unres
[unres.git] / PARAM / tor_opt_iter1_7p_old-ext.parm
1 3  ***  Optimized torsional parameters 7p_wham_last  ***  
2 1 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 1 1 1 2 1 1 0 0
3  0 0 ** Gly-D-Pro-reg
4  0 0 ** Gly-D-Ala-reg
5  6 0  ************  G-G
6      1                    3.89266E-01       0.00000E+00
7      2                    4.18662E-01       0.00000E+00
8      3                   -4.85875E-03       0.00000E+00
9      4                   -2.28912E-01       0.00000E+00
10      5                   -1.32435E-01       0.00000E+00
11      6                   -3.25567E-02       0.00000E+00
12  6 0  ************  G-A
13      1                    4.48732E-01      -6.17446E-01
14      2                   -7.19420E-02      -2.81509E-01
15      3                    8.55553E-02       9.54595E-02
16      4                   -1.78171E-01       2.81875E-01
17      5                   -3.35660E-02       2.20930E-01
18      6                    7.48948E-02      -1.48385E-01
19 10 0  ************  G-P
20      1                   -1.02764E+00       7.71574E-01
21      2                    6.60187E-01       4.73949E-01
22      3                    3.06766E-01       6.26077E-02
23      4                    1.12028E-01      -2.20307E-03
24      5                    1.41205E-01       4.63242E-01
25      6                   -2.32839E-01       2.16374E-01
26      7                    4.45175E-02      -2.13921E-01
27      8                    2.13415E-01       1.05584E-01
28      9                   -1.06794E-01       1.83807E-01
29     10                   -1.58917E-01      -4.77027E-02
30  0 0 ****** Ala-D-Pro
31  0 0 ****** Ala-D-Ala
32  6 0  ************  A-G
33      1                   -5.35331E-01       3.07619E-01
34      2                   -4.40634E-03       2.42563E-01
35      3                    4.08626E-01      -1.26381E-01
36      4                   -3.75632E-01      -1.24731E-01
37      5                    1.54159E-01      -4.34413E-02
38      6                   -5.10726E-03      -8.98940E-02
39  6 0  ************  A-A
40      1                    7.57412E-01       2.41619E-01
41      2                    3.16517E-01      -4.83719E-01
42      3                    2.94869E-01      -3.00853E-02
43      4                   -1.18430E-01       6.30789E-02
44      5                    1.39669E-02       6.86930E-02
45      6                    5.15960E-03       2.89140E-02
46 10 0  ************  A-P
47      1                    1.24599E+00       3.28913E+00
48      2                    3.71946E-01       6.21240E-01
49      3                    1.72894E-01       5.10551E-01
50      4                   -4.30010E-01       1.34074E-01
51      5                   -1.04165E-01      -1.24492E-01
52      6                    1.84767E-01       1.76351E-01
53      7                    9.14037E-02       1.45966E-01
54      8                    2.88613E-01       2.65632E-01
55      9                   -5.37851E-02       5.01514E-01
56     10                   -2.33602E-01       1.43541E-01
57  0 0 ** Pro-D-Por
58  0 0 ** Pro-D-Ala
59 10 0  ************  P-G
60      1                    2.12359E-02       4.05506E-02
61      2                   -1.19424E-01       2.91087E-01
62      3                    3.81770E-01      -1.11839E-01
63      4                   -9.75339E-02      -7.60089E-02
64      5                   -5.00214E-02       3.42037E-02
65      6                    8.12296E-02       3.98713E-02
66      7                   -1.21613E-02      -4.57682E-02
67      8                    6.95870E-03       2.28245E-02
68      9                    2.02598E-02      -2.00100E-02
69     10                   -1.48685E-02      -1.09627E-02
70 10 0  ************  P-A
71      1                   -1.44568E+00       4.48810E-01
72      2                    2.44809E-01      -9.84525E-02
73      3                    7.10743E-02      -7.82747E-02
74      4                    6.10521E-02       1.26535E-01
75      5                   -1.06073E-01      -5.66209E-02
76      6                   -2.54567E-02       1.39995E-01
77      7                    8.12043E-02       4.96622E-02
78      8                   -1.02693E-01       2.65604E-02
79      9                   -4.64168E-02      -6.09468E-02
80     10                   -1.28754E-01      -4.35563E-02
81 10 0  ************  P-P
82      1                    4.99994E+00       1.02894E+00
83      2                    3.01919E+00      -1.08282E+00
84      3                    1.44640E+00      -1.36232E+00
85      4                    1.53375E-01      -8.06450E-01
86      5                   -1.13926E+00      -2.92452E-01
87      6                   -2.18888E+00      -1.79960E-01
88      7                   -2.71687E+00       2.89616E-01
89      8                   -2.52591E+00       9.09040E-01
90      9                   -1.45928E+00       1.12958E+00
