -12.658   0.227  -4.437
   66   2HA   GLY  31          1HA       GLY  31 -11.379   0.165  -5.647
   67    H    HIS  32           H        HIS  32  -9.247  -0.276  -3.627
   68    HA   HIS  32           HA       HIS  32  -9.200   2.334  -2.196
   69   1HB   HIS  32          1HB       HIS  32  -7.936  -0.339  -1.703
   70   2HB   HIS  32          2HB       HIS  32  -7.091   1.098  -1.146
   71    HD1  HIS  32           HD1      HIS  32 -10.607  -0.476  -0.731
   72    HD2  HIS  32           HD2      HIS  32  -7.785   1.973   1.171
   73    HE1  HIS  32           HE1      HIS  32 -11.544   0.018   1.608
   74    H    LEU  33           H        LEU  33  -7.101   3.300  -1.942
   75    HA   LEU  33           HA       LEU  33  -5.247   3.413  -4.203
   76   1HB   LEU  33          1HB       LEU  33  -7.179   5.673  -3.451
   77   2HB   LEU  33          2HB       LEU  33  -5.742   5.920  -4.428
   78    HG   LEU  33           HG       LEU  33  -8.113   4.201  -5.255
   79   1HD1  LEU  33          2HD1      LEU  33  -8.643   6.597  -5.154
   80   2HD1  LEU  33          3HD1      LEU  33  -7.220   6.967  -6.153
   81   3HD1  LEU  33          1HD1      LEU  33  -8.569   6.025  -6.828
   82   1HD2  LEU  33          3HD2      LEU  33  -5.633   5.105  -6.798
   83   2HD2  LEU  33          1HD2      LEU  33  -6.009   3.433  -6.319
   84   3HD2  LEU  33          2HD2      LEU  33  -7.035   4.263  -7.493
   85    H    SER  34           H        SER  34  -3.584   5.105  -3.692
   86    HA   SER  34           HA       SER  34  -2.507   5.132  -1.093
   87   1HB   SER  34          1HB       SER  34  -2.151   7.060  -3.420
   88   2HB   SER  34          2HB       SER  34  -1.082   6.970  -2.010
   89    HG   SER  34           HG       SER  34  -0.353   5.697  -3.822
   90    H    SER  35           H        SER  35  -5.293   6.806  -1.981
   91    HA   SER  35           HA       SER  35  -5.071   8.701   0.319
   92   1HB   SER  35          1HB       SER  35  -6.588  10.172  -0.980
   93   2HB   SER  35          2HB       SER  35  -5.038   9.893  -1.796
   94    HG   SER  35           HG       SER  35  -6.848   9.661  -3.218
   95    H    GLN  36           H        GLN  36  -6.792   5.969  -0.865
   96    HA   GLN  36           HA       GLN  36  -9.357   6.553   0.443
   97   1HB   GLN  36          1HB       GLN  36  -8.944   4.983  -1.575
   98   2HB   GLN  36          2HB       GLN  36  -8.266   3.853  -0.408
   99   1HG   GLN  36          1HG       GLN  36 -10.486   3.127  -0.603
  100   2HG   GLN  36          2HG       GLN  36 -10.565   4.108   0.846
  101   1HE2  GLN  36          2HE2      GLN  36 -11.652   3.741  -2.494
  102   2HE2  GLN  36          1HE2      GLN  36 -12.686   5.164  -2.481
  103    H    CYS  37           H        CYS  37  -6.393   4.790   1.128
  104    HA   CYS  37           HA       CYS  37  -6.741   5.070   4.029
  105   1HB   CYS  37          1HB       CYS  37  -6.240   2.437   2.588
  106   2HB   CYS  37          2HB       CYS  37  -5.586   2.712   4.191
  107    H    ARG  38           H        ARG  38  -4.430   4.265   4.954
  108    HA   ARG  38           HA       ARG  38  -2.493   6.176   4.212
  109   1HB   ARG  38          1HB       ARG  38  -2.166   3.518   5.673
  110   2HB   ARG  38          2HB       ARG  38  -0.867   4.675   5.436
  111   1HG   ARG  38          1HG       ARG  38  -1.613   5.000   7.605
  112   2HG   ARG  38          2HG       ARG  38  -2.135   6.408   6.696
  113   1HD   ARG  38          1HD       ARG  38  -4.003   4.067   7.208
  114   2HD   ARG  38          2HD       ARG  38  -3.702   5.271   8.463
  115    HE   ARG  38           HE       ARG  38  -4.375   6.913   6.455
  116   1HH1  ARG  38          1HH1      ARG  38  -6.066   4.079   7.651
  117   2HH1  ARG  38          2HH1      ARG  38  -7.596   4.627   7.029
  118   1HH2  ARG  38          2HH2      ARG  38  -6.394   7.614   5.834
  119   2HH2  ARG  38          1HH2      ARG  38  -7.782   6.604   6.108
  120    H    ALA  39           H        ALA  39  -2.807   2.852   3.007
  121    HA   ALA  39           HA       ALA  39  -1.507   3.594   0.530
  122   1HB   ALA  39          2HB       ALA  39   0.490   3.057   1.935
  123   2HB   ALA  39          3HB       ALA  39  -0.221   1.471   2.315
  124   3HB   ALA  39          1HB       ALA  39   0.274   1.848   0.659
  125    HA   PRO  40           HA       PRO  40  -3.755  -0.302  -0.657
  126   1HB   PRO  40          2HB       PRO  40  -2.569  -0.896  -3.022
  127   2HB   PRO  40          1HB       PRO  40  -3.702   0.480  -2.862
  128   1HG   PRO  40          1HG       PRO  40  -0.667   0.551  -2.792
  129   2HG   PRO  40          2HG       PRO  40  -1.775   1.585  -3.749
  130   1HD   PRO  40          1HD       PRO  40  -0.710   2.357  -1.339
  131   2HD   PRO  40          2HD       PRO  40  -2.331   2.877  -1.878
  132    H    LYS  41           H        LYS  41  -3.020  -2.594  -1.067
  133    HA   LYS  41           HA       LYS  41  -1.294  -3.475   0.937
  134   1HB   LYS  41          1HB       LYS  41  -3.223  -4.674  -0.298
  135   2HB   LYS  41          2HB       LYS  41  -2.052  -5.088  -1.534
  136   1HG   LYS  41          1HG       LYS  41  -2.429  -6.946  -0.021
  137   2HG   LYS  41          2HG       LYS  41  -0.760  -6.408   0.137
  138   1HD   LYS  41          1HD       LYS  41  -1.299  -5.238   2.236
  139   2HD   LYS  41          2HD       LYS  41  -3.027  -5.619   2.022
  140   1HE   LYS  41          1HE       LYS  41  -2.506  -8.032   2.187
  141   2HE   LYS  41          2HE       LYS  41  -0.791  -7.653   2.398
  142   1HZ   LYS  41          3HZ       LYS  41  -2.955  -6.779   4.248
  143   2HZ   LYS  41          1HZ       LYS  41  -1.913  -8.004   4.537
  144   3HZ   LYS  41          2HZ       LYS  41  -1.368  -6.467   4.449
  145    H    VAL  42           H        VAL  42  -0.241  -2.422  -2.098
  146    HA   VAL  42           HA       VAL  42   2.284  -3.652  -2.471
  147    HB   VAL  42           HB       VAL  42   1.524  -0.718  -2.812
  148   1HG1  VAL  42          3HG1      VAL  42   3.706  -2.373  -4.140
  149   2HG1  VAL  42          1HG1      VAL  42   3.247  -0.719  -4.606
  150   3HG1  VAL  42          2HG1      VAL  42   3.948  -1.014  -3.017
  151   1HG2  VAL  42          2HG2      VAL  42   1.298  -3.041  -4.776
  152   2HG2  VAL  42          3HG2      VAL  42  -0.055  -2.126  -4.073
  153   3HG2  VAL  42          1HG2      VAL  42   1.057  -1.328  -5.180
  154    H    CYS  43           H        CYS  43   1.243  -1.301  -0.037
  155    HA   CYS  43           HA       CYS  43   3.810  -1.471   1.420
  156   1HB   CYS  43          1HB       CYS  43   3.888   0.347  -0.358
  157   2HB   CYS  43          2HB       CYS  43   2.585   1.170   0.508
  158    H    PHE  44           H        PHE  44   3.257   0.601   3.114
  159    HA   PHE  44           HA       PHE  44   0.547   0.358   4.285
  160   1HB   PHE  44          1HB       PHE  44   1.312  -0.020   6.494
  161   2HB   PHE  44          2HB       PHE  44   2.075  -1.241   5.494
  162    HD1  PHE  44           HD1      PHE  44   2.590   1.532   7.785
  163    HD2  PHE  44           HD2      PHE  44   4.550  -0.914   4.821
  164    HE1  PHE  44           HE1      PHE  44   4.802   2.287   8.622
  165    HE2  PHE  44           HE2      PHE  44   6.758  -0.148   5.652
  166    HZ   PHE  44           HZ       PHE  44   6.889   1.455   7.551
  167    H    LYS  45           H        LYS  45   3.302   2.310   3.479
  168    HA   LYS  45           HA       LYS  45   1.978   4.777   4.409
  169   1HB   LYS  45          1HB       LYS  45   3.129   3.948   6.434
  170   2HB   LYS  45          2HB       LYS  45   4.659   3.872   5.559
  171   1HG   LYS  45          1HG       LYS  45   4.599   6.345   5.259
  172   2HG   LYS  45          2HG       LYS  45   3.037   6.403   6.102
  173   1HD   LYS  45          1HD       LYS  45   4.111   5.471   8.140
  174   2HD   LYS  45          2HD       LYS  45   5.668   5.397   7.287
  175   1HE   LYS  45          1HE       LYS  45   5.595   7.860   6.949
  176   2HE   LYS  45          2HE       LYS  45   4.050   7.932   7.805
  177   1HZ   LYS  45          2HZ       LYS  45   5.190   7.092   9.794
  178   2HZ   LYS  45          3HZ       LYS  45   6.618   7.028   9.000
  179   3HZ   LYS  45          1HZ       LYS  45   5.902   8.466   9.281
  180    H    CYS  46           H        CYS  46   5.277   3.710   3.376
  181    HA   CYS  46           HA       CYS  46   5.836   6.180   2.123
  182   1HB   CYS  46          1HB       CYS  46   7.809   4.569   1.203
  183   2HB   CYS  46          2HB       CYS  46   7.769   5.324   2.789
  184    H    LYS  47           H        LYS  47   4.656   3.191   0.731
  185    HA   LYS  47           HA       LYS  47   3.946   2.591  -1.358
  186   1HB   LYS  47          1HB       LYS  47   1.871   3.695  -1.787
  187   2HB   LYS  47          2HB       LYS  47   2.176   3.581  -0.064
  188   1HG   LYS  47          1HG       LYS  47   3.072   6.055  -0.294
  189   2HG   LYS  47          2HG       LYS  47   2.202   6.050  -1.830
  190   1HD   LYS  47          1HD       LYS  47   0.104   5.532  -0.637
  191   2HD   LYS  47          2HD       LYS  47   1.005   5.323   0.874
  192   1HE   LYS  47          1HE       LYS  47   1.765   7.667   0.782
  193   2HE   LYS  47          2HE       LYS  47   0.807   7.941  -0.681
  194   1HZ   LYS  47          2HZ       LYS  47  -0.390   6.989   1.863
  195   2HZ   LYS  47          3HZ       LYS  47  -0.281   8.591   1.493
  196   3HZ   LYS  47          1HZ       LYS  47  -1.197   7.592   0.581
