Structural statistics:
str target upper limits van der Waals torsion angles
function # sum max # sum max # sum max
1 37.61 78 67.0 1.05 23 28.0 0.54 26 283.9 14.17
2 37.67 85 66.9 1.10 27 27.8 0.62 20 279.6 17.92
3 38.68 82 68.8 1.09 17 24.5 0.41 27 314.9 22.75
4 38.88 81 65.4 1.46 25 27.0 0.50 22 315.4 19.24
5 39.45 86 67.4 1.07 21 27.6 0.57 25 301.5 15.98
6 40.18 83 66.1 1.46 26 28.7 0.38 26 317.4 16.87
7 40.19 80 66.6 1.10 22 28.6 0.52 23 300.2 16.89
8 40.35 92 70.7 1.14 21 28.6 0.52 25 314.9 15.12
9 40.56 84 69.4 1.26 14 25.9 0.43 22 324.5 23.09
10 40.73 91 69.2 0.99 28 27.3 0.54 24 314.8 15.05
11 41.33 84 69.7 1.05 31 30.2 0.54 21 279.5 18.52
12 41.67 85 69.5 0.99 22 27.9 0.41 27 321.5 18.61
13 42.16 93 69.3 1.12 21 28.0 0.60 22 300.3 28.64
14 42.44 95 73.1 1.24 16 26.2 0.39 24 327.0 21.98
15 42.56 93 72.9 0.95 25 29.5 0.56 30 350.7 18.21
16 42.57 79 69.0 1.39 23 27.4 0.52 23 306.9 26.83
17 42.79 91 72.5 1.03 22 29.1 0.46 28 334.8 22.57
18 42.92 80 66.8 1.34 22 30.2 0.50 24 318.1 25.68
19 43.01 101 75.4 1.26 25 25.7 0.39 27 336.5 17.23
20 43.10 86 67.2 1.25 24 28.4 0.44 23 312.6 27.44
Ave 40.94 86 69.1 1.17 23 27.8 0.49 24 312.8 20.14
+/- 1.75 6 2.6 0.15 4 1.4 0.07 2 18.0 4.32
Min 37.61 78 65.4 0.95 14 24.5 0.38 20 279.5 14.17
Max 43.10 101 75.4 1.46 31 30.2 0.62 30 350.7 28.64
Constraints violated in 6 or more structures:
Cutoffs: Upper distance limits : 0.30 A
Lower distance limits : 0.20 A
Angle constraints : 5.00 deg
# mean max. 1 5 10 15 20
Upper HN THR 79 - QG2 THR 79 3.37 16 0.35 0.45 *+++++ +++++++ + ++ # peak 3 # SUP 4.50
Upper QG2 THR 39 - HB THR 79 3.53 6 0.28 0.50 + + + + + * # peak 19 # SUP 1.83
Upper HB3 LYS+ 72 - QD1 LEU 74 3.55 11 0.32 0.50 + + ++ ++ ++ ++* # peak 47 # SUP 0.70
HB2 LYS+ 66 - QD1 LEU 74 # SUP 0.44
Upper QG2 VAL 73 - HN LEU 74 3.08 20 0.58 0.68 ++++++++++*+++++++++ # peak 96 # SUP 4.58
Upper QG2 VAL 62 - HN LYS+ 63 3.20 20 0.56 0.77 ++++++++*+++++++++++ # peak 100 # SUP 4.81
Upper HA LYS+ 72 - QG2 VAL 73 3.50 20 0.43 0.56 ++++*+++++++++++++++ # peak 106 # SUP 2.86
Upper HB3 SER 49 - HB2 GLU- 50 3.08 19 0.38 0.49 ++++* ++++++++++++++ # peak 143 # SUP 1.67
Upper QG1 VAL 40 - QD1 LEU 74 3.42 8 0.26 0.40 +* ++ + +++ # peak 155 # SUP 4.32
