Structural statistics:
str target upper limits van der Waals torsion angles
function # rms max # sum max # rms max
1 274.62 11 0.1120 2.28 249 152.6 0.74 9411.8955 43.38
2 292.82 14 0.1172 2.63 228 141.7 0.85 9013.4450 67.07
3 302.14 7 0.1151 2.02 292 173.6 0.95 9612.7201 49.16
4 303.83 17 0.1211 2.46 217 144.4 0.76 9312.9349 51.75
5 310.20 13 0.1183 2.11 254 155.3 0.79 8713.6767 61.90
6 312.37 14 0.1191 2.93 309 178.9 0.68 9012.5069 52.85
7 313.13 12 0.1171 3.03 248 155.1 0.72 9914.7106 65.15
8 320.46 14 0.1225 2.65 294 166.8 0.73 8412.4272 50.72
9 322.01 15 0.1243 2.62 295 166.0 0.69 9512.3167 43.86
10 323.55 13 0.1191 2.00 285 160.7 0.69 9415.2240 60.59
11 323.80 16 0.1202 2.84 295 176.5 0.68 8313.6752 56.85
12 324.49 14 0.1188 2.71 283 176.1 1.00 9013.9142 91.19
13 333.13 17 0.1211 2.65 292 165.7 0.77 7514.5386 59.48
14 333.64 10 0.1169 2.36 306 175.0 0.86 10915.4805 57.92
15 337.29 16 0.1233 2.34 293 165.4 0.87 9113.6978 66.05
16 337.39 11 0.1190 2.15 297 172.9 0.78 9715.9439 51.83
17 338.21 13 0.1205 2.27 277 163.7 0.68 9616.1718101.01
18 338.66 11 0.1239 2.54 263 157.3 0.84 9715.3088 72.20
19 338.85 10 0.1182 2.82 269 155.0 0.71 9617.3543 84.34
20 342.32 14 0.1191 2.20 308 180.6 0.76 8615.5889 59.59
Ave 321.15 13 0.1193 2.48 278 164.2 0.78 9214.1766 62.34
+/- 17.46 3 0.0029 0.30 26 11.0 0.09 7 1.4697 14.74
Min 274.62 7 0.1120 2.00 217 141.7 0.68 7511.8955 43.38
Max 342.32 17 0.1243 3.03 309 180.6 1.00 10917.3543101.01
Cut 1.50 0.20 5.00
Constraints violated in 6 or more structures:
# mean max. 1 5 10 15 20
Upper HB3 GLN 16 - HA VAL 31 3.89 11 1.50 2.05 +++++* + + + + + peak 2148
HA VAL 31 - HB ILE 32
HA VAL 31 - HG3 PRO 157
Upper HA LEU 17 - H ILE 102 3.80 6 1.10 2.55 ++ + + +* peak 355
HA VAL 100 - H ILE 102
H ILE 102 - HA TRP 118
HB2 GLN 27 - HH2 TRP 118
HB3 GLN 27 - HH2 TRP 118
HB3 ARG 97 - HH2 TRP 118
Upper QD PHE 26 - HG2 ARG 38 3.34 7 1.03 2.62 + + +*+ + + peak 467
QD PHE 26 - HB3 LEU 87
QD PHE 26 - HG LEU 87
HB3 LYS 68 - H GLU 85
HG LEU 76 - H GLU 85
H GLU 85 - HB2 GLU 105
H GLU 85 - HB3 ARG 137
Upper HB2 GLN 27 - HA2 GLY 78 3.67 8 1.28 2.21 + ++* + ++ + peak 74
HB3 GLN 27 - HA2 GLY 78
HG2 GLN 27 - HA2 GLY 78
HG2 PRO 40 - HA2 GLY 78
HB ILE 63 - HA2 GLY 78
HA2 GLY 78 - HB3 GLU 83