  197    H    GLN  48           H        GLN  48   6.433   4.161  -1.857
  198    HA   GLN  48           HA       GLN  48   6.038   5.577  -4.328
  199   1HB   GLN  48          1HB       GLN  48   8.548   4.245  -3.238
  200   2HB   GLN  48          2HB       GLN  48   8.506   5.391  -4.570
  201   1HG   GLN  48          1HG       GLN  48   7.874   5.948  -1.651
  202   2HG   GLN  48          2HG       GLN  48   9.242   6.527  -2.578
  203   1HE2  GLN  48          2HE2      GLN  48   6.043   7.273  -1.584
  204   2HE2  GLN  48          1HE2      GLN  48   5.824   8.681  -2.634
  205    HA   PRO  49           HA       PRO  49   5.252   2.711  -7.397
  206   1HB   PRO  49          2HB       PRO  49   7.664   3.676  -8.949
  207   2HB   PRO  49          1HB       PRO  49   5.994   3.387  -9.533
  208   1HG   PRO  49          1HG       PRO  49   6.785   5.895  -8.934
  209   2HG   PRO  49          2HG       PRO  49   5.181   5.316  -8.375
  210   1HD   PRO  49          1HD       PRO  49   7.748   5.550  -6.808
  211   2HD   PRO  49          2HD       PRO  49   6.075   5.964  -6.334
  212    H    GLY  50           H        GLY  50   8.612   2.314  -6.357
  213   1HA   GLY  50          2HA       GLY  50   9.753   0.321  -7.656
  214   2HA   GLY  50          1HA       GLY  50   8.425  -0.609  -6.968
  215    H    HIS  51           H        HIS  51   9.185   1.622  -4.613
  216    HA   HIS  51           HA       HIS  51  11.639   0.722  -3.538
  217   1HB   HIS  51          1HB       HIS  51  11.107   2.014  -1.660
  218   2HB   HIS  51          2HB       HIS  51  10.300   2.837  -2.981
  219    HD1  HIS  51           HD1      HIS  51   7.428   1.822  -3.092
  220    HD2  HIS  51           HD2      HIS  51   9.724   1.584   0.439
  221    HE1  HIS  51           HE1      HIS  51   5.820   1.254  -1.221
  222    H    PHE  52           H        PHE  52   8.441  -0.689  -3.203
  223    HA   PHE  52           HA       PHE  52   8.673  -1.913  -0.711
  224   1HB   PHE  52          1HB       PHE  52   6.774  -3.315  -1.437
  225   2HB   PHE  52          2HB       PHE  52   6.556  -1.605  -1.745
  226    HD1  PHE  52           HD1      PHE  52   6.960  -4.927  -3.298
  227    HD2  PHE  52           HD2      PHE  52   6.506  -0.701  -4.055
  228    HE1  PHE  52           HE1      PHE  52   6.425  -5.404  -5.670
  229    HE2  PHE  52           HE2      PHE  52   5.964  -1.191  -6.421
  230    HZ   PHE  52           HZ       PHE  52   5.929  -3.537  -7.239
  231    H    SER  53           H        SER  53   9.555  -3.338  -3.885
  232    HA   SER  53           HA       SER  53  10.327  -5.900  -3.024
  233   1HB   SER  53          1HB       SER  53  11.562  -4.208  -5.230
  234   2HB   SER  53          2HB       SER  53  11.667  -5.974  -5.078
  235    HG   SER  53           HG       SER  53   9.999  -5.326  -6.519
  236    H    LYS  54           H        LYS  54  11.834  -3.001  -2.098
  237    HA   LYS  54           HA       LYS  54  14.362  -4.374  -1.269
  238   1HB   LYS  54          1HB       LYS  54  14.015  -1.469  -2.126
  239   2HB   LYS  54          2HB       LYS  54  15.528  -2.248  -1.682
  240   1HG   LYS  54          1HG       LYS  54  13.858  -2.909  -4.148
  241   2HG   LYS  54          2HG       LYS  54  15.302  -1.906  -4.109
  242   1HD   LYS  54          1HD       LYS  54  16.685  -3.805  -3.414
  243   2HD   LYS  54          2HD       LYS  54  15.259  -4.855  -3.329
  244   1HE   LYS  54          1HE       LYS  54  14.824  -4.455  -5.747
  245   2HE   LYS  54          2HE       LYS  54  16.276  -3.451  -5.836
  246   1HZ   LYS  54          3HZ       LYS  54  16.242  -6.338  -5.118
  247   2HZ   LYS  54          1HZ       LYS  54  16.719  -5.732  -6.556
  248   3HZ   LYS  54          2HZ       LYS  54  17.586  -5.412  -5.213
  249    H    GLN  55           H        GLN  55  11.578  -3.323   0.039
  250    HA   GLN  55           HA       GLN  55  12.849  -2.837   2.643
  251   1HB   GLN  55          1HB       GLN  55  12.730  -0.566   1.559
  252   2HB   GLN  55          2HB       GLN  55  10.977  -0.729   1.476
  253   1HG   GLN  55          1HG       GLN  55  10.987  -1.008   4.021
  254   2HG   GLN  55          2HG       GLN  55  12.717  -0.652   3.986
  255   1HE2  GLN  55          1HE2      GLN  55   9.466   0.654   3.455
  256   2HE2  GLN  55          2HE2      GLN  55   9.943   2.344   3.480
  257    H    CYS  56           H        CYS  56   9.576  -2.340   1.217
  258    HA   CYS  56           HA       CYS  56   8.336  -3.386   3.612
  259   1HB   CYS  56          1HB       CYS  56   7.139  -2.273   1.040
  260   2HB   CYS  56          2HB       CYS  56   6.288  -2.530   2.567
  261    H    ARG  57           H        ARG  57   9.296  -4.934   0.790
  262    HA   ARG  57           HA       ARG  57   7.671  -7.348   1.308
  263   1HB   ARG  57          1HB       ARG  57   6.680  -5.530  -0.441
  264   2HB   ARG  57          2HB       ARG  57   7.826  -6.276  -1.527
  265   1HG   ARG  57          1HG       ARG  57   5.545  -7.193  -1.727
  266   2HG   ARG  57          2HG       ARG  57   6.696  -8.448  -1.284
  267   1HD   ARG  57          1HD       ARG  57   4.494  -8.570  -0.064
  268   2HD   ARG  57          2HD       ARG  57   5.901  -8.527   0.977
  269    HE   ARG  57           HE       ARG  57   5.389  -6.336   1.691
  270   1HH1  ARG  57          1HH2      ARG  57   2.984  -7.293  -0.708
  271   2HH1  ARG  57          2HH2      ARG  57   1.964  -5.925  -0.279
  272   1HH2  ARG  57          2HH1      ARG  57   3.984  -4.689   2.135
  273   2HH2  ARG  57          1HH1      ARG  57   2.494  -4.553   1.211
  274    H    SER  58           H        SER  58  10.591  -6.492   1.354
  275    HA   SER  58           HA       SER  58  12.223  -7.602  -0.587
  276   1HB   SER  58          1HB       SER  58  12.676  -7.682   2.416
  277   2HB   SER  58          2HB       SER  58  13.919  -7.806   1.154
  278    HG   SER  58           HG       SER  58  13.688  -5.651   1.981

  No H/Q in entry =         278
  Start of MODEL   28
    1    H1   GLN  22           H1       GLN  22  -6.894   0.694  -5.654
    2    H2   GLN  22           H3       GLN  22  -6.926   0.179  -7.220
    3    H3   GLN  22           H2       GLN  22  -8.003  -0.411  -6.126
    4    HA   GLN  22           HA       GLN  22  -6.345  -2.063  -6.532
    5   1HB   GLN  22          1HB       GLN  22  -4.569  -0.426  -7.207
    6   2HB   GLN  22          2HB       GLN  22  -4.351   0.003  -5.505
    7   1HG   GLN  22          1HG       GLN  22  -3.665  -2.343  -5.008
    8   2HG   GLN  22          2HG       GLN  22  -4.006  -2.795  -6.680
    9   1HE2  GLN  22          2HE2      GLN  22  -1.866  -3.418  -7.255
   10   2HE2  GLN  22          1HE2      GLN  22  -0.551  -2.254  -7.275
   11    H    THR  23           H        THR  23  -6.293  -3.584  -4.906
   12    HA   THR  23           HA       THR  23  -7.772  -3.272  -2.650
   13    HB   THR  23           HB       THR  23  -5.474  -5.239  -2.895
   14    HG1  THR  23           HG1      THR  23  -6.968  -6.473  -4.044
   15   1HG2  THR  23          3HG2      THR  23  -8.231  -5.475  -1.600
   16   2HG2  THR  23          1HG2      THR  23  -7.023  -6.770  -1.721
   17   3HG2  THR  23          2HG2      THR  23  -6.686  -5.355  -0.719
   18    H    CYS  24           H        CYS  24  -7.635  -2.595  -0.645
   19    HA   CYS  24           HA       CYS  24  -5.729  -0.897   0.391
   20   1HB   CYS  24          1HB       CYS  24  -8.127  -1.379   1.107
   21   2HB   CYS  24          2HB       CYS  24  -7.512  -2.781   1.979
   22    H    TYR  25           H        TYR  25  -4.088  -0.998   1.947
   23    HA   TYR  25           HA       TYR  25  -2.533  -3.385   2.314
   24   1HB   TYR  25          1HB       TYR  25  -1.121  -2.164   3.590
   25   2HB   TYR  25          2HB       TYR  25  -1.768  -0.931   2.537
   26    HD1  TYR  25           HD1      TYR  25  -0.784  -1.601   5.783
   27    HD2  TYR  25           HD2      TYR  25  -4.096   0.203   3.681
   28    HE1  TYR  25           HE1      TYR  25  -1.399  -0.329   7.832
   29    HE2  TYR  25           HE2      TYR  25  -4.743   1.413   5.752
   30    HH   TYR  25           HH       TYR  25  -4.298   1.767   7.968
   31    H    ASN  26           H        ASN  26  -5.391  -2.297   3.890
   32    HA   ASN  26           HA       ASN  26  -5.059  -4.252   6.150
   33   1HB   ASN  26          1HB       ASN  26  -4.606  -1.996   6.899
   34   2HB   ASN  26          2HB       ASN  26  -6.031  -1.362   6.082
   35   1HD2  ASN  26          2HD2      ASN  26  -8.106  -1.584   7.072
   36   2HD2  ASN  26          1HD2      ASN  26  -8.239  -2.174   8.722
   37    H    CYS  27           H        CYS  27  -7.496  -2.390   4.266
   38    HA   CYS  27           HA       CYS  27  -9.691  -3.680   5.554
   39   1HB   CYS  27          1HB       CYS  27  -9.635  -1.879   3.104
   40   2HB   CYS  27          2HB       CYS  27 -11.023  -2.200   4.148
   41    H    GLY  28           H        GLY  28  -7.854  -4.837   2.943
   42   1HA   GLY  28          2HA       GLY  28  -9.401  -7.133   2.462
   43   2HA   GLY  28          1HA       GLY  28  -8.124  -6.523   1.406
   44    H    LYS  29           H        LYS  29  -9.513  -4.033   0.742
   45    HA   LYS  29           HA       LYS  29 -11.831  -4.999  -0.884
   46   1HB   LYS  29          1HB       LYS  29 -12.374  -3.692   1.209
   47   2HB   LYS  29          2HB       LYS  29 -11.516  -2.336   0.520
   48   1HG   LYS  29          1HG       LYS  29 -13.569  -1.720  -0.187