Upper HA VAL 13 - HN ASN 15 3.29 16 0.42 0.58 ++++++ +++ + +++*+ + # peak 366 # SUP 2.35
Upper HA LYS+ 32 - QB ALA 33 3.49 14 0.32 0.37 ++ +++++++* + +++ # peak 565 # SUP 2.61
Upper HA LYS+ 44 - HB VAL 47 3.54 7 0.20 0.62 + + *++ + + # peak 569 # SUP 1.50
Upper HB3 GLU- 18 - QB ALA 33 3.43 20 0.55 0.85 ++++++++*+++++++++++ # peak 572 # SUP 2.92
HB2 LEU 17 - QB ALA 33 # SUP 1.87
Upper QB ALA 42 - QG2 VAL 80 3.50 19 0.53 1.05 ++++++++ +*+++++++++ # peak 712 # SUP 0.58
QG2 VAL 40 - QB ALA 42 # SUP 2.13
Upper HN ALA 103 - QB ALA 103 2.59 11 0.23 0.42 ++ + + +*++ + + + # peak 716 # SUP 2.81
Upper QG2 VAL 87 - HA SER 88 3.39 6 0.30 0.87 + + + ++ * # peak 824 # SUP 2.39
Upper QD PHE 21 - QG2 ILE 29 3.32 6 0.23 0.51 + + ++ * + # peak 829 # SUP 2.55
Upper HB2 LEU 17 - QG2 ILE 29 3.29 8 0.26 0.50 ++++ * ++ + # peak 905 # SUP 0.75
HB2 GLN 16 - QG2 ILE 29 # SUP 0.64
Upper QG2 ILE 48 - HN SER 49 3.26 8 0.26 0.54 ++ ++ + + *+ # peak 950 # SUP 6.92
Upper HB ILE 29 - QD1 ILE 29 2.85 20 0.35 0.36 +++++++++++++++++*++ # peak 994 # SUP 3.87
Upper HN ILE 68 - QD1 ILE 68 3.51 7 0.26 0.81 ++ + +* + + # peak 1107 # SUP 6.15
Upper HA ILE 68 - QD1 ILE 68 3.37 6 0.12 0.40 ++ + * + + # peak 1110 # SUP 4.89
QD1 ILE 68 - HA SER 69 # SUP 2.67
Upper QG2 ILE 19 - QD1 ILE 19 2.70 12 0.34 0.57 ++ *+ ++ ++ +++ + # peak 1125 # SUP 6.66
Upper HA LEU 90 - HN GLY 92 3.01 11 0.36 0.78 ++++ +* ++ +++ # peak 1127 # SUP 1.00
Upper QD1 ILE 48 - HN THR 61 3.39 15 0.45 0.77 ++++* ++++++++ ++ # peak 1129 # SUP 2.65
Upper QB ALA 103 - HD3 PRO 104 3.45 14 0.28 0.67 ++ + +*++++ +++ ++ # peak 1327 # SUP 3.39
Upper HB3 LEU 17 - HN ILE 19 3.62 18 0.41 0.65 ++++++++++++* ++ +++ # peak 1375 # SUP 5.79
Upper QG2 VAL 80 - HD3 ARG+ 84 3.50 13 0.30 0.54 + ++++ + ++* ++ + + # peak 1419 # SUP 1.04
Upper HN GLU- 64 - HG3 GLU- 64 3.47 11 0.26 0.58 +++++++ ++ + * # peak 1801 # SUP 6.17
HN THR 61 - HG3 GLU- 64 # SUP 1.89
Upper HA GLU- 64 - HG2 GLU- 64 3.58 6 0.20 0.50 +++ + *+ # peak 1802 # SUP 5.20
Upper HN LYS+ 60 - HB3 LYS+ 60 3.36 16 0.39 0.54 ++++ ++++++*+++++ # peak 1911 # SUP 5.38
Upper HN VAL 73 - HB VAL 73 2.94 11 0.30 0.55 + ++ + + *+++++ # peak 2102 # SUP 3.30