QD TYR 95 - HB2 ARG 97
QD TYR 95 - HB2 LYS 114
QD TYR 95 - HG LEU 138
Upper HA GLU 41 - HB ILE 42 4.29 6 1.08 1.69 + * +++ + peak 271
HB ILE 42 - HA ASP 88
HB ILE 42 - HA GLU 105
Upper HA THR 46 - H THR 115 4.02 6 1.11 2.05 + +* + + + peak 524
HA2 GLY 101 - H THR 115
HA VAL 113 - H THR 115
HG LEU 76 - H LEU 84
HG LEU 76 - H LYS 148
Upper HB3 LEU 47 - QD TYR 116 4.20 10 1.46 2.36 + ++ +++ +*+ + peak 440
HB3 LEU 47 - HZ2 TRP 130
HB3 LEU 47 - HZ2 TRP 135
HG2 GLU 70 - H THR 80
HG2 GLU 70 - H GLU 96
Upper HB2 PHE 50 - QE PHE 53 3.91 7 1.24 1.72 + * +++ + + peak 184
HB3 ARG 52 - QE PHE 53
QE PHE 53 - HB3 PRO 157
Upper QD PHE 50 - HB2 ASN 86 3.56 7 1.02 2.93 *++++ ++ peak 507
HB2 ASN 86 - HD21 ASN 162
HB VAL 34 - QE TYR 95
HB3 PRO 48 - QE TYR 95
Upper H PHE 53 - H VAL 64 2.99 8 1.37 1.96 +++ + + +* + peak 711
H PHE 53 - H GLY 101
QG2 ILE 63 - QG2 VAL 100
QD1 LEU 87 - QG2 VAL 100
Upper HA VAL 79 - H SER 81 3.07 11 1.53 2.86 + + *+++ + + ++ + peak 1022
H SER 81 - HB THR 115
H SER 81 - HA PHE 143
H MET 35 - HD2 ARG 38
H MET 35 - HB3 ASN 86
H MET 35 - HE3 LYS 148
Upper HA GLU 83 - HB2 LEU 84 3.50 14 1.72 2.90 ++ + *++ ++ ++++++ peak 2109
HB2 LEU 84 - HA ARG 137
HA ARG 137 - HD3 LYS 148
VdW CA LEU 15 - CD1 LEU 15 3.00 7 0.15 0.27 + + * ++ ++
VdW HA LEU 15 - CD1 LEU 15 2.60 8 0.20 0.40 + + + *+ +++
VdW HA ASN 19 - O LEU 76 2.30 8 0.22 0.51 ++ ++ *+ + +
VdW ND2 ASN 19 - C ASN 19 2.95 6 0.09 0.44 + ++ *+ +
VdW N VAL 20 - O LEU 76 2.75 6 0.12 0.55 ++ * + ++
VdW O VAL 20 - N LEU 76 2.75 8 0.21 0.58 + + ++ +* + +
VdW HA PHE 21 - O LYS 74 2.30 8 0.21 0.68 ++ + + + + + *
VdW CG2 VAL 22 - C VAL 22 2.90 6 0.11 0.33 + + * + + +
VdW HA ASP 28 - CD PRO 29 2.60 6 0.11 0.31 ++ + ++ *
VdW CB ASP 28 - CD PRO 29 3.20 7 0.15 1.00 ++ + *+ + +
VdW O VAL 31 - N VAL 34 2.75 6 0.12 0.37 * + + + + +
VdW CG2 ILE 32 - CD1 ILE 32 3.00 11 0.19 0.33 +++* + +++ + ++
VdW CG2 ILE 32 - C ILE 32 2.90 12 0.18 0.32 + ++ +++ +++ ++ *
VdW O ASN 33 - HA ASP 37 2.30 7 0.15 0.57 + + + + + * +
VdW O LEU 36 - CB ASP 37 2.90 12 0.23 0.52 +++ ++*+ + ++ + +
VdW CB ARG 38 - H THR 39 2.55 8 0.16 0.40 + + ++ +*+ +
VdW HA THR 39 - CD PRO 40 2.60 18 0.26 0.30 ++++++ ++++*+++++++
VdW CG1 ILE 42 - C ILE 42 2.90 11 0.20 0.32 + + + + ++ *+ ++ +
VdW H VAL 43 - HB VAL 75 1.95 6 0.10 0.52 * + ++ + +