   49   2HG   LYS  29          2HG       LYS  29 -13.248  -2.800  -1.538
   50   1HD   LYS  29          1HD       LYS  29 -14.811  -3.439   1.007
   51   2HD   LYS  29          2HD       LYS  29 -15.490  -3.147  -0.597
   52   1HE   LYS  29          1HE       LYS  29 -14.344  -5.179  -1.459
   53   2HE   LYS  29          2HE       LYS  29 -13.671  -5.480   0.151
   54   1HZ   LYS  29          2HZ       LYS  29 -16.571  -5.434  -0.494
   55   2HZ   LYS  29          3HZ       LYS  29 -15.687  -6.777  -0.217
   56   3HZ   LYS  29          1HZ       LYS  29 -15.944  -5.712   0.990
   57    HA   PRO  30           HA       PRO  30  -9.180  -3.684  -4.284
   58   1HB   PRO  30          2HB       PRO  30 -11.852  -3.674  -5.695
   59   2HB   PRO  30          1HB       PRO  30 -10.269  -4.281  -6.278
   60   1HG   PRO  30          1HG       PRO  30 -12.085  -6.013  -5.288
   61   2HG   PRO  30          2HG       PRO  30 -10.364  -6.158  -4.797
   62   1HD   PRO  30          1HD       PRO  30 -12.662  -4.932  -3.269
   63   2HD   PRO  30          2HD       PRO  30 -11.333  -5.984  -2.691
   64    H    GLY  31           H        GLY  31 -12.121  -1.828  -3.556
   65   1HA   GLY  31          2HA       GLY  31 -12.807   0.313  -4.017
   66   2HA   GLY  31          1HA       GLY  31 -11.582   0.400  -5.281
   67    H    HIS  32           H        HIS  32  -9.272   0.037  -3.598
   68    HA   HIS  32           HA       HIS  32  -9.321   2.471  -1.872
   69   1HB   HIS  32          1HB       HIS  32  -7.920  -0.170  -1.627
   70   2HB   HIS  32          2HB       HIS  32  -7.139   1.266  -0.976
   71    HD1  HIS  32           HD1      HIS  32 -10.487  -0.624  -0.564
   72    HD2  HIS  32           HD2      HIS  32  -7.892   2.046   1.361
   73    HE1  HIS  32           HE1      HIS  32 -11.420  -0.294   1.808
   74    H    LEU  33           H        LEU  33  -7.511   3.706  -1.681
   75    HA   LEU  33           HA       LEU  33  -5.563   4.083  -3.832
   76   1HB   LEU  33          1HB       LEU  33  -7.895   5.988  -3.256
   77   2HB   LEU  33          2HB       LEU  33  -6.478   6.449  -4.184
   78    HG   LEU  33           HG       LEU  33  -8.494   4.335  -5.039
   79   1HD1  LEU  33          1HD1      LEU  33  -9.412   6.609  -5.046
   80   2HD1  LEU  33          2HD1      LEU  33  -8.031   7.179  -6.007
   81   3HD1  LEU  33          3HD1      LEU  33  -9.179   6.004  -6.693
   82   1HD2  LEU  33          2HD2      LEU  33  -6.136   5.590  -6.526
   83   2HD2  LEU  33          3HD2      LEU  33  -6.242   3.898  -5.991
   84   3HD2  LEU  33          1HD2      LEU  33  -7.346   4.498  -7.233
   85    H    SER  34           H        SER  34  -4.261   6.106  -3.254
   86    HA   SER  34           HA       SER  34  -3.408   6.382  -0.588
   87   1HB   SER  34          1HB       SER  34  -3.412   8.497  -2.776
   88   2HB   SER  34          2HB       SER  34  -2.335   8.437  -1.368
   89    HG   SER  34           HG       SER  34  -1.473   7.572  -3.410
   90    H    SER  35           H        SER  35  -6.287   7.718  -2.038
   91    HA   SER  35           HA       SER  35  -6.776   9.685   0.114
   92   1HB   SER  35          1HB       SER  35  -8.767  10.221  -1.291
   93   2HB   SER  35          2HB       SER  35  -7.229  10.376  -2.153
   94    HG   SER  35           HG       SER  35  -8.830   9.239  -3.373
   95    H    GLN  36           H        GLN  36  -7.295   6.374  -0.238
   96    HA   GLN  36           HA       GLN  36  -9.893   6.373   1.244
   97   1HB   GLN  36          1HB       GLN  36  -9.485   5.139  -1.036
   98   2HB   GLN  36          2HB       GLN  36  -8.569   3.993  -0.064
   99   1HG   GLN  36          1HG       GLN  36 -10.688   3.020  -0.140
  100   2HG   GLN  36          2HG       GLN  36 -10.748   3.848   1.408
  101   1HE2  GLN  36          2HE2      GLN  36 -12.075   3.639  -1.848
  102   2HE2  GLN  36          1HE2      GLN  36 -13.273   4.913  -1.626
  103    H    CYS  37           H        CYS  37  -6.616   4.962   1.248
  104    HA   CYS  37           HA       CYS  37  -6.520   4.942   4.185
  105   1HB   CYS  37          1HB       CYS  37  -6.160   2.453   2.466
  106   2HB   CYS  37          2HB       CYS  37  -5.322   2.627   3.989
  107    H    ARG  38           H        ARG  38  -4.177   4.285   4.816
  108    HA   ARG  38           HA       ARG  38  -2.343   6.210   3.857
  109   1HB   ARG  38          1HB       ARG  38  -1.843   3.594   5.354
  110   2HB   ARG  38          2HB       ARG  38  -0.604   4.787   5.003
  111   1HG   ARG  38          1HG       ARG  38  -1.165   5.175   7.195
  112   2HG   ARG  38          2HG       ARG  38  -1.899   6.504   6.315
  113   1HD   ARG  38          1HD       ARG  38  -3.486   4.024   7.080
  114   2HD   ARG  38          2HD       ARG  38  -3.169   5.301   8.259
  115    HE   ARG  38           HE       ARG  38  -4.205   6.669   6.088
  116   1HH1  ARG  38          1HH2      ARG  38  -5.428   4.213   8.268
  117   2HH1  ARG  38          2HH2      ARG  38  -7.085   4.688   8.020
  118   1HH2  ARG  38          1HH1      ARG  38  -6.343   7.270   5.879
  119   2HH2  ARG  38          2HH1      ARG  38  -7.576   6.375   6.712
  120    H    ALA  39           H        ALA  39  -2.703   2.842   2.775
  121    HA   ALA  39           HA       ALA  39  -1.489   3.502   0.232
  122   1HB   ALA  39          1HB       ALA  39   0.561   3.061   1.577
  123   2HB   ALA  39          2HB       ALA  39  -0.114   1.493   2.082
  124   3HB   ALA  39          3HB       ALA  39   0.322   1.769   0.390
  125    HA   PRO  40           HA       PRO  40  -3.685  -0.428  -0.827
  126   1HB   PRO  40          2HB       PRO  40  -2.527  -1.043  -3.201
  127   2HB   PRO  40          1HB       PRO  40  -3.675   0.321  -3.040
  128   1HG   PRO  40          1HG       PRO  40  -0.641   0.428  -3.020
  129   2HG   PRO  40          2HG       PRO  40  -1.776   1.436  -3.975
  130   1HD   PRO  40          1HD       PRO  40  -0.689   2.258  -1.597
  131   2HD   PRO  40          2HD       PRO  40  -2.330   2.745  -2.110
  132    H    LYS  41           H        LYS  41  -2.953  -2.708  -1.237
  133    HA   LYS  41           HA       LYS  41  -1.214  -3.567   0.757
  134   1HB   LYS  41          1HB       LYS  41  -3.162  -4.771  -0.438
  135   2HB   LYS  41          2HB       LYS  41  -2.005  -5.218  -1.677
  136   1HG   LYS  41          1HG       LYS  41  -2.404  -7.037  -0.102
  137   2HG   LYS  41          2HG       LYS  41  -0.718  -6.538  -0.022
  138   1HD   LYS  41          1HD       LYS  41  -1.136  -5.310   2.065
  139   2HD   LYS  41          2HD       LYS  41  -2.883  -5.628   1.926
  140   1HE   LYS  41          1HE       LYS  41  -2.483  -8.036   2.171
  141   2HE   LYS  41          2HE       LYS  41  -0.736  -7.763   2.247
  142   1HZ   LYS  41          1HZ       LYS  41  -2.683  -6.651   4.207
  143   2HZ   LYS  41          2HZ       LYS  41  -1.756  -7.975   4.471
  144   3HZ   LYS  41          3HZ       LYS  41  -1.064  -6.507   4.292
  145    H    VAL  42           H        VAL  42  -0.151  -2.563  -2.292
  146    HA   VAL  42           HA       VAL  42   2.357  -3.859  -2.620
  147    HB   VAL  42           HB       VAL  42   1.614  -0.939  -3.083
  148   1HG1  VAL  42          3HG1      VAL  42   3.858  -2.618  -4.279
  149   2HG1  VAL  42          1HG1      VAL  42   3.383  -0.999  -4.837
  150   3HG1  VAL  42          2HG1      VAL  42   4.042  -1.204  -3.217
  151   1HG2  VAL  42          2HG2      VAL  42   1.471  -3.339  -4.963
  152   2HG2  VAL  42          3HG2      VAL  42   0.087  -2.427  -4.320
  153   3HG2  VAL  42          1HG2      VAL  42   1.206  -1.643  -5.430
  154    H    CYS  43           H        CYS  43   1.331  -1.444  -0.265
  155    HA   CYS  43           HA       CYS  43   3.883  -1.615   1.221
  156   1HB   CYS  43          1HB       CYS  43   3.968   0.217  -0.535
  157   2HB   CYS  43          2HB       CYS  43   2.637   1.017   0.310
  158    H    PHE  44           H        PHE  44   3.276   0.430   2.939
  159    HA   PHE  44           HA       PHE  44   0.535   0.139   4.042
  160   1HB   PHE  44          1HB       PHE  44   1.286  -0.151   6.278
  161   2HB   PHE  44          2HB       PHE  44   2.085  -1.380   5.315
  162    HD1  PHE  44           HD1      PHE  44   2.517   1.496   7.511
  163    HD2  PHE  44           HD2      PHE  44   4.559  -1.052   4.691
  164    HE1  PHE  44           HE1      PHE  44   4.702   2.298   8.367
  165    HE2  PHE  44           HE2      PHE  44   6.742  -0.240   5.545
  166    HZ   PHE  44           HZ       PHE  44   6.822   1.435   7.380
  167    H    LYS  45           H        LYS  45   3.120   2.156   3.096
  168    HA   LYS  45           HA       LYS  45   1.864   4.633   4.101
  169   1HB   LYS  45          1HB       LYS  45   3.114   3.847   6.061
  170   2HB   LYS  45          2HB       LYS  45   4.560   3.605   5.087
  171   1HG   LYS  45          1HG       LYS  45   4.647   6.106   4.695
  172   2HG   LYS  45          2HG       LYS  45   3.219   6.271   5.724
  173   1HD   LYS  45          1HD       LYS  45   5.200   6.789   7.008
  174   2HD   LYS  45          2HD       LYS  45   4.510   5.279   7.624
  175   1HE   LYS  45          1HE       LYS  45   6.194   3.976   6.346
  176   2HE   LYS  45          2HE       LYS  45   6.832   5.465   5.640
  177   1HZ   LYS  45          2HZ       LYS  45   6.881   4.805   8.541
  178   2HZ   LYS  45          3HZ       LYS  45   8.164   4.732   7.535
  179   3HZ   LYS  45          1HZ       LYS  45   7.482   6.173   7.879
  180    H    CYS  46           H        CYS  46   5.094   3.558   2.982