Upper HB3 PRO 52 - HB3 ARG+ 53 3.56 8 0.32 0.83 * +++ + + + + # peak 2113 # SUP 3.98
Upper HB3 GLU- 18 - HB3 PHE 34 3.57 14 0.41 0.83 ++ + +++++ * ++ +++ # peak 2128 # SUP 1.09
Upper HB3 ARG+ 53 - HN GLU- 54 3.47 7 0.14 0.48 +++ + ++ * # peak 2244 # SUP 5.45
Upper HA VAL 47 - HB3 TRP 51 2.62 20 0.71 1.04 +++++*++++++++++++++ # peak 2435 # SUP 0.64
Upper HA LYS+ 60 - HD3 LYS+ 60 3.09 7 0.37 0.73 ++ + ++ + * # peak 2445 # SUP 3.64
HD3 LYS+ 60 - HB THR 61 # SUP 2.86
Upper QG2 ILE 48 - HD3 LYS+ 60 3.44 19 0.66 1.02 +++++*+++++++++++ ++ # peak 2481 # SUP 1.65
HD3 LYS+ 60 - QG1 VAL 65 # SUP 1.20
Upper QD2 LEU 67 - QD1 LEU 74 3.54 18 0.50 0.86 ++++++++*+ ++++++ ++ # peak 2531 # SUP 2.00
Upper HN LEU 74 - HG LEU 74 3.45 7 0.22 0.67 + * ++ + ++ # peak 2532 # SUP 5.87
Upper HA ARG+ 53 - HG3 ARG+ 53 3.15 10 0.22 0.46 +++ *+ + +++ + # peak 2590 # SUP 3.97
Upper HG LEU 17 - HA ILE 29 3.43 20 0.75 1.01 +++++*++++++++++++++ # peak 2617 # SUP 4.75
Upper HG2 ARG+ 22 - HB2 HIS+ 98 3.55 7 0.27 0.60 *++ + + + + # peak 2636 # SUP 2.66
Upper HN LEU 74 - QD2 LEU 74 3.28 14 0.38 0.71 + ++ +++ +++*+ +++ # peak 2668 # SUP 5.90
Upper QD1 LEU 17 - HN GLU- 18 3.24 17 0.50 0.71 ++++++++*+++ +++++ # peak 2824 # SUP 6.48
HN GLU- 10 - QD1 LEU 17 # SUP 0.93
Upper HA LEU 17 - QD1 LEU 17 2.88 6 0.26 0.39 + ++ * ++ # peak 2827 # SUP 5.80
Upper HB3 GLU- 64 - QG2 VAL 65 3.03 8 0.31 0.81 + + +* + +++ # peak 2991 # SUP 3.85
HG3 GLU- 64 - QG2 VAL 65 # SUP 3.48
Upper QD1 ILE 19 - HB THR 95 3.81 11 0.37 1.12 + + +++ *+ + +++ # peak 3308 # SUP 2.96
Upper QG2 VAL 47 - HE3 TRP 51 3.96 6 0.16 0.52 + * +++ + # peak 3369 # SUP 0.75
Upper QD2 LEU 23 - HB2 TRP 51 4.17 20 0.55 0.75 +++++++*++++++++++++ # peak 3396 # SUP 2.27
Upper QD2 LEU 17 - HA ILE 29 3.66 20 0.57 0.81 +++++++++++++*++++++ # peak 3424 # SUP 1.46
Upper QD2 LEU 17 - HG13 ILE 19 3.02 16 0.46 0.82 ++ ++ ++++* ++++ +++ # peak 3427 # SUP 0.19
Upper HA VAL 40 - HN LYS+ 44 3.92 7 0.24 0.43 * + + + + + + # peak 3442 # SUP 3.42
Upper HN LYS+ 20 - HG3 LYS+ 20 4.03 15 0.41 0.58 +*+++ ++ ++++ +++ + # peak 3460 # SUP 3.99
Upper HG12 ILE 19 - HB THR 95 4.04 8 0.21 0.83 * + + + +++ + # peak 3470 # SUP 2.39