VdW CG2 THR 46 - C THR 46 2.90 8 0.12 0.32 ++ ++ ++ + *
VdW O THR 46 - CD PRO 48 2.90 6 0.11 0.38 + + + + + *
VdW O THR 46 - HD3 PRO 48 2.30 6 0.13 0.45 + * +++ +
VdW CA LEU 47 - CD2 LEU 47 3.00 7 0.11 0.27 + +* + + + +
VdW CG LEU 47 - O LEU 47 2.90 6 0.17 0.58 + ++ * + +
VdW CD1 LEU 47 - O LEU 47 2.90 10 0.25 0.65 ++ +++++ + * +
VdW HD12 LEU 47 - O LEU 47 2.30 6 0.10 0.37 + *+ + ++
VdW CD2 LEU 47 - C LEU 47 3.10 10 0.21 0.67 *+ +++ ++ ++ +
VdW O GLY 49 - HA PRO 65 2.30 8 0.15 0.51 ++++*++ +
VdW HA PHE 50 - O VAL 64 2.30 8 0.16 0.56 ++ *+ + ++ +
VdW N GLN 51 - O VAL 64 2.75 6 0.15 0.55 + +++ + *
VdW CG GLN 51 - C GLN 51 2.90 7 0.17 0.24 * ++++ + +
VdW HG3 GLN 51 - C GLN 51 2.50 8 0.16 0.48 + *+ + ++ + +
VdW O GLN 51 - HA ILE 63 2.30 12 0.26 0.57 ++ +* ++++ + + ++
VdW O GLN 51 - N VAL 64 2.75 9 0.21 0.84 + + + ++ +*+ +
VdW O GLN 51 - H VAL 64 1.80 6 0.14 0.85 + + +*+ +
VdW HA ARG 52 - O CYS 62 2.30 6 0.15 0.54 + + + + * +
VdW N PHE 53 - CD1 PHE 53 3.05 8 0.17 0.54 ++ ++ ++ +*
VdW N PHE 53 - CD2 PHE 53 3.05 12 0.27 0.61 + ++ +++++++* +
VdW N PHE 53 - HD2 PHE 53 2.45 8 0.16 0.56 + + ++ ++ * +
VdW H PHE 53 - CD1 PHE 53 2.55 6 0.12 0.61 *+ ++ ++
VdW O LEU 59 - C TYR 60 2.80 6 0.13 0.47 +++ +* +
VdW N TYR 60 - HD2 PRO 61 2.45 6 0.15 0.66 * ++ + ++
VdW CB TYR 60 - CD PRO 61 3.20 17 0.34 0.63 +++++++++++++ + ++*
VdW CB TYR 60 - HD3 PRO 61 2.60 8 0.15 0.36 + +++* + + +
VdW HA ILE 63 - CD1 ILE 63 2.60 6 0.15 0.51 * + + ++ +
VdW CG2 ILE 63 - C ILE 63 2.90 9 0.18 0.33 ++ + + ++ * ++
VdW CB VAL 64 - HD2 PRO 65 2.60 7 0.15 0.37 *+ + ++ ++
VdW HB VAL 64 - HD2 PRO 65 2.00 12 0.27 0.76 ++ * + ++ ++++++
VdW CG1 VAL 64 - C VAL 64 2.90 6 0.10 0.33 +* ++ ++
VdW N HIS 72 - CD2 HIS 72 3.05 10 0.16 0.45 + + + *+++ + ++
VdW CG1 VAL 75 - C VAL 75 2.90 7 0.12 0.32 + + +* ++ +
VdW CG2 VAL 79 - CB LEU 84 3.20 6 0.10 0.31 * +++ + +
VdW C THR 80 - N ASP 82 2.95 6 0.14 0.25 + ++* + +
VdW C THR 80 - H ASP 82 2.45 9 0.17 0.43 + ++* ++++ +
VdW O SER 81 - CB GLU 85 2.90 6 0.12 0.36 + + * + ++
VdW O SER 81 - HB2 GLU 85 2.30 6 0.12 0.46 + + + +*+
VdW O ASN 86 - N VAL 90 2.75 10 0.19 0.53 + ++ + * + ++++
VdW O ASN 86 - H VAL 90 1.80 6 0.12 0.50 ++ + * ++
VdW O VAL 90 - CB GLU 91 2.90 6 0.13 0.56 + ++*++