  181    HA   CYS  46           HA       CYS  46   5.670   5.989   1.719
  182   1HB   CYS  46          1HB       CYS  46   7.478   3.999   0.776
  183   2HB   CYS  46          2HB       CYS  46   7.707   5.203   2.024
  184    H    LYS  47           H        LYS  47   4.596   2.944   0.308
  185    HA   LYS  47           HA       LYS  47   4.032   2.275  -1.811
  186   1HB   LYS  47          1HB       LYS  47   2.002   3.402  -2.534
  187   2HB   LYS  47          2HB       LYS  47   2.074   3.171  -0.793
  188   1HG   LYS  47          1HG       LYS  47   2.743   5.542  -0.496
  189   2HG   LYS  47          2HG       LYS  47   2.631   5.799  -2.239
  190   1HD   LYS  47          1HD       LYS  47   0.258   5.411  -2.210
  191   2HD   LYS  47          2HD       LYS  47   0.292   4.805  -0.547
  192   1HE   LYS  47          1HE       LYS  47   1.146   7.631  -1.297
  193   2HE   LYS  47          2HE       LYS  47  -0.519   7.212  -0.878
  194   1HZ   LYS  47          3HZ       LYS  47   1.775   6.727   0.956
  195   2HZ   LYS  47          1HZ       LYS  47   0.756   8.010   1.058
  196   3HZ   LYS  47          2HZ       LYS  47   0.202   6.484   1.283
  197    H    GLN  48           H        GLN  48   6.503   3.954  -2.093
  198    HA   GLN  48           HA       GLN  48   6.298   5.294  -4.625
  199   1HB   GLN  48          1HB       GLN  48   8.747   4.139  -3.233
  200   2HB   GLN  48          2HB       GLN  48   8.786   5.249  -4.596
  201   1HG   GLN  48          1HG       GLN  48   7.785   5.839  -1.784
  202   2HG   GLN  48          2HG       GLN  48   9.229   6.464  -2.555
  203   1HE2  GLN  48          2HE2      GLN  48   5.898   7.074  -1.981
  204   2HE2  GLN  48          1HE2      GLN  48   5.748   8.440  -3.094
  205    HA   PRO  49           HA       PRO  49   5.970   2.326  -7.671
  206   1HB   PRO  49          2HB       PRO  49   8.447   3.412  -9.026
  207   2HB   PRO  49          1HB       PRO  49   6.856   3.009  -9.748
  208   1HG   PRO  49          1HG       PRO  49   7.436   5.569  -9.138
  209   2HG   PRO  49          2HG       PRO  49   5.826   4.901  -8.712
  210   1HD   PRO  49          1HD       PRO  49   8.221   5.326  -6.928
  211   2HD   PRO  49          2HD       PRO  49   6.491   5.637  -6.616
  212    H    GLY  50           H        GLY  50   9.224   2.128  -6.309
  213   1HA   GLY  50          2HA       GLY  50  10.564   0.143  -7.487
  214   2HA   GLY  50          1HA       GLY  50   9.233  -0.807  -6.826
  215    H    HIS  51           H        HIS  51   9.482   1.370  -4.463
  216    HA   HIS  51           HA       HIS  51  11.948   0.636  -3.140
  217   1HB   HIS  51          1HB       HIS  51  11.249   2.026  -1.422
  218   2HB   HIS  51          2HB       HIS  51  10.512   2.766  -2.831
  219    HD1  HIS  51           HD1      HIS  51   7.680   1.705  -3.080
  220    HD2  HIS  51           HD2      HIS  51   9.757   1.587   0.588
  221    HE1  HIS  51           HE1      HIS  51   5.970   1.129  -1.293
  222    H    PHE  52           H        PHE  52   8.724  -0.782  -3.170
  223    HA   PHE  52           HA       PHE  52   8.730  -1.922  -0.599
  224   1HB   PHE  52          1HB       PHE  52   6.866  -3.341  -1.469
  225   2HB   PHE  52          2HB       PHE  52   6.676  -1.615  -1.685
  226    HD1  PHE  52           HD1      PHE  52   6.683  -0.574  -3.912
  227    HD2  PHE  52           HD2      PHE  52   7.164  -4.838  -3.432
  228    HE1  PHE  52           HE1      PHE  52   6.243  -0.899  -6.326
  229    HE2  PHE  52           HE2      PHE  52   6.729  -5.153  -5.853
  230    HZ   PHE  52           HZ       PHE  52   6.272  -3.184  -7.307
  231    H    SER  53           H        SER  53   9.675  -3.502  -3.696
  232    HA   SER  53           HA       SER  53  10.361  -6.026  -2.690
  233   1HB   SER  53          1HB       SER  53  11.701  -4.510  -4.959
  234   2HB   SER  53          2HB       SER  53  11.704  -6.268  -4.719
  235    HG   SER  53           HG       SER  53  10.094  -5.614  -6.212
  236    H    LYS  54           H        LYS  54  11.903  -3.184  -1.768
  237    HA   LYS  54           HA       LYS  54  14.248  -4.650  -0.690
  238   1HB   LYS  54          1HB       LYS  54  15.756  -2.846  -1.352
  239   2HB   LYS  54          2HB       LYS  54  14.990  -3.590  -2.747
  240   1HG   LYS  54          1HG       LYS  54  13.390  -1.664  -2.894
  241   2HG   LYS  54          2HG       LYS  54  14.170  -0.935  -1.483
  242   1HD   LYS  54          1HD       LYS  54  15.096   0.175  -3.370
  243   2HD   LYS  54          2HD       LYS  54  16.337  -0.927  -2.790
  244   1HE   LYS  54          1HE       LYS  54  16.415  -1.212  -5.107
  245   2HE   LYS  54          2HE       LYS  54  15.481  -2.604  -4.566
  246   1HZ   LYS  54          1HZ       LYS  54  13.436  -1.318  -5.195
  247   2HZ   LYS  54          2HZ       LYS  54  14.379  -0.098  -5.732
  248   3HZ   LYS  54          3HZ       LYS  54  14.430  -1.547  -6.469
  249    H    GLN  55           H        GLN  55  11.601  -3.369   0.354
  250    HA   GLN  55           HA       GLN  55  12.828  -2.556   2.887
  251   1HB   GLN  55          1HB       GLN  55  12.675  -0.415   1.527
  252   2HB   GLN  55          2HB       GLN  55  10.920  -0.606   1.530
  253   1HG   GLN  55          1HG       GLN  55  11.040  -0.632   4.091
  254   2HG   GLN  55          2HG       GLN  55  12.755  -0.242   3.945
  255   1HE2  GLN  55          1HE2      GLN  55   9.455   0.928   3.506
  256   2HE2  GLN  55          2HE2      GLN  55   9.880   2.624   3.339
  257    H    CYS  56           H        CYS  56   9.643  -2.568   1.206
  258    HA   CYS  56           HA       CYS  56   8.306  -3.306   3.740
  259   1HB   CYS  56          1HB       CYS  56   7.202  -2.160   1.142
  260   2HB   CYS  56          2HB       CYS  56   6.317  -2.380   2.654
  261    H    ARG  57           H        ARG  57   9.321  -4.917   1.014
  262    HA   ARG  57           HA       ARG  57   7.657  -7.294   1.523
  263   1HB   ARG  57          1HB       ARG  57   6.735  -5.553  -0.329
  264   2HB   ARG  57          2HB       ARG  57   7.944  -6.307  -1.340
  265   1HG   ARG  57          1HG       ARG  57   5.682  -7.269  -1.612
  266   2HG   ARG  57          2HG       ARG  57   6.839  -8.490  -1.098
  267   1HD   ARG  57          1HD       ARG  57   4.592  -8.627   0.040
  268   2HD   ARG  57          2HD       ARG  57   5.959  -8.538   1.131
  269    HE   ARG  57           HE       ARG  57   5.390  -6.328   1.766
  270   1HH1  ARG  57          1HH1      ARG  57   3.085  -7.409  -0.672
  271   2HH1  ARG  57          2HH1      ARG  57   2.034  -6.040  -0.333
  272   1HH2  ARG  57          1HH2      ARG  57   3.955  -4.689   2.103
  273   2HH2  ARG  57          2HH2      ARG  57   2.494  -4.607   1.127
  274    H    SER  58           H        SER  58  10.548  -6.433   1.712
  275    HA   SER  58           HA       SER  58  12.308  -7.578  -0.097
  276   1HB   SER  58          1HB       SER  58  12.583  -7.563   2.929
  277   2HB   SER  58          2HB       SER  58  13.897  -7.680   1.743
  278    HG   SER  58           HG       SER  58  13.566  -5.514   2.508

  No H/Q in entry =         278
  Start of MODEL   29
    1    H1   GLN  22           H2       GLN  22  -7.668  -0.457  -7.220
    2    H2   GLN  22           H1       GLN  22  -6.910   0.726  -6.378
    3    H3   GLN  22           H3       GLN  22  -6.329   0.250  -7.847
    4    HA   GLN  22           HA       GLN  22  -5.764  -1.912  -7.002
    5   1HB   GLN  22          1HB       GLN  22  -4.651   0.271  -5.176
    6   2HB   GLN  22          2HB       GLN  22  -3.954  -1.324  -5.456
    7   1HG   GLN  22          1HG       GLN  22  -3.609  -0.752  -7.860
    8   2HG   GLN  22          2HG       GLN  22  -4.232   0.872  -7.543
    9   1HE2  GLN  22          2HE2      GLN  22  -2.414   2.207  -7.704
   10   2HE2  GLN  22          1HE2      GLN  22  -0.930   1.900  -6.810
   11    H    THR  23           H        THR  23  -5.007  -2.483  -4.336
   12    HA   THR  23           HA       THR  23  -7.649  -2.933  -2.998
   13    HB   THR  23           HB       THR  23  -5.315  -4.852  -3.352
   14    HG1  THR  23           HG1      THR  23  -6.734  -5.940  -4.701
   15   1HG2  THR  23          3HG2      THR  23  -6.546  -5.312  -1.238
   16   2HG2  THR  23          1HG2      THR  23  -8.071  -5.375  -2.153
   17   3HG2  THR  23          2HG2      THR  23  -6.800  -6.579  -2.439
   18    H    CYS  24           H        CYS  24  -7.669  -2.717  -0.778
   19    HA   CYS  24           HA       CYS  24  -5.823  -0.974   0.405
   20   1HB   CYS  24          1HB       CYS  24  -8.270  -1.509   1.015
   21   2HB   CYS  24          2HB       CYS  24  -7.629  -2.877   1.930
   22    H    TYR  25           H        TYR  25  -4.225  -1.135   1.974
   23    HA   TYR  25           HA       TYR  25  -2.785  -3.627   2.329
   24   1HB   TYR  25          1HB       TYR  25  -1.245  -2.465   3.504
   25   2HB   TYR  25          2HB       TYR  25  -1.854  -1.208   2.457
   26    HD1  TYR  25           HD1      TYR  25  -0.731  -1.829   5.642
   27    HD2  TYR  25           HD2      TYR  25  -4.096   0.051   3.696
   28    HE1  TYR  25           HE1      TYR  25  -1.124  -0.423   7.661
   29    HE2  TYR  25           HE2      TYR  25  -4.492   1.432   5.714
   30    HH   TYR  25           HH       TYR  25  -3.826   1.915   7.844
   31    H    ASN  26           H        ASN  26  -5.533  -2.267   3.956
   32    HA   ASN  26           HA       ASN  26  -5.231  -4.209   6.232