Upper HN ILE 68 - HG13 ILE 68 3.65 13 0.46 0.79 ++ ++++* ++ ++ + + # peak 3489 # SUP 6.18
Upper HG3 ARG+ 53 - HN GLU- 54 3.86 9 0.19 0.46 + + +* ++++ + # peak 3492 # SUP 6.34
Upper HG LEU 17 - HN ILE 19 3.98 18 0.57 0.91 ++ ++++++++++++*++ + # peak 3500 # SUP 3.88
Upper HG13 ILE 68 - HB2 HIS+ 98 4.38 6 0.25 0.70 ++ ++ + * # peak 3538 # SUP 4.90
HB3 LYS+ 20 - HB2 HIS+ 98 # SUP 0.87
Upper HB3 LYS+ 63 - HN GLU- 64 3.63 9 0.22 0.51 +* +++ + + + + # peak 3570 # SUP 5.67
HN THR 61 - HB3 LYS+ 63 # SUP 2.36
Upper HB2 GLU- 64 - QG2 VAL 65 3.71 18 0.42 0.61 +++++++++ +*++++++ + # peak 3578 # SUP 3.11
HB2 GLU- 64 - QG1 VAL 65 # SUP 2.95
Upper QG1 VAL 40 - HB3 GLU- 75 3.76 9 0.23 0.44 +++*+++ + + # peak 3582 # SUP 2.09
HB3 GLU- 64 - QG2 VAL 65 # SUP 3.85
QG2 ILE 48 - HB VAL 62 # SUP 0.95
Upper HB3 LYS+ 20 - HA MET 97 3.85 20 0.78 0.93 +++++*++++++++++++++ # peak 3635 # SUP 1.15
HB3 LYS+ 20 - HA HIS+ 98 # SUP 0.66
Upper HA ALA 42 - HG2 GLU- 45 3.71 13 0.38 0.64 +*+++ +++++ +++ # peak 3643 # SUP 2.74
Upper QB ALA 11 - HD3 PRO 31 3.63 6 0.19 0.38 *++ ++ + # peak 3768 # SUP 1.50
Upper QD1 ILE 101 - HN GLN 102 3.58 10 0.33 0.63 + + + + +*+ + ++ # peak 3778 # SUP 4.25
Upper QG2 THR 95 - HB3 MET 97 2.87 11 0.31 0.48 +++ + +*+ ++ ++ # peak 3847 # SUP 1.19
HG3 ARG+ 84 - QG2 THR 95 # SUP 0.65
HG13 ILE 19 - QG2 THR 95 # SUP 1.34
Upper QG1 VAL 94 - HB THR 95 3.19 11 0.38 0.93 + + ++ +++ + +*+ # peak 3850 # SUP 3.18
HA1 GLY 92 - QG1 VAL 94 # SUP 0.34
Upper HB2 GLU- 18 - QG2 VAL 94 3.13 6 0.21 0.73 +* ++ + + # peak 3854 # SUP 4.38
Upper QG2 THR 39 - HN SER 41 3.73 9 0.30 0.44 + ++ ++ + * + + # peak 3862 # SUP 3.47
Upper QD1 LEU 74 - HN GLU- 75 3.86 7 0.18 0.61 + ++ + +*+ # peak 3863 # SUP 5.40
Upper HB3 PHE 21 - HB ILE 29 3.92 8 0.25 0.63 + + * + + + ++ # peak 3896 # SUP 2.25
HB3 PHE 21 - HB2 LEU 23 # SUP 1.03
Upper HB3 GLU- 64 - HG12 ILE 101 3.17 12 0.33 0.60 +++++ *++ ++ ++ # peak 3972 # SUP 2.18
HG3 GLU- 64 - HG12 ILE 101 # SUP 2.11
Upper HB3 LYS+ 60 - QG2 THR 61 3.17 9 0.27 0.82 + +++ *++++ # peak 4011 # SUP 2.91
Upper HB3 LEU 17 - QD1 ILE 19 3.78 16 0.64 1.39 +++++++++ ++ +* +++ # peak 4033 # SUP 3.27
HB3 LEU 17 - HG12 ILE 19 # SUP 2.82
Upper QG2 ILE 19 - HB VAL 80 3.49 14 0.35 0.69 ++ *+ +++ ++ +++++ # peak 4044 # SUP 0.75