VdW HA ARG 97 - HA TYR 116 2.00 6 0.14 0.84 + + + + *+
VdW CG2 VAL 98 - O THR 115 2.90 6 0.10 0.52 + + + + *+
VdW O VAL 98 - HB3 LYS 114 2.30 8 0.14 0.47 + ++ + ++ *+
VdW CG2 THR 99 - C THR 99 2.90 11 0.19 0.31 +++++++ + +*+
VdW CG2 THR 99 - O THR 99 2.90 10 0.20 0.42 ++ ++++ + + * +
VdW N ILE 102 - CG2 ILE 102 2.85 6 0.13 0.24 +* + + + +
VdW CG1 ILE 102 - C ILE 102 2.90 12 0.19 0.33 +++*+ + + ++ +++
VdW CD1 ILE 102 - C ILE 102 3.10 9 0.19 0.56 ++*++++ ++
VdW CD1 ILE 102 - O ILE 102 2.90 6 0.12 0.46 +* + + ++
VdW O VAL 103 - O ARG 104 2.60 7 0.15 0.52 + * ++ + ++
VdW N ARG 104 - HG2 ARG 104 2.45 7 0.11 0.41 + + *+ + ++
VdW CG TRP 118 - O TRP 118 2.90 7 0.16 0.72 + *+ ++ + +
VdW C ILE 119 - H LYS 121 2.45 6 0.14 0.49 + + + + *+
VdW N ASP 123 - HD2 PRO 124 2.45 9 0.12 0.30 * ++++ + + + +
VdW CB ASP 123 - CD PRO 124 3.20 9 0.17 0.69 ++++ +*+ + +
VdW C PHE 132 - H GLU 134 2.45 7 0.14 0.62 + + * ++++
VdW O GLU 134 - N LYS 136 2.75 6 0.09 0.28 + ++ + *+
VdW CG ARG 137 - H LEU 138 2.55 6 0.13 0.51 * +++ + +
VdW O HIS 139 - C LYS 140 2.80 6 0.09 0.33 + + + ++ *
VdW C LYS 140 - H LYS 142 2.45 10 0.15 0.45 +++++ + ++ + *
VdW C ILE 144 - N THR 146 2.95 7 0.13 0.35 + +* ++ ++
VdW C ILE 144 - H THR 146 2.45 6 0.14 0.50 + *+ + + +
VdW O ILE 144 - C GLU 145 2.80 8 0.14 0.37 + ++ * ++ + +
VdW O ILE 144 - N THR 146 2.75 7 0.17 0.62 + +* ++ ++
VdW O PHE 147 - N ILE 150 2.75 7 0.11 0.35 +++ ++ * +
VdW CG2 ILE 150 - C ILE 150 2.90 20 0.30 0.33 +*++++++++++++++++++
VdW HA LYS 156 - CD PRO 157 2.60 6 0.11 0.29 + * + ++ +
Angle PHI HIS 18 -140.00 -116.00 7 4.25 14.23 ++ +++* +
Angle PSI HIS 18 139.00 159.00 18 14.93 54.36 ++++ +++++ +++*+++++
Angle PHI ASN 19 -143.00 -93.00 6 3.53 14.48 + *+ +++
Angle PSI ASN 19 126.00 156.00 7 7.19 42.84 + +++ + + *
Angle PHI VAL 20 -132.00 -112.00 14 10.10 35.01 + + ++ +++*++ +++ +
Angle PSI VAL 20 124.00 144.00 16 16.47 37.07 +++++ +++ +*++ ++++
Angle PHI PHE 21 -129.00 -95.00 9 6.78 29.03 + +* + +++++
Angle PSI PHE 21 124.00 148.00 10 7.61 39.00 ++*+ ++ + + ++
Angle PHI VAL 22 -139.00 -103.00 12 8.31 41.53 *++ ++ ++ ++ +++
Angle PSI VAL 22 135.00 169.00 13 11.33 28.00 ++ +*++ ++++ +++
Angle PSI PRO 29 -39.00 -29.00 11 9.23 40.97 +++ ++ + * ++ ++
Angle PHI ASP 30 -76.00 -56.00 7 7.04 43.38 *+ ++ + + +