   33   1HB   ASN  26          1HB       ASN  26  -4.454  -1.969   6.847
   34   2HB   ASN  26          2HB       ASN  26  -5.964  -1.250   6.287
   35   1HD2  ASN  26          1HD2      ASN  26  -7.635  -1.079   7.785
   36   2HD2  ASN  26          2HD2      ASN  26  -7.598  -1.864   9.354
   37    H    CYS  27           H        CYS  27  -7.644  -2.223   4.396
   38    HA   CYS  27           HA       CYS  27  -9.912  -3.296   5.756
   39   1HB   CYS  27          1HB       CYS  27  -9.732  -1.988   3.006
   40   2HB   CYS  27          2HB       CYS  27 -11.188  -2.184   3.984
   41    H    GLY  28           H        GLY  28  -7.958  -4.747   3.313
   42   1HA   GLY  28          2HA       GLY  28  -9.483  -7.138   3.007
   43   2HA   GLY  28          1HA       GLY  28  -8.170  -6.593   1.954
   44    H    LYS  29           H        LYS  29  -9.577  -4.097   1.203
   45    HA   LYS  29           HA       LYS  29 -11.910  -5.078  -0.404
   46   1HB   LYS  29          1HB       LYS  29 -11.212  -2.326   0.689
   47   2HB   LYS  29          2HB       LYS  29 -12.551  -2.621  -0.404
   48   1HG   LYS  29          1HG       LYS  29 -12.316  -3.606   2.453
   49   2HG   LYS  29          2HG       LYS  29 -13.288  -2.285   1.854
   50   1HD   LYS  29          1HD       LYS  29 -14.910  -3.884   1.990
   51   2HD   LYS  29          2HD       LYS  29 -14.424  -4.078   0.315
   52   1HE   LYS  29          1HE       LYS  29 -14.693  -6.254   1.310
   53   2HE   LYS  29          2HE       LYS  29 -12.979  -6.019   0.988
   54   1HZ   LYS  29          3HZ       LYS  29 -14.264  -5.640   3.643
   55   2HZ   LYS  29          1HZ       LYS  29 -13.395  -6.951   3.206
   56   3HZ   LYS  29          2HZ       LYS  29 -12.656  -5.504   3.350
   57    HA   PRO  30           HA       PRO  30  -9.758  -3.330  -4.066
   58   1HB   PRO  30          2HB       PRO  30 -11.795  -3.417  -5.847
   59   2HB   PRO  30          1HB       PRO  30 -11.024  -4.913  -5.252
   60   1HG   PRO  30          1HG       PRO  30 -13.576  -3.615  -4.239
   61   2HG   PRO  30          2HG       PRO  30 -13.328  -5.321  -4.732
   62   1HD   PRO  30          1HD       PRO  30 -13.172  -4.469  -2.127
   63   2HD   PRO  30          2HD       PRO  30 -12.180  -5.822  -2.750
   64    H    GLY  31           H        GLY  31 -10.894  -1.477  -5.729
   65   1HA   GLY  31          2HA       GLY  31 -12.606   0.488  -4.572
   66   2HA   GLY  31          1HA       GLY  31 -11.498   0.745  -5.927
   67    H    HIS  32           H        HIS  32  -9.119   0.036  -4.323
   68    HA   HIS  32           HA       HIS  32  -8.973   2.285  -2.370
   69   1HB   HIS  32          1HB       HIS  32  -8.152  -0.583  -2.274
   70   2HB   HIS  32          2HB       HIS  32  -7.035   0.573  -1.557
   71    HD1  HIS  32           HD1      HIS  32 -10.775  -0.413  -1.180
   72    HD2  HIS  32           HD2      HIS  32  -7.587   1.502   0.788
   73    HE1  HIS  32           HE1      HIS  32 -11.579   0.076   1.208
   74    H    LEU  33           H        LEU  33  -7.161   3.415  -2.106
   75    HA   LEU  33           HA       LEU  33  -4.969   3.514  -4.056
   76   1HB   LEU  33          1HB       LEU  33  -7.223   5.584  -3.849
   77   2HB   LEU  33          2HB       LEU  33  -5.682   5.925  -4.616
   78    HG   LEU  33           HG       LEU  33  -7.691   3.872  -5.616
   79   1HD1  LEU  33          1HD1      LEU  33  -8.463   6.187  -5.850
   80   2HD1  LEU  33          2HD1      LEU  33  -6.938   6.629  -6.649
   81   3HD1  LEU  33          3HD1      LEU  33  -8.056   5.481  -7.424
   82   1HD2  LEU  33          2HD2      LEU  33  -5.085   4.909  -6.831
   83   2HD2  LEU  33          3HD2      LEU  33  -5.373   3.255  -6.245
   84   3HD2  LEU  33          1HD2      LEU  33  -6.262   3.858  -7.649
   85    H    SER  34           H        SER  34  -3.602   5.459  -3.537
   86    HA   SER  34           HA       SER  34  -2.831   5.923  -0.903
   87   1HB   SER  34          1HB       SER  34  -2.735   7.899  -3.214
   88   2HB   SER  34          2HB       SER  34  -1.635   7.835  -1.827
   89    HG   SER  34           HG       SER  34  -0.806   6.838  -3.775
   90    H    SER  35           H        SER  35  -5.639   7.254  -2.480
   91    HA   SER  35           HA       SER  35  -6.043   9.393  -0.464
   92   1HB   SER  35          1HB       SER  35  -7.856  10.074  -2.035
   93   2HB   SER  35          2HB       SER  35  -6.249  10.044  -2.780
   94    HG   SER  35           HG       SER  35  -7.860   9.026  -4.090
   95    H    GLN  36           H        GLN  36  -6.994   6.137  -0.936
   96    HA   GLN  36           HA       GLN  36  -9.635   6.452   0.397
   97   1HB   GLN  36          1HB       GLN  36  -9.216   4.946  -1.649
   98   2HB   GLN  36          2HB       GLN  36  -8.284   3.911  -0.568
   99   1HG   GLN  36          1HG       GLN  36 -10.426   2.937  -0.667
  100   2HG   GLN  36          2HG       GLN  36 -10.402   3.747   0.891
  101   1HE2  GLN  36          2HE2      GLN  36 -11.858   3.625  -2.320
  102   2HE2  GLN  36          1HE2      GLN  36 -13.081   4.853  -1.993
  103    H    CYS  37           H        CYS  37  -6.443   4.948   0.879
  104    HA   CYS  37           HA       CYS  37  -6.706   5.040   3.821
  105   1HB   CYS  37          1HB       CYS  37  -6.236   2.534   2.156
  106   2HB   CYS  37          2HB       CYS  37  -5.582   2.664   3.781
  107    H    ARG  38           H        ARG  38  -4.571   4.409   4.803
  108    HA   ARG  38           HA       ARG  38  -2.461   6.131   4.100
  109   1HB   ARG  38          1HB       ARG  38  -2.662   3.649   5.827
  110   2HB   ARG  38          2HB       ARG  38  -1.106   4.452   5.604
  111   1HG   ARG  38          1HG       ARG  38  -1.795   6.460   6.578
  112   2HG   ARG  38          2HG       ARG  38  -3.514   6.096   6.444
  113   1HD   ARG  38          1HD       ARG  38  -1.735   4.341   8.158
  114   2HD   ARG  38          2HD       ARG  38  -2.282   5.918   8.758
  115    HE   ARG  38           HE       ARG  38  -4.575   4.606   7.779
  116   1HH1  ARG  38          2HH1      ARG  38  -2.343   4.173  10.442
  117   2HH1  ARG  38          1HH1      ARG  38  -3.571   3.498  11.479
  118   1HH2  ARG  38          1HH2      ARG  38  -6.086   3.721   9.145
  119   2HH2  ARG  38          2HH2      ARG  38  -5.629   3.244  10.751
  120    H    ALA  39           H        ALA  39  -2.872   2.779   3.000
  121    HA   ALA  39           HA       ALA  39  -1.439   3.452   0.606
  122   1HB   ALA  39          3HB       ALA  39   0.521   2.876   2.040
  123   2HB   ALA  39          1HB       ALA  39  -0.235   1.311   2.427
  124   3HB   ALA  39          2HB       ALA  39   0.300   1.658   0.777
  125    HA   PRO  40           HA       PRO  40  -3.687  -0.378  -0.677
  126   1HB   PRO  40          2HB       PRO  40  -2.477  -0.918  -3.049
  127   2HB   PRO  40          1HB       PRO  40  -3.621   0.445  -2.857
  128   1HG   PRO  40          1HG       PRO  40  -0.589   0.535  -2.790
  129   2HG   PRO  40          2HG       PRO  40  -1.709   1.597  -3.701
  130   1HD   PRO  40          1HD       PRO  40  -0.627   2.274  -1.265
  131   2HD   PRO  40          2HD       PRO  40  -2.240   2.835  -1.791
  132    H    LYS  41           H        LYS  41  -2.986  -2.653  -1.104
  133    HA   LYS  41           HA       LYS  41  -1.289  -3.667   0.858
  134   1HB   LYS  41          1HB       LYS  41  -3.176  -4.832  -0.353
  135   2HB   LYS  41          2HB       LYS  41  -2.125  -5.015  -1.745
  136   1HG   LYS  41          1HG       LYS  41  -2.227  -7.104  -0.574
  137   2HG   LYS  41          2HG       LYS  41  -0.609  -6.470  -0.421
  138   1HD   LYS  41          1HD       LYS  41  -1.140  -7.370   1.690
  139   2HD   LYS  41          2HD       LYS  41  -1.282  -5.628   1.926
  140   1HE   LYS  41          1HE       LYS  41  -3.770  -5.828   1.607
  141   2HE   LYS  41          2HE       LYS  41  -3.578  -7.564   1.355
  142   1HZ   LYS  41          1HZ       LYS  41  -2.654  -7.687   3.645
  143   2HZ   LYS  41          2HZ       LYS  41  -3.000  -6.098   3.881
  144   3HZ   LYS  41          3HZ       LYS  41  -4.198  -7.171   3.626
  145    H    VAL  42           H        VAL  42  -0.205  -2.529  -2.181
  146    HA   VAL  42           HA       VAL  42   2.316  -3.747  -2.545
  147    HB   VAL  42           HB       VAL  42   1.549  -0.816  -2.881
  148   1HG1  VAL  42          2HG1      VAL  42   3.760  -2.446  -4.198
  149   2HG1  VAL  42          3HG1      VAL  42   3.282  -0.801  -4.667
  150   3HG1  VAL  42          1HG1      VAL  42   3.977  -1.084  -3.074
  151   1HG2  VAL  42          1HG2      VAL  42   1.356  -3.143  -4.845
  152   2HG2  VAL  42          2HG2      VAL  42  -0.008  -2.236  -4.153
  153   3HG2  VAL  42          3HG2      VAL  42   1.102  -1.432  -5.253
  154    H    CYS  43           H        CYS  43   1.296  -1.435  -0.077
  155    HA   CYS  43           HA       CYS  43   3.864  -1.647   1.367
  156   1HB   CYS  43          1HB       CYS  43   3.943   0.223  -0.350
  157   2HB   CYS  43          2HB       CYS  43   2.632   1.015   0.535
  158    H    PHE  44           H        PHE  44   3.263   0.427   3.099
  159    HA   PHE  44           HA       PHE  44   0.569   0.055   4.275
  160   1HB   PHE  44          1HB       PHE  44   1.335  -0.332   6.465
  161   2HB   PHE  44          2HB       PHE  44   2.216  -1.468   5.462
  162    HD1  PHE  44           HD1      PHE  44   2.449   1.256   7.839
  163    HD2  PHE  44           HD2      PHE  44   4.671  -0.889   4.823