Upper QG2 VAL 40 - QD1 LEU 74 3.39 6 0.15 0.46 ++ + *+ + # peak 4055 # SUP 6.28
Upper HN TYR 83 - HD3 ARG+ 84 4.20 13 0.50 1.14 +++ +++* +++ ++ + # peak 4079 # SUP 4.33
Upper HN VAL 62 - HB3 LYS+ 63 4.29 7 0.24 0.42 + ++ + +* + # peak 4124 # SUP 4.00
Upper HA LYS+ 60 - HD3 LYS+ 60 3.39 20 0.53 0.70 +++++++++++++++++*++ # peak 4131 # SUP 3.64
Upper QD1 ILE 29 - HB2 TRP 51 4.39 15 0.41 0.67 ++ + + ++++ +++ +*++ # peak 4169 # SUP 4.93
Upper HA ARG+ 22 - HA ASP- 28 3.39 20 0.61 0.80 +++++++++++*++++++++ # peak 4177 # SUP 0.75
Upper HB2 ARG+ 22 - QG2 THR 96 3.94 17 0.49 1.00 +++ ++ +++++++ +*+++ # peak 4184 # SUP 1.50
Upper HB3 ARG+ 22 - QG2 THR 96 3.76 17 0.47 0.70 ++*+++ ++++++ ++ +++ # peak 4187 # SUP 1.50
Upper HN ARG+ 84 - HD3 ARG+ 84 4.22 9 0.24 0.55 * ++ ++ ++ + + # peak 4297 # SUP 6.31
Upper HD3 ARG+ 84 - QG1 VAL 94 3.96 15 0.55 1.05 ++++*+++ +++ ++ + + # peak 4309 # SUP 1.45
Upper QD1 LEU 17 - HA ILE 29 3.32 20 0.82 1.26 ++++++++++++++++++*+ # peak 4312 # SUP 0.02
QD1 LEU 17 - HA ALA 93 # SUP 0.02
QD1 LEU 17 - HA VAL 94 # SUP 0.02
HA ASP- 36 - QG2 VAL 40 # SUP 0.02
Upper QD1 ILE 19 - HN LYS+ 20 4.21 7 0.24 0.47 + ++ +*+ + # peak 4331 # SUP 6.19
QD1 ILE 19 - HN VAL 80 # SUP 0.75
Upper HB3 LYS+ 63 - HA GLU- 64 3.21 7 0.26 0.38 ++ +++ + * # peak 4362 # SUP 3.21
HB2 LYS+ 117 - HA ASN 119 # SUP 0.67
Upper HG13 ILE 19 - QD PHE 21 3.82 8 0.25 0.55 +* +++ ++ + # peak 302 # SUP 1.47
QD PHE 21 - HG2 ARG+ 22 # SUP 3.67
QD PHE 21 - HB3 MET 97 # SUP 0.02
QD PHE 21 - HB ILE 100 # SUP 0.43
QD PHE 21 - HB3 LYS+ 66 # SUP 0.47
Upper QD TYR 83 - HG3 ARG+ 84 3.91 15 0.36 0.58 ++ + ++ ++++*+++ ++ # peak 551 # SUP 3.58
HB3 LYS+ 81 - QD TYR 83 # SUP 1.17
Upper HG LEU 23 - HH2 TRP 51 3.90 11 0.25 0.57 + + ++ +++ * +++ # peak 557 # SUP 1.50
HG2 ARG+ 22 - HH2 TRP 51 # SUP 0.98
Upper QE PHE 21 - HG LEU 43 4.09 6 0.13 0.73 + +* + + + # peak 571 # SUP 2.25
Upper HN ALA 103 - HG2 PRO 104 4.54 10 0.22 0.41 +* + + + ++ + + + # peak 62 # SUP 0.34
HN ALA 103 - HG2 PRO 112 # SUP 0.18
HN ALA 103 - HB VAL 105 # SUP 0.18
Upper HN ARG+ 22 - QG2 THR 96 4.07 8 0.26 0.38 *+ + ++ + + + # peak 136 # SUP 1.50
Upper HG2 LYS+ 32 - HN ALA 33 4.32 20 0.66 0.78 ++++*+++++++++++++++ # peak 146 # SUP 3.37