Angle PSI ASP 30 -48.00 -28.00 9 7.64 35.52 * + +++ ++ + +
Angle PHI VAL 31 -76.00 -56.00 13 14.35 45.80 + ++++ +++ ++*+ +
Angle PSI VAL 31 -53.00 -31.00 9 9.37 27.09 ++ + + + +*+ +
Angle PHI ILE 32 -73.00 -53.00 12 8.72 25.61 +*+ + + + ++++++
Angle PSI ILE 32 -54.00 -34.00 9 5.75 24.79 +++ + ++* ++
Angle PSI ASN 33 -52.00 -32.00 11 7.21 26.67 ++ + +++ +++ + *
Angle PHI VAL 34 -81.00 -61.00 12 9.68 30.68 ++ +++ + + ++ + *+
Angle PSI VAL 34 -51.00 -31.00 7 6.89 38.53 +++ + + * +
Angle PHI MET 35 -78.00 -58.00 16 10.10 22.75 +*++ +++++++++ +++
Angle PSI MET 35 -35.00 -15.00 8 4.65 21.64 * ++ + + +++
Angle PHI LEU 36 -115.00 -83.00 6 4.00 18.64 + + +* + +
Angle PSI LEU 36 -34.00 10.00 8 6.90 34.95 + +++* ++ +
Angle PHI THR 39 -125.00 -97.00 11 8.54 21.87 + + +* ++++++ +
Angle PSI THR 39 120.00 150.00 13 10.37 31.15 + ++ *+++ + +++++
Angle PSI PRO 40 116.00 150.00 18 11.93 22.18 + ++++ ++++++++*++++
Angle PSI ILE 42 123.00 143.00 8 5.89 20.83 ++ + +* + + +
Angle PHI VAL 43 -130.00 -110.00 12 7.12 24.99 + +*+++++ ++ ++
Angle PSI VAL 43 120.00 146.00 13 9.15 38.79 +++ + + + ++* ++++
Angle PHI SER 44 -115.00 -77.00 15 12.34 34.39 +++ ++ +*+++++++ +
Angle PSI SER 44 123.00 143.00 12 7.75 29.94 +* ++++ + + + ++ +
Angle PHI ALA 45 -145.00 -125.00 9 7.58 31.93 + +++*+ + + +
Angle PSI ALA 45 131.00 157.00 9 5.74 25.61 ++* +++ + + +
Angle PHI THR 46 -134.00 -92.00 10 8.24 36.44 +++* ++ + + + +
Angle PSI THR 46 118.00 138.00 12 10.54 39.02 ++*+++++ + ++ +
Angle PSI LEU 47 94.00 144.00 14 10.77 30.21 + ++++++++ ++ +* +
Angle PSI PRO 48 136.00 156.00 13 10.90 30.77 ++ ++ +* ++ +++++
Angle PHI PHE 50 -149.00 -103.00 6 4.06 37.54 ++ +* + +
Angle PSI PHE 50 145.00 175.00 13 10.73 29.06 + + ++++++ + +*++
Angle PHI ARG 52 -141.00 -101.00 6 3.88 13.60 + + +++ *
Angle PSI ARG 52 118.00 150.00 8 5.48 36.17 + ++ + + + + *
Angle PHI CYS 62 -151.00 -119.00 7 4.65 19.30 ++ + + +* +
Angle PSI CYS 62 148.00 170.00 10 9.33 32.08 + + ++ *+ ++++
Angle PHI ILE 63 -151.00 -129.00 14 14.73 34.27 + ++*++ ++ ++++++
Angle PSI ILE 63 146.00 170.00 9 5.18 18.05 ++ + ++++* +
Angle PHI VAL 64 -148.00 -124.00 10 5.41 17.07 * + ++ +++ +++
Angle PSI LYS 68 1.00 25.00 8 7.11 32.77 + + + + * + ++
Angle PHI VAL 71 -144.00 -114.00 10 6.13 22.75 ++ +++ ++* ++