  164    HE1  PHE  44           HE1      PHE  44   4.570   2.177   8.744
  165    HE2  PHE  44           HE2      PHE  44   6.786   0.044   5.726
  166    HZ   PHE  44           HZ       PHE  44   6.740   1.580   7.683
  167    H    LYS  45           H        LYS  45   3.297   2.122   3.570
  168    HA   LYS  45           HA       LYS  45   1.796   4.521   4.402
  169   1HB   LYS  45          1HB       LYS  45   2.914   3.732   6.479
  170   2HB   LYS  45          2HB       LYS  45   4.483   3.820   5.676
  171   1HG   LYS  45          1HG       LYS  45   4.205   6.276   5.410
  172   2HG   LYS  45          2HG       LYS  45   2.590   6.172   6.142
  173   1HD   LYS  45          1HD       LYS  45   3.608   5.303   8.242
  174   2HD   LYS  45          2HD       LYS  45   5.221   5.424   7.503
  175   1HE   LYS  45          1HE       LYS  45   4.901   7.871   7.209
  176   2HE   LYS  45          2HE       LYS  45   3.288   7.752   7.927
  177   1HZ   LYS  45          3HZ       LYS  45   4.340   6.994   9.995
  178   2HZ   LYS  45          1HZ       LYS  45   5.830   7.108   9.333
  179   3HZ   LYS  45          2HZ       LYS  45   4.935   8.451   9.568
  180    H    CYS  46           H        CYS  46   5.163   3.573   3.435
  181    HA   CYS  46           HA       CYS  46   5.640   6.095   2.214
  182   1HB   CYS  46          1HB       CYS  46   7.736   4.670   1.372
  183   2HB   CYS  46          2HB       CYS  46   7.560   5.283   3.011
  184    H    LYS  47           H        LYS  47   4.687   3.021   0.785
  185    HA   LYS  47           HA       LYS  47   4.071   2.399  -1.335
  186   1HB   LYS  47          1HB       LYS  47   1.987   3.484  -1.914
  187   2HB   LYS  47          2HB       LYS  47   2.158   3.241  -0.182
  188   1HG   LYS  47          1HG       LYS  47   2.798   5.641   0.086
  189   2HG   LYS  47          2HG       LYS  47   2.545   5.892  -1.643
  190   1HD   LYS  47          1HD       LYS  47   0.201   5.373  -1.439
  191   2HD   LYS  47          2HD       LYS  47   0.388   4.799   0.221
  192   1HE   LYS  47          1HE       LYS  47   1.056   7.657  -0.584
  193   2HE   LYS  47          2HE       LYS  47  -0.580   7.170  -0.114
  194   1HZ   LYS  47          1HZ       LYS  47   1.790   6.790   1.645
  195   2HZ   LYS  47          2HZ       LYS  47   0.702   8.015   1.789
  196   3HZ   LYS  47          3HZ       LYS  47   0.242   6.454   2.014
  197    H    GLN  48           H        GLN  48   6.508   4.062  -1.714
  198    HA   GLN  48           HA       GLN  48   6.152   5.550  -4.142
  199   1HB   GLN  48          1HB       GLN  48   8.663   4.299  -2.961
  200   2HB   GLN  48          2HB       GLN  48   8.646   5.462  -4.278
  201   1HG   GLN  48          1HG       GLN  48   7.807   5.953  -1.397
  202   2HG   GLN  48          2HG       GLN  48   9.215   6.592  -2.222
  203   1HE2  GLN  48          2HE2      GLN  48   5.909   7.192  -1.469
  204   2HE2  GLN  48          1HE2      GLN  48   5.718   8.605  -2.513
  205    HA   PRO  49           HA       PRO  49   5.620   2.820  -7.375
  206   1HB   PRO  49          2HB       PRO  49   8.043   3.975  -8.772
  207   2HB   PRO  49          1HB       PRO  49   6.413   3.641  -9.442
  208   1HG   PRO  49          1HG       PRO  49   7.059   6.145  -8.677
  209   2HG   PRO  49          2HG       PRO  49   5.462   5.464  -8.220
  210   1HD   PRO  49          1HD       PRO  49   7.949   5.734  -6.534
  211   2HD   PRO  49          2HD       PRO  49   6.240   6.039  -6.113
  212    H    GLY  50           H        GLY  50   8.939   2.491  -6.205
  213   1HA   GLY  50          2HA       GLY  50  10.192   0.585  -7.585
  214   2HA   GLY  50          1HA       GLY  50   8.882  -0.399  -6.929
  215    H    HIS  51           H        HIS  51   9.269   1.593  -4.432
  216    HA   HIS  51           HA       HIS  51  11.791   0.760  -3.288
  217   1HB   HIS  51          1HB       HIS  51  11.180   2.022  -1.439
  218   2HB   HIS  51          2HB       HIS  51  10.389   2.864  -2.757
  219    HD1  HIS  51           HD1      HIS  51   7.540   1.832  -2.959
  220    HD2  HIS  51           HD2      HIS  51   9.773   1.438   0.596
  221    HE1  HIS  51           HE1      HIS  51   5.912   1.107  -1.156
  222    H    PHE  52           H        PHE  52   8.572  -0.662  -3.276
  223    HA   PHE  52           HA       PHE  52   8.660  -1.941  -0.779
  224   1HB   PHE  52          1HB       PHE  52   6.773  -3.310  -1.649
  225   2HB   PHE  52          2HB       PHE  52   6.579  -1.578  -1.805
  226    HD1  PHE  52           HD1      PHE  52   6.565  -0.462  -4.008
  227    HD2  PHE  52           HD2      PHE  52   6.972  -4.745  -3.654
  228    HE1  PHE  52           HE1      PHE  52   6.042  -0.714  -6.414
  229    HE2  PHE  52           HE2      PHE  52   6.453  -4.986  -6.068
  230    HZ   PHE  52           HZ       PHE  52   5.991  -2.972  -7.453
  231    H    SER  53           H        SER  53   9.504  -3.361  -3.978
  232    HA   SER  53           HA       SER  53  10.250  -5.924  -3.125
  233   1HB   SER  53          1HB       SER  53  11.490  -4.281  -5.364
  234   2HB   SER  53          2HB       SER  53  11.516  -6.051  -5.213
  235    HG   SER  53           HG       SER  53   9.847  -5.334  -6.613
  236    H    LYS  54           H        LYS  54  11.794  -3.121  -2.106
  237    HA   LYS  54           HA       LYS  54  14.189  -4.610  -1.193
  238   1HB   LYS  54          1HB       LYS  54  15.664  -2.769  -1.829
  239   2HB   LYS  54          2HB       LYS  54  14.855  -3.465  -3.226
  240   1HG   LYS  54          1HG       LYS  54  13.233  -1.543  -3.230
  241   2HG   LYS  54          2HG       LYS  54  14.081  -0.860  -1.836
  242   1HD   LYS  54          1HD       LYS  54  14.930   0.312  -3.717
  243   2HD   LYS  54          2HD       LYS  54  16.186  -0.829  -3.260
  244   1HE   LYS  54          1HE       LYS  54  16.133  -1.037  -5.580
  245   2HE   LYS  54          2HE       LYS  54  15.174  -2.417  -5.052
  246   1HZ   LYS  54          2HZ       LYS  54  13.150  -1.040  -5.523
  247   2HZ   LYS  54          3HZ       LYS  54  14.106   0.176  -6.046
  248   3HZ   LYS  54          1HZ       LYS  54  14.076  -1.235  -6.853
  249    H    GLN  55           H        GLN  55  11.579  -3.409   0.006
  250    HA   GLN  55           HA       GLN  55  12.897  -2.727   2.528
  251   1HB   GLN  55          1HB       GLN  55  12.671  -0.507   1.313
  252   2HB   GLN  55          2HB       GLN  55  10.920  -0.720   1.364
  253   1HG   GLN  55          1HG       GLN  55  11.137  -0.910   3.916
  254   2HG   GLN  55          2HG       GLN  55  12.837  -0.474   3.729
  255   1HE2  GLN  55          1HE2      GLN  55   9.505   0.652   3.540
  256   2HE2  GLN  55          2HE2      GLN  55   9.887   2.363   3.424
  257    H    CYS  56           H        CYS  56   9.622  -2.579   1.026
  258    HA   CYS  56           HA       CYS  56   8.423  -3.538   3.543
  259   1HB   CYS  56          1HB       CYS  56   7.204  -2.246   1.067
  260   2HB   CYS  56          2HB       CYS  56   6.356  -2.614   2.572
  261    H    ARG  57           H        ARG  57   9.331  -4.972   0.678
  262    HA   ARG  57           HA       ARG  57   7.712  -7.397   1.104
  263   1HB   ARG  57          1HB       ARG  57   6.695  -5.532  -0.575
  264   2HB   ARG  57          2HB       ARG  57   7.849  -6.217  -1.694
  265   1HG   ARG  57          1HG       ARG  57   5.579  -7.161  -1.921
  266   2HG   ARG  57          2HG       ARG  57   6.754  -8.414  -1.533
  267   1HD   ARG  57          1HD       ARG  57   4.555  -8.614  -0.308
  268   2HD   ARG  57          2HD       ARG  57   5.971  -8.601   0.723
  269    HE   ARG  57           HE       ARG  57   5.445  -6.443   1.530
  270   1HH1  ARG  57          2HH2      ARG  57   3.024  -7.330  -0.878
  271   2HH1  ARG  57          1HH2      ARG  57   2.001  -5.985  -0.387
  272   1HH2  ARG  57          2HH1      ARG  57   4.038  -4.826   2.049
  273   2HH2  ARG  57          1HH1      ARG  57   2.537  -4.665   1.147
  274    H    SER  58           H        SER  58  10.605  -6.531   1.211
  275    HA   SER  58           HA       SER  58  12.278  -7.514  -0.763
  276   1HB   SER  58          1HB       SER  58  12.704  -7.744   2.235
  277   2HB   SER  58          2HB       SER  58  13.959  -7.752   0.979
  278    HG   SER  58           HG       SER  58  13.646  -5.659   1.943

  No H/Q in entry =         278
  Start of MODEL   30
    1    H1   GLN  22           H2       GLN  22  -7.907  -0.570  -7.205
    2    H2   GLN  22           H1       GLN  22  -7.091   0.588  -6.377
    3    H3   GLN  22           H3       GLN  22  -6.572   0.112  -7.867
    4    HA   GLN  22           HA       GLN  22  -6.026  -2.069  -7.061
    5   1HB   GLN  22          1HB       GLN  22  -4.812   0.057  -5.234
    6   2HB   GLN  22          2HB       GLN  22  -4.157  -1.543  -5.579
    7   1HG   GLN  22          1HG       GLN  22  -3.874  -0.914  -7.975
    8   2HG   GLN  22          2HG       GLN  22  -4.465   0.710  -7.599
    9   1HE2  GLN  22          2HE2      GLN  22  -2.510   1.824  -8.110
   10   2HE2  GLN  22          1HE2      GLN  22  -1.058   1.583  -7.147
   11    H    THR  23           H        THR  23  -5.197  -2.658  -4.412
   12    HA   THR  23           HA       THR  23  -7.797  -3.046  -2.968
   13    HB   THR  23           HB       THR  23  -5.461  -4.967  -3.306
   14    HG1  THR  23           HG1      THR  23  -6.921  -6.121  -4.556
   15   1HG2  THR  23          2HG2      THR  23  -8.168  -5.429  -1.977
   16   2HG2  THR  23          3HG2      THR  23  -6.937  -6.666  -2.294