Upper HN THR 96 - HB3 MET 97 4.63 20 0.50 0.63 *+++++++++++++++++++ # peak 191 # SUP 3.38
HG3 ARG+ 84 - HN THR 96 # SUP 0.54
Upper HG LEU 17 - HN GLU- 18 4.19 7 0.25 0.51 + ++++ * + # peak 204 # SUP 7.15
HN GLU- 18 - HB ILE 19 # SUP 3.83
HN GLU- 18 - HB3 LYS+ 32 # SUP 0.27
Upper HA LYS+ 55 - HN GLU- 56 3.27 12 0.22 0.37 +++ + + + +++++* # peak 226 # SUP 3.99
Upper HN GLU- 10 - HN GLN 16 4.34 6 0.31 1.10 * ++ ++ + # peak 248 # SUP 1.13
HN GLN 16 - HN GLU- 18 # SUP 3.02
Upper HG3 ARG+ 53 - HN LYS+ 55 3.46 20 0.68 1.46 +++*++++++++++++++++ # peak 413 # SUP 1.84
HN LYS+ 55 - HD3 PRO 59 # SUP 0.75
Upper HN LYS+ 55 - HA1 GLY 58 4.22 12 0.43 0.93 +++++ + +++ +* + # peak 418 # SUP 1.34
Upper HB3 PRO 52 - HN LYS+ 55 4.12 16 0.44 0.72 +++ +++ ++ ++++++ +* # peak 420 # SUP 1.20
Upper HB2 GLU- 18 - HN VAL 94 3.59 12 0.40 0.82 + ++++++ ++ *+ + # peak 554 # SUP 3.65
Upper HG12 ILE 68 - HN SER 69 4.06 10 0.30 0.47 ++ ++ + ++ ++ * # peak 668 # SUP 4.78
QD1 LEU 67 - HN SER 69 # SUP 1.63
Upper HN LYS+ 63 - HG3 GLU- 64 3.80 7 0.26 0.52 + ++* + + + # peak 680 # SUP 2.89
HN LYS+ 63 - HB3 GLU- 64 # SUP 3.52
Upper HG3 LYS+ 60 - HN LYS+ 63 4.04 20 0.72 0.95 +++++++++++*++++++++ # peak 681 # SUP 1.97
HG2 PRO 59 - HN LYS+ 63 # SUP 0.72
Upper HN ILE 19 - HN PHE 34 4.06 12 0.38 0.62 +++ ++++ ++ *+ + # peak 691 # SUP 3.68
HN LEU 17 - HN PHE 34 # SUP 0.64
Upper HB2 PRO 52 - HN GLU- 54 3.71 14 0.40 0.59 +*+ + + ++ ++++++ + # peak 854 # SUP 3.10
HN GLU- 54 - HA1 GLY 58 # SUP 0.75
Upper HD3 PRO 31 - HN LYS+ 32 4.49 18 0.34 0.38 +++ ++++*++++ ++++++ # peak 1102 # SUP 2.57
HA1 GLY 30 - HN LYS+ 32 # SUP 1.94
Upper HN LEU 90 - HN ALA 91 4.06 9 0.26 0.58 + +++ ++ ++ * # peak 1308 # SUP 3.17
HD22 ASN 89 - HN ALA 91 # SUP 1.53
Upper HN GLN 16 - QD1 LEU 17 4.37 8 0.29 0.72 + + + + *+ + + # peak 1333 # SUP 3.33
HN GLN 16 - QG2 ILE 29 # SUP 0.64
Angle PHI LEU 17 229.00 273.00 17 10.34 16.63 + +++++++++++ ++ +*+
Angle PSI LEU 17 116.00 146.00 10 4.66 15.50 + + ++++ *+ + +
Angle PSI ILE 19 124.00 144.00 11 5.17 12.90 + + * + ++++ +++
Angle PHI LYS+ 20 204.00 242.00 18 9.58 22.75 + *++++++ ++++++++++
Angle PSI LYS+ 20 128.00 162.00 19 11.17 16.43 ++++++++++++ *++++++