91     10                   -4.89916E-01       3.69826E-01
92  0 0 ** Gly-D-Pro-reg
93  0 0 ** Gly-D-Ala-reg
94  6 0  ************  G-G
95      1                    3.89266E-01       0.00000E+00
96      2                    4.18662E-01       0.00000E+00
97      3                   -4.85875E-03       0.00000E+00
98      4                   -2.28912E-01       0.00000E+00
99      5                   -1.32435E-01       0.00000E+00
100      6                   -3.25567E-02       0.00000E+00
101  6 0  ************  G-A
102      1                    4.48732E-01      -6.17446E-01
103      2                   -7.19420E-02      -2.81509E-01
104      3                    8.55553E-02       9.54595E-02
105      4                   -1.78171E-01       2.81875E-01
106      5                   -3.35660E-02       2.20930E-01
107      6                    7.48948E-02      -1.48385E-01
108 10 0  ************  G-P
109      1                   -1.02764E+00       7.71574E-01
110      2                    6.60187E-01       4.73949E-01
111      3                    3.06766E-01       6.26077E-02
112      4                    1.12028E-01      -2.20307E-03
113      5                    1.41205E-01       4.63242E-01
114      6                   -2.32839E-01       2.16374E-01
115      7                    4.45175E-02      -2.13921E-01
116      8                    2.13415E-01       1.05584E-01
117      9                   -1.06794E-01       1.83807E-01
118     10                   -1.58917E-01      -4.77027E-02
119  0 0 ****** Ala-D-Pro
120  0 0 ****** Ala-D-Ala
121  6 0  ************  A-G
122      1                   -5.35331E-01       3.07619E-01
123      2                   -4.40634E-03       2.42563E-01
124      3                    4.08626E-01      -1.26381E-01
125      4                   -3.75632E-01      -1.24731E-01
126      5                    1.54159E-01      -4.34413E-02
127      6                   -5.10726E-03      -8.98940E-02
128  6 0  ************  A-A
129      1                    7.57412E-01       2.41619E-01
130      2                    3.16517E-01      -4.83719E-01
131      3                    2.94869E-01      -3.00853E-02
132      4                   -1.18430E-01       6.30789E-02
133      5                    1.39669E-02       6.86930E-02
134      6                    5.15960E-03       2.89140E-02
135 10 0  ************  A-P
136      1                    1.24599E+00       3.28913E+00
137      2                    3.71946E-01       6.21240E-01
138      3                    1.72894E-01       5.10551E-01
139      4                   -4.30010E-01       1.34074E-01
140      5                   -1.04165E-01      -1.24492E-01
141      6                    1.84767E-01       1.76351E-01
142      7                    9.14037E-02       1.45966E-01
143      8                    2.88613E-01       2.65632E-01
144      9                   -5.37851E-02       5.01514E-01
145     10                   -2.33602E-01       1.43541E-01
146  0 0 ** Pro-D-Por
147  0 0 ** Pro-D-Ala
148 10 0  ************  P-G
149      1                    2.12359E-02       4.05506E-02
150      2                   -1.19424E-01       2.91087E-01
151      3                    3.81770E-01      -1.11839E-01
152      4                   -9.75339E-02      -7.60089E-02
153      5                   -5.00214E-02       3.42037E-02
154      6                    8.12296E-02       3.98713E-02
155      7                   -1.21613E-02      -4.57682E-02
156      8                    6.95870E-03       2.28245E-02
157      9                    2.02598E-02      -2.00100E-02
158     10                   -1.48685E-02      -1.09627E-02
159 10 0  ************  P-A
160      1                   -1.44568E+00       4.48810E-01
161      2                    2.44809E-01      -9.84525E-02
162      3                    7.10743E-02      -7.82747E-02
163      4                    6.10521E-02       1.26535E-01
164      5                   -1.06073E-01      -5.66209E-02
165      6                   -2.54567E-02       1.39995E-01
166      7                    8.12043E-02       4.96622E-02
167      8                   -1.02693E-01       2.65604E-02
168      9                   -4.64168E-02      -6.09468E-02
169     10                   -1.28754E-01      -4.35563E-02
170 10 0  ************  P-P
171      1                    4.99994E+00       1.02894E+00
172      2                    3.01919E+00      -1.08282E+00
173      3                    1.44640E+00      -1.36232E+00
174      4                    1.53375E-01      -8.06450E-01
175      5                   -1.13926E+00      -2.92452E-01
176      6                   -2.18888E+00      -1.79960E-01
177      7                   -2.71687E+00       2.89616E-01
178      8                   -2.52591E+00       9.09040E-01
179      9                   -1.45928E+00       1.12958E+00
180     10                   -4.89916E-01       3.69826E-01