   17   3HG2  THR  23          1HG2      THR  23  -6.595  -5.374  -1.144
   18    H    CYS  24           H        CYS  24  -7.706  -2.959  -0.696
   19    HA   CYS  24           HA       CYS  24  -5.871  -1.094   0.374
   20   1HB   CYS  24          1HB       CYS  24  -8.283  -1.656   1.052
   21   2HB   CYS  24          2HB       CYS  24  -7.606  -3.012   1.959
   22    H    TYR  25           H        TYR  25  -4.282  -1.206   1.922
   23    HA   TYR  25           HA       TYR  25  -2.682  -3.607   2.304
   24   1HB   TYR  25          1HB       TYR  25  -1.229  -2.283   3.483
   25   2HB   TYR  25          2HB       TYR  25  -1.882  -1.145   2.321
   26    HD1  TYR  25           HD1      TYR  25  -0.855  -1.456   5.606
   27    HD2  TYR  25           HD2      TYR  25  -4.233   0.048   3.377
   28    HE1  TYR  25           HE1      TYR  25  -1.453   0.039   7.504
   29    HE2  TYR  25           HE2      TYR  25  -4.869   1.452   5.302
   30    HH   TYR  25           HH       TYR  25  -2.969   1.566   8.322
   31    H    ASN  26           H        ASN  26  -5.513  -2.394   3.874
   32    HA   ASN  26           HA       ASN  26  -5.065  -4.138   6.283
   33   1HB   ASN  26          1HB       ASN  26  -4.417  -1.839   6.779
   34   2HB   ASN  26          2HB       ASN  26  -5.934  -1.219   6.129
   35   1HD2  ASN  26          1HD2      ASN  26  -7.761  -1.174   7.485
   36   2HD2  ASN  26          2HD2      ASN  26  -7.704  -1.763   9.137
   37    H    CYS  27           H        CYS  27  -7.589  -2.266   4.485
   38    HA   CYS  27           HA       CYS  27  -9.790  -3.469   5.837
   39   1HB   CYS  27          1HB       CYS  27  -9.710  -2.126   3.098
   40   2HB   CYS  27          2HB       CYS  27 -11.124  -2.342   4.132
   41    H    GLY  28           H        GLY  28  -7.850  -4.621   3.192
   42   1HA   GLY  28          2HA       GLY  28  -9.258  -7.108   2.805
   43   2HA   GLY  28          1HA       GLY  28  -7.924  -6.478   1.836
   44    H    LYS  29           H        LYS  29 -10.192  -4.073   1.728
   45    HA   LYS  29           HA       LYS  29 -12.057  -5.168  -0.256
   46   1HB   LYS  29          1HB       LYS  29 -11.679  -2.548   1.203
   47   2HB   LYS  29          2HB       LYS  29 -12.496  -2.497  -0.343
   48   1HG   LYS  29          1HG       LYS  29 -14.137  -2.578   1.322
   49   2HG   LYS  29          2HG       LYS  29 -14.209  -4.085   0.421
   50   1HD   LYS  29          1HD       LYS  29 -12.705  -3.882   3.057
   51   2HD   LYS  29          2HD       LYS  29 -14.458  -4.077   3.020
   52   1HE   LYS  29          1HE       LYS  29 -14.299  -6.162   1.780
   53   2HE   LYS  29          2HE       LYS  29 -12.545  -6.000   1.645
   54   1HZ   LYS  29          3HZ       LYS  29 -14.006  -6.291   4.211
   55   2HZ   LYS  29          1HZ       LYS  29 -13.151  -7.473   3.476
   56   3HZ   LYS  29          2HZ       LYS  29 -12.380  -6.145   4.048
   57    HA   PRO  30           HA       PRO  30  -9.870  -3.468  -3.909
   58   1HB   PRO  30          2HB       PRO  30 -11.874  -3.572  -5.723
   59   2HB   PRO  30          1HB       PRO  30 -11.139  -5.063  -5.071
   60   1HG   PRO  30          1HG       PRO  30 -13.688  -3.696  -4.142
   61   2HG   PRO  30          2HG       PRO  30 -13.458  -5.418  -4.585
   62   1HD   PRO  30          1HD       PRO  30 -13.335  -4.502  -2.000
   63   2HD   PRO  30          2HD       PRO  30 -12.353  -5.885  -2.572
   64    H    GLY  31           H        GLY  31 -10.974  -1.648  -5.644
   65   1HA   GLY  31          2HA       GLY  31 -12.663   0.379  -4.570
   66   2HA   GLY  31          1HA       GLY  31 -11.532   0.576  -5.916
   67    H    HIS  32           H        HIS  32  -9.200  -0.136  -4.240
   68    HA   HIS  32           HA       HIS  32  -9.034   2.164  -2.350
   69   1HB   HIS  32          1HB       HIS  32  -8.200  -0.698  -2.215
   70   2HB   HIS  32          2HB       HIS  32  -7.081   0.472  -1.531
   71    HD1  HIS  32           HD1      HIS  32 -10.801  -0.553  -1.065
   72    HD2  HIS  32           HD2      HIS  32  -7.595   1.416   0.808
   73    HE1  HIS  32           HE1      HIS  32 -11.545  -0.076   1.342
   74    H    LEU  33           H        LEU  33  -7.168   3.261  -2.093
   75    HA   LEU  33           HA       LEU  33  -5.024   3.317  -4.094
   76   1HB   LEU  33          1HB       LEU  33  -7.193   5.468  -3.808
   77   2HB   LEU  33          2HB       LEU  33  -5.660   5.755  -4.613
   78    HG   LEU  33           HG       LEU  33  -7.769   3.788  -5.579
   79   1HD1  LEU  33          2HD1      LEU  33  -8.456   6.138  -5.774
   80   2HD1  LEU  33          3HD1      LEU  33  -6.937   6.525  -6.612
   81   3HD1  LEU  33          1HD1      LEU  33  -8.120   5.429  -7.362
   82   1HD2  LEU  33          1HD2      LEU  33  -5.162   4.741  -6.856
   83   2HD2  LEU  33          2HD2      LEU  33  -5.490   3.095  -6.275
   84   3HD2  LEU  33          3HD2      LEU  33  -6.397   3.739  -7.648
   85    H    SER  34           H        SER  34  -3.608   5.224  -3.599
   86    HA   SER  34           HA       SER  34  -2.691   5.540  -0.992
   87   1HB   SER  34          1HB       SER  34  -2.527   7.534  -3.283
   88   2HB   SER  34          2HB       SER  34  -1.386   7.371  -1.938
   89    HG   SER  34           HG       SER  34  -0.716   6.310  -3.915
   90    H    SER  35           H        SER  35  -5.593   6.888  -2.132
   91    HA   SER  35           HA       SER  35  -5.697   8.959   0.020
   92   1HB   SER  35          1HB       SER  35  -7.366  10.074  -1.436
   93   2HB   SER  35          2HB       SER  35  -5.771   9.937  -2.198
   94    HG   SER  35           HG       SER  35  -7.490   9.321  -3.618
   95    H    GLN  36           H        GLN  36  -7.055   5.956  -1.008
   96    HA   GLN  36           HA       GLN  36  -9.620   6.288   0.416
   97   1HB   GLN  36          1HB       GLN  36  -9.200   4.805  -1.664
   98   2HB   GLN  36          2HB       GLN  36  -8.327   3.725  -0.576
   99   1HG   GLN  36          1HG       GLN  36 -10.503   2.820  -0.732
  100   2HG   GLN  36          2HG       GLN  36 -10.491   3.616   0.832
  101   1HE2  GLN  36          2HE2      GLN  36 -11.870   3.577  -2.416
  102   2HE2  GLN  36          1HE2      GLN  36 -13.047   4.855  -2.111
  103    H    CYS  37           H        CYS  37  -6.424   4.871   0.896
  104    HA   CYS  37           HA       CYS  37  -6.720   4.880   3.816
  105   1HB   CYS  37          1HB       CYS  37  -6.298   2.440   2.106
  106   2HB   CYS  37          2HB       CYS  37  -5.317   2.565   3.541
  107    H    ARG  38           H        ARG  38  -4.439   4.303   4.765
  108    HA   ARG  38           HA       ARG  38  -2.556   6.291   4.010
  109   1HB   ARG  38          1HB       ARG  38  -2.267   3.755   5.685
  110   2HB   ARG  38          2HB       ARG  38  -0.923   4.827   5.352
  111   1HG   ARG  38          1HG       ARG  38  -1.472   5.744   7.281
  112   2HG   ARG  38          2HG       ARG  38  -2.533   6.730   6.294
  113   1HD   ARG  38          1HD       ARG  38  -3.444   4.180   7.705
  114   2HD   ARG  38          2HD       ARG  38  -3.387   5.728   8.515
  115    HE   ARG  38           HE       ARG  38  -5.037   6.633   7.002
  116   1HH1  ARG  38          2HH1      ARG  38  -4.927   3.102   7.027
  117   2HH1  ARG  38          1HH1      ARG  38  -6.511   3.009   6.282
  118   1HH2  ARG  38          1HH2      ARG  38  -7.130   6.359   6.320
  119   2HH2  ARG  38          2HH2      ARG  38  -7.723   4.758   5.987
  120    H    ALA  39           H        ALA  39  -2.785   2.964   2.859
  121    HA   ALA  39           HA       ALA  39  -1.414   3.738   0.443
  122   1HB   ALA  39          2HB       ALA  39   0.560   3.139   1.859
  123   2HB   ALA  39          3HB       ALA  39  -0.185   1.559   2.202
  124   3HB   ALA  39          1HB       ALA  39   0.337   1.956   0.558
  125    HA   PRO  40           HA       PRO  40  -3.756  -0.039  -0.856
  126   1HB   PRO  40          2HB       PRO  40  -2.624  -0.567  -3.260
  127   2HB   PRO  40          1HB       PRO  40  -3.711   0.833  -3.023
  128   1HG   PRO  40          1HG       PRO  40  -0.678   0.812  -3.013
  129   2HG   PRO  40          2HG       PRO  40  -1.772   1.924  -3.894
  130   1HD   PRO  40          1HD       PRO  40  -0.629   2.533  -1.465
  131   2HD   PRO  40          2HD       PRO  40  -2.231   3.153  -1.955
  132    H    LYS  41           H        LYS  41  -3.098  -2.304  -1.408
  133    HA   LYS  41           HA       LYS  41  -1.502  -3.474   0.513
  134   1HB   LYS  41          1HB       LYS  41  -3.351  -4.465  -0.875
  135   2HB   LYS  41          2HB       LYS  41  -2.206  -4.669  -2.199
  136   1HG   LYS  41          1HG       LYS  41  -0.888  -6.244  -0.861
  137   2HG   LYS  41          2HG       LYS  41  -1.889  -5.910   0.570
  138   1HD   LYS  41          1HD       LYS  41  -3.859  -6.884  -0.560
  139   2HD   LYS  41          2HD       LYS  41  -2.928  -7.085  -2.047
  140   1HE   LYS  41          1HE       LYS  41  -3.058  -9.227  -0.999
  141   2HE   LYS  41          2HE       LYS  41  -1.392  -8.663  -0.887
  142   1HZ   LYS  41          2HZ       LYS  41  -3.392  -8.525   1.315
  143   2HZ   LYS  41          3HZ       LYS  41  -2.187  -9.618   1.211
  144   3HZ   LYS  41          1HZ       LYS  41  -1.831  -8.044   1.434
  145    H    VAL  42           H        VAL  42  -0.242  -2.178  -2.404
  146    HA   VAL  42           HA       VAL  42   2.249  -3.489  -2.726
  147    HB   VAL  42           HB       VAL  42   1.578  -0.532  -3.033