Angle PSI VAL 71 120.00 142.00 11 7.24 24.12 + * ++ + + + ++ + +
Angle PHI LYS 74 -148.00 -128.00 9 5.58 21.50 ++ +* + ++ ++
Angle PSI LYS 74 146.00 170.00 15 12.31 33.09 + ++ ++ + +++++++*+
Angle PHI VAL 75 -136.00 -112.00 14 15.17 52.85 +++++* +++ ++++ +
Angle PSI VAL 75 117.00 149.00 8 5.10 17.05 +* + + ++ ++
Angle PHI LEU 76 -116.00 -96.00 13 11.62 46.09 + +++ +*++ ++ ++ +
Angle PSI LEU 76 104.00 128.00 11 9.37 30.66 + +++*++++ ++
Angle PHI MET 77 -128.00 -72.00 10 7.07 50.72 + + ++* +++ ++
Angle PSI MET 77 120.00 178.00 8 5.66 22.71 ++ * ++++ +
Angle PSI THR 80 159.00 179.00 16 12.29 30.26 ++ + ++++++++++++*
Angle PSI SER 81 -48.00 -28.00 12 9.75 25.33 + + ++* + ++++ ++
Angle PHI ASP 82 -77.00 -57.00 6 3.22 15.65 + + +++ *
Angle PSI ASP 82 -52.00 -32.00 13 12.41 27.56 ++++ + + ++ +++ +*
Angle PHI GLU 83 -78.00 -58.00 16 11.69 23.88 ++++ ++++* ++++++ +
Angle PHI LEU 84 -73.00 -53.00 6 3.32 10.16 ++ + + *+
Angle PSI LEU 84 -51.00 -31.00 8 6.25 27.80 +++* + + + +
Angle PHI GLU 85 -76.00 -56.00 9 8.38 29.50 ++ ++ + * ++ +
Angle PSI GLU 85 -52.00 -32.00 7 6.60 28.48 + + + +*++
Angle PHI ASN 86 -76.00 -56.00 14 10.64 21.37 ++ + *+++++++++ +
Angle PSI ASN 86 -50.00 -30.00 9 7.88 48.47 + + + +++* + +
Angle PHI LEU 87 -72.00 -52.00 9 6.26 23.45 + +++ + +*+ +
Angle PSI LEU 87 -51.00 -31.00 6 4.61 23.06 *+ +++ +
Angle PHI ASP 88 -73.00 -53.00 14 11.69 30.36 ++ ++++++*+ + +++
Angle PHI ALA 89 -73.00 -53.00 9 8.73 29.46 ++ ++ *+ + + +
Angle PSI ALA 89 -52.00 -32.00 13 12.94 47.52 +++ ++ +++ *+++ +
Angle PHI VAL 90 -77.00 -57.00 14 10.48 32.95 ++ +++ ++++*++ + +
Angle PSI VAL 90 -56.00 -32.00 8 7.18 26.43 + *+ + + ++ +
Angle PHI TYR 95 -144.00 -114.00 12 8.99 25.44 +*+ + ++ +++++ +
Angle PSI TYR 95 142.00 162.00 15 13.68 45.65 +++ ++++ +* + +++++
Angle PHI GLU 96 -157.00 -125.00 14 13.62 44.42 +++ *+ + ++++ ++++
Angle PSI GLU 96 129.00 163.00 11 11.14 46.57 + + + + + + *++++
Angle PHI ARG 97 -112.00 -88.00 10 10.54 31.49 + +++ + + * + ++
Angle PSI ARG 97 115.00 135.00 10 7.31 28.89 +++ * + + +++ +
Angle PHI VAL 98 -147.00 -123.00 8 5.44 19.08 + ++ ++ * ++
Angle PHI THR 99 -108.00 -88.00 16 11.97 39.70 +++ +++++*+ ++++++
Angle PSI THR 99 127.00 151.00 14 16.08 64.59 + +++ + ++ +++++*+