Angle PSI PHE 21 106.00 132.00 19 10.96 15.44 +++++ +++++++++++++*
Angle PHI ARG+ 22 225.00 267.00 14 6.63 13.52 + ++++*++++++++
Angle PSI ASP- 28 127.00 157.00 20 9.97 18.61 +++++++++++*++++++++
Angle PHI ILE 29 214.00 268.00 7 3.95 8.26 + ++ *+ + +
Angle PSI PRO 31 128.00 150.00 20 15.77 21.98 +++++++++++++*++++++
Angle PHI LYS+ 32 205.00 253.00 15 10.19 17.23 + +++ +++ ++++ + +*+
Angle PHI VAL 40 282.00 302.00 8 4.31 9.48 ++++* + + +
Angle PSI VAL 47 304.00 324.00 7 4.71 7.45 *+++ + ++
Angle PHI ILE 48 291.00 311.00 7 3.27 7.98 +++ + + * +
Angle PHI TRP 51 251.00 281.00 8 4.44 9.69 + *+ + + + + +
Angle PSI TRP 51 110.00 138.00 15 8.16 14.15 +++ + + ++ +++*++ ++
Angle PHI ARG+ 53 285.00 305.00 10 4.50 14.41 +++ ++ + +++ *
Angle PSI ARG+ 53 314.00 334.00 11 5.17 9.81 + +* ++ ++++++
Angle PHI GLU- 54 256.00 286.00 17 7.56 12.20 +++*+++ ++ ++++++++
Angle PHI THR 61 232.00 276.00 20 11.67 18.56 ++++++++++++++++*+++
Angle PSI THR 61 147.00 175.00 10 4.79 9.77 + ++* ++ + +++
Angle PSI VAL 62 316.00 336.00 20 11.26 14.65 ++++++++++++*+++++++
Angle PSI LYS+ 81 309.00 331.00 11 4.27 7.48 + + + +++ ++ +*+
Angle PSI ARG+ 84 118.00 162.00 9 3.91 12.03 + ++++++ * +
Angle PHI SER 85 256.00 276.00 7 3.31 11.19 + + + ++ * +
Angle PSI SER 85 113.00 153.00 7 3.85 13.20 + + *+ ++ +
Angle PSI GLY 92 349.00 11.00 7 3.51 13.89 + + * + + + +
Angle PHI ALA 93 251.00 297.00 6 3.62 10.28 + + * + + +
Angle PSI ALA 93 109.00 151.00 17 10.86 22.57 ++++++ ++ ++++++*+ +
Angle PHI VAL 94 245.00 279.00 9 4.87 13.71 +* + + + ++ + +
Angle PSI VAL 94 119.00 147.00 8 8.12 28.64 + + + * + +++
Angle PHI THR 95 219.00 273.00 7 3.49 12.54 + +* ++ + +
Angle PSI THR 95 113.00 139.00 12 5.64 10.94 + + ++ + ++ ++ *++
Angle PSI THR 96 116.00 146.00 6 3.99 11.40 + + + *+ +
Angle PHI MET 97 248.00 292.00 14 5.70 11.01 +++++ ++ +++ +* + +
Angle PHI ILE 100 227.00 273.00 10 4.33 6.49 ++ + *+++ + + +
Angle PHI GLN 102 231.00 287.00 7 2.93 9.62 + + +*++ +
111 violated distance constraints.
37 violated angle constraints.
RMSDs for residues 16..108:
Average backbone RMSD to mean : 2.19 +/- 0.60 A (1.47..3.29 A)
Average heavy atom RMSD to mean : 2.57 +/- 0.59 A (1.93..3.74 A)