  148   1HG1  VAL  42          1HG1      VAL  42   3.801  -2.193  -4.284
  149   2HG1  VAL  42          2HG1      VAL  42   3.385  -0.530  -4.746
  150   3HG1  VAL  42          3HG1      VAL  42   4.008  -0.854  -3.131
  151   1HG2  VAL  42          2HG2      VAL  42   1.425  -2.818  -5.051
  152   2HG2  VAL  42          3HG2      VAL  42   0.047  -1.907  -4.392
  153   3HG2  VAL  42          1HG2      VAL  42   1.211  -1.096  -5.429
  154    H    CYS  43           H        CYS  43   1.223  -1.189  -0.242
  155    HA   CYS  43           HA       CYS  43   3.750  -1.492   1.260
  156   1HB   CYS  43          1HB       CYS  43   3.939   0.385  -0.443
  157   2HB   CYS  43          2HB       CYS  43   2.645   1.223   0.420
  158    H    PHE  44           H        PHE  44   3.190   0.594   2.992
  159    HA   PHE  44           HA       PHE  44   0.468   0.320   4.126
  160   1HB   PHE  44          1HB       PHE  44   1.207  -0.164   6.328
  161   2HB   PHE  44          2HB       PHE  44   1.949  -1.356   5.276
  162    HD1  PHE  44           HD1      PHE  44   2.511   1.278   7.710
  163    HD2  PHE  44           HD2      PHE  44   4.437  -1.054   4.633
  164    HE1  PHE  44           HE1      PHE  44   4.733   1.926   8.607
  165    HE2  PHE  44           HE2      PHE  44   6.655  -0.399   5.531
  166    HZ   PHE  44           HZ       PHE  44   6.809   1.095   7.512
  167    H    LYS  45           H        LYS  45   3.292   2.269   3.512
  168    HA   LYS  45           HA       LYS  45   1.964   4.688   4.576
  169   1HB   LYS  45          1HB       LYS  45   3.118   3.682   6.532
  170   2HB   LYS  45          2HB       LYS  45   4.637   3.665   5.649
  171   1HG   LYS  45          1HG       LYS  45   4.603   5.476   7.234
  172   2HG   LYS  45          2HG       LYS  45   4.642   6.147   5.603
  173   1HD   LYS  45          1HD       LYS  45   2.261   6.728   5.728
  174   2HD   LYS  45          2HD       LYS  45   2.081   5.809   7.228
  175   1HE   LYS  45          1HE       LYS  45   2.147   8.131   7.806
  176   2HE   LYS  45          2HE       LYS  45   3.625   7.365   8.388
  177   1HZ   LYS  45          2HZ       LYS  45   3.411   8.997   5.907
  178   2HZ   LYS  45          3HZ       LYS  45   4.071   9.499   7.311
  179   3HZ   LYS  45          1HZ       LYS  45   4.792   8.311   6.463
  180    H    CYS  46           H        CYS  46   5.235   3.650   3.419
  181    HA   CYS  46           HA       CYS  46   5.736   6.246   2.310
  182   1HB   CYS  46          1HB       CYS  46   7.907   5.025   1.606
  183   2HB   CYS  46          2HB       CYS  46   7.554   5.282   3.314
  184    H    LYS  47           H        LYS  47   4.787   3.203   0.830
  185    HA   LYS  47           HA       LYS  47   4.160   2.632  -1.303
  186   1HB   LYS  47          1HB       LYS  47   2.132   3.853  -1.893
  187   2HB   LYS  47          2HB       LYS  47   2.261   3.516  -0.173
  188   1HG   LYS  47          1HG       LYS  47   2.958   5.832   0.275
  189   2HG   LYS  47          2HG       LYS  47   2.891   6.215  -1.449
  190   1HD   LYS  47          1HD       LYS  47   0.526   5.898  -1.509
  191   2HD   LYS  47          2HD       LYS  47   0.479   5.173   0.101
  192   1HE   LYS  47          1HE       LYS  47   1.427   8.028  -0.398
  193   2HE   LYS  47          2HE       LYS  47  -0.268   7.627  -0.093
  194   1HZ   LYS  47          2HZ       LYS  47   1.934   6.976   1.802
  195   2HZ   LYS  47          3HZ       LYS  47   0.886   8.232   1.961
  196   3HZ   LYS  47          1HZ       LYS  47   0.345   6.685   2.025
  197    H    GLN  48           H        GLN  48   6.666   4.154  -1.659
  198    HA   GLN  48           HA       GLN  48   6.403   5.716  -4.059
  199   1HB   GLN  48          1HB       GLN  48   8.827   4.271  -2.917
  200   2HB   GLN  48          2HB       GLN  48   8.883   5.466  -4.205
  201   1HG   GLN  48          1HG       GLN  48   8.073   5.941  -1.311
  202   2HG   GLN  48          2HG       GLN  48   9.531   6.494  -2.112
  203   1HE2  GLN  48          2HE2      GLN  48   6.280   7.328  -1.350
  204   2HE2  GLN  48          1HE2      GLN  48   6.204   8.777  -2.359
  205    HA   PRO  49           HA       PRO  49   5.650   3.103  -7.324
  206   1HB   PRO  49          2HB       PRO  49   8.175   4.023  -8.716
  207   2HB   PRO  49          1HB       PRO  49   6.520   3.854  -9.386
  208   1HG   PRO  49          1HG       PRO  49   7.404   6.280  -8.604
  209   2HG   PRO  49          2HG       PRO  49   5.749   5.751  -8.149
  210   1HD   PRO  49          1HD       PRO  49   8.253   5.768  -6.465
  211   2HD   PRO  49          2HD       PRO  49   6.582   6.233  -6.034
  212    H    GLY  50           H        GLY  50   8.970   2.480  -6.236
  213   1HA   GLY  50          2HA       GLY  50  10.029   0.488  -7.593
  214   2HA   GLY  50          1HA       GLY  50   8.640  -0.400  -6.973
  215    H    HIS  51           H        HIS  51   9.397   1.643  -4.490
  216    HA   HIS  51           HA       HIS  51  11.793   0.608  -3.387
  217   1HB   HIS  51          1HB       HIS  51  11.241   1.845  -1.476
  218   2HB   HIS  51          2HB       HIS  51  10.497   2.748  -2.783
  219    HD1  HIS  51           HD1      HIS  51   7.607   1.861  -3.031
  220    HD2  HIS  51           HD2      HIS  51   9.781   1.242   0.529
  221    HE1  HIS  51           HE1      HIS  51   5.927   1.159  -1.271
  222    H    PHE  52           H        PHE  52   8.554  -0.740  -3.291
  223    HA   PHE  52           HA       PHE  52   8.622  -1.996  -0.798
  224   1HB   PHE  52          1HB       PHE  52   6.737  -3.363  -1.654
  225   2HB   PHE  52          2HB       PHE  52   6.562  -1.638  -1.889
  226    HD1  PHE  52           HD1      PHE  52   6.608  -0.619  -4.143
  227    HD2  PHE  52           HD2      PHE  52   6.974  -4.886  -3.591
  228    HE1  PHE  52           HE1      PHE  52   6.138  -0.978  -6.549
  229    HE2  PHE  52           HE2      PHE  52   6.506  -5.233  -6.001
  230    HZ   PHE  52           HZ       PHE  52   6.090  -3.280  -7.486
  231    H    SER  53           H        SER  53   9.614  -3.409  -3.944
  232    HA   SER  53           HA       SER  53  10.260  -5.997  -3.094
  233   1HB   SER  53          1HB       SER  53  11.646  -4.328  -5.226
  234   2HB   SER  53          2HB       SER  53  11.671  -6.098  -5.097
  235    HG   SER  53           HG       SER  53  10.081  -5.364  -6.582
  236    H    LYS  54           H        LYS  54  11.867  -3.193  -2.027
  237    HA   LYS  54           HA       LYS  54  14.152  -4.804  -0.978
  238   1HB   LYS  54          1HB       LYS  54  15.658  -2.934  -1.342
  239   2HB   LYS  54          2HB       LYS  54  14.987  -3.526  -2.854
  240   1HG   LYS  54          1HG       LYS  54  13.477  -1.660  -3.046
  241   2HG   LYS  54          2HG       LYS  54  13.849  -1.087  -1.414
  242   1HD   LYS  54          1HD       LYS  54  15.909  -1.235  -3.652
  243   2HD   LYS  54          2HD       LYS  54  14.919   0.194  -3.311
  244   1HE   LYS  54          1HE       LYS  54  15.797   0.272  -0.992
  245   2HE   LYS  54          2HE       LYS  54  16.813  -1.136  -1.319
  246   1HZ   LYS  54          3HZ       LYS  54  17.024   1.473  -2.729
  247   2HZ   LYS  54          1HZ       LYS  54  18.048   0.941  -1.579
  248   3HZ   LYS  54          2HZ       LYS  54  17.971   0.172  -3.015
  249    H    GLN  55           H        GLN  55  11.450  -3.526   0.120
  250    HA   GLN  55           HA       GLN  55  12.645  -2.936   2.753
  251   1HB   GLN  55          1HB       GLN  55  12.601  -0.741   1.441
  252   2HB   GLN  55          2HB       GLN  55  10.840  -0.858   1.455
  253   1HG   GLN  55          1HG       GLN  55  10.999  -0.983   4.021
  254   2HG   GLN  55          2HG       GLN  55  12.719  -0.631   3.852
  255   1HE2  GLN  55          1HE2      GLN  55   9.441   0.624   3.494
  256   2HE2  GLN  55          2HE2      GLN  55   9.895   2.314   3.353
  257    H    CYS  56           H        CYS  56   9.519  -2.866   0.965
  258    HA   CYS  56           HA       CYS  56   8.093  -3.608   3.467
  259   1HB   CYS  56          1HB       CYS  56   7.112  -2.208   0.947
  260   2HB   CYS  56          2HB       CYS  56   6.169  -2.513   2.407
  261    H    ARG  57           H        ARG  57   9.042  -5.071   0.621
  262    HA   ARG  57           HA       ARG  57   7.312  -7.417   1.044
  263   1HB   ARG  57          1HB       ARG  57   6.437  -5.585  -0.747
  264   2HB   ARG  57          2HB       ARG  57   7.621  -6.349  -1.782
  265   1HG   ARG  57          1HG       ARG  57   5.319  -7.213  -2.076
  266   2HG   ARG  57          2HG       ARG  57   6.439  -8.490  -1.622
  267   1HD   ARG  57          1HD       ARG  57   4.185  -8.585  -0.473
  268   2HD   ARG  57          2HD       ARG  57   5.570  -8.620   0.599
  269    HE   ARG  57           HE       ARG  57   5.121  -6.428   1.362
  270   1HH1  ARG  57          2HH1      ARG  57   2.722  -7.237  -1.092
  271   2HH1  ARG  57          1HH1      ARG  57   1.753  -5.836  -0.646
  272   1HH2  ARG  57          2HH2      ARG  57   3.795  -4.741   1.817
  273   2HH2  ARG  57          1HH2      ARG  57   2.316  -4.524   0.889
  274    H    SER  58           H        SER  58  10.296  -6.500   1.040
  275    HA   SER  58           HA       SER  58  11.759  -8.133  -0.815
  276   1HB   SER  58          1HB       SER  58  13.607  -7.774   0.924
  277   2HB   SER  58          2HB       SER  58  12.944  -6.358   0.100
  278    HG   SER  58           HG       SER  58  13.165  -6.217   2.493

  No H/Q in entry =         278