Angle PHI VAL 100 -148.00 -128.00 14 10.98 32.93 ++++ * ++ + ++++++
Angle PSI VAL 100 149.00 169.00 13 10.44 25.45 + ++ + ++ *+ +++ + +
Angle PSI GLY 101 123.00 153.00 18 20.65 49.16 ++*++++++++++++++ +
Angle PHI ILE 102 -140.00 -120.00 11 7.23 23.48 +++ + ++ +++*+
Angle PSI ILE 102 136.00 160.00 10 5.46 20.81 * ++ ++++ + ++
Angle PHI VAL 103 -130.00 -84.00 10 8.07 32.63 + + + + *+ +++ +
Angle PSI VAL 103 108.00 152.00 12 11.89 45.89 ++ + ++++ + *+ ++
Angle PSI GLU 105 -55.00 -35.00 18 10.19 17.93 ++++++ ++++ +++*++++
Angle PHI ASP 106 -81.00 -55.00 7 3.76 11.57 +++ + + *+
Angle PHI SER 108 -88.00 -50.00 8 6.97 35.49 +++++ + *+
Angle PHI LYS 110 -109.00 -67.00 17 13.26 23.82 ++++++++++++ *+++ +
Angle PSI LYS 110 125.00 147.00 10 6.59 27.83 ++++ +++ + * +
Angle PSI MET 111 134.00 160.00 9 4.42 12.22 + + + ++* + ++
Angle PHI ALA 112 -119.00 -87.00 6 4.16 18.74 * + + + + +
Angle PSI ALA 112 118.00 144.00 17 19.13 43.26 +++++++++ ++ ++++*+
Angle PHI VAL 113 -146.00 -126.00 8 7.01 33.29 ++ + * + + ++
Angle PSI VAL 113 147.00 173.00 7 5.00 19.16 + + + + * ++
Angle PHI LYS 114 -141.00 -95.00 13 11.51 46.66 +++ ++ ++* ++ +++
Angle PSI LYS 114 134.00 164.00 9 7.70 33.49 + + + ++ +* ++
Angle PHI THR 115 -156.00 -112.00 14 11.70 33.92 ++++ + ++*+++++ +
Angle PSI THR 115 123.00 171.00 10 10.98 59.59 + ++ + +++++*
Angle PHI TYR 116 -125.00 -97.00 12 7.80 33.87 +++++ + +++ + +*
Angle PSI TYR 116 109.00 139.00 9 8.85 39.85 ++++ + ++*+
Angle PHI MET 117 -141.00 -103.00 11 10.22 40.67 ++++++ + +++ *
Angle PSI MET 117 113.00 151.00 12 10.38 37.56 + +*++ ++ + + + + +
Angle PHI TRP 118 -103.00 -65.00 7 11.69 45.51 + ++ * + ++
Angle PSI TRP 118 113.00 153.00 12 15.73 84.34 ++ ++ +++ + + ++*
Angle PHI ILE 119 -78.00 -50.00 19 21.48 45.85 ++ +++*+++++++++++++
Angle PSI ILE 119 -43.00 -21.00 10 7.85 25.86 + + +++ *+ + ++
Angle PHI ASN 120 -107.00 -79.00 10 8.55 33.20 + + ++++ * + ++
Angle PSI PHE 132 -54.00 -34.00 12 9.15 34.18 ++++ ++++*++ +
Angle PHI GLU 133 -73.00 -53.00 9 5.06 23.79 * ++ +++ ++ +
Angle PSI GLU 133 -49.00 -29.00 14 15.00 52.14 ++ + ++++* + + ++++
Angle PHI GLU 134 -77.00 -57.00 8 7.50 60.59 ++ + +* + + +
Angle PSI GLU 134 -50.00 -30.00 12 11.99 60.23 ++ ++++ + ++ *++
Angle PHI TRP 135 -74.00 -54.00 13 8.55 16.87 ++ + +++++++ + + *
Angle PSI TRP 135 -52.00 -32.00 13 13.07 37.12 + + +++ ++ ++*+++
Angle PHI LYS 136 -72.00 -52.00 9 6.16 30.54 +*++ +++ ++
Angle PSI LYS 136 -49.00 -29.00 10 9.44 47.76 + +++ + * + +++
Angle PHI ARG 137 -74.00 -54.00 9 6.37 30.01 ++ ++ + +* + +
Angle PSI ARG 137 -51.00 -31.00 16 19.83 66.05 +++ ++++++ ++*++ ++
Angle PHI LEU 138 -91.00 -71.00 15 21.28 52.26 ++++ ++++*+ ++++ +
Angle PSI LEU 138 -45.00 -15.00 16 26.11 70.29 +++ + ++ + +++++++*+
Angle PHI HIS 139 -115.00 -77.00 15 28.93 101.01 ++++ + +++ ++ +*+++
Angle PSI HIS 139 -37.00 5.00 15 20.76 44.90 + + ++++++*+ +++++
Angle PHI LYS 140 -70.00 -50.00 17 19.94 59.48 + +++++++++* ++++++
Angle PSI LYS 140 -53.00 -33.00 15 16.52 44.05 +*++ + +++ +++++++
Angle PHI LYS 141 -75.00 -55.00 9 10.02 43.20 + + + ++++* +
Angle PSI LYS 141 -50.00 -30.00 18 23.73 42.49 +++++++ ++++*++++++
Angle PHI LYS 142 -75.00 -55.00 19 25.22 61.90 ++++*+++ +++++++++++
Angle PSI LYS 142 -51.00 -31.00 12 11.15 42.80 + + +++ + +++*+ +
Angle PHI PHE 143 -76.00 -56.00 14 12.99 61.23 +++ +++ +++++*++
Angle PSI PHE 143 -53.00 -33.00 12 22.28 56.85 + +++ * ++ +++++
Angle PHI ILE 144 -73.00 -53.00 14 19.15 51.45 ++++++ + ++ ++*++
Angle PSI ILE 144 -54.00 -34.00 15 26.01 91.19 +++ ++ +++* ++++++
Angle PHI GLU 145 -72.00 -52.00 14 20.28 56.30 + +++ ++++++ ++ +*
Angle PSI GLU 145 -51.00 -31.00 9 13.41 72.20 + + + + +++ *+
Angle PHI THR 146 -81.00 -61.00 14 15.47 53.00 ++ +++ ++++++++*
Angle PSI THR 146 -49.00 -29.00 8 5.66 21.64 ++ + + ++*+
Angle PHI PHE 147 -76.00 -56.00 12 10.24 36.06 +++ +++ +* + + + +
Angle PSI PHE 147 -51.00 -31.00 12 13.20 43.39 +++ *++ + +++ + +
Angle PHI LYS 148 -74.00 -54.00 12 10.75 34.44 ++++ ++++ +++ *
Angle PSI LYS 148 -49.00 -29.00 10 7.52 31.45 + + +*+ ++++ +
Angle PHI LYS 149 -74.00 -54.00 10 6.51 43.66 ++ ++*+ ++ ++
Angle PSI LYS 149 -49.00 -29.00 7 4.89 19.02 *+++ + ++
Angle PHI ILE 150 -74.00 -54.00 7 3.77 8.68 + ++ + + +*
Angle PSI ILE 150 -52.00 -32.00 6 2.89 8.16 * + + + + +
Angle PHI GLU 152 -76.00 -56.00 9 5.16 10.52 * + + +++ + + +
12 violated distance constraints.
153 violated angle constraints.
RMSDs for residues 18..164:
Average backbone RMSD to mean : 8.62 +/- 1.82 A (5.97..12.28 A)
Average heavy atom RMSD to mean : 9.13 +/- 1.71 A (6.72..12.64 A)