Structural statistics: str target upper limits van der Waals torsion angles function # rms max # sum max # rms max 1 342.43 21 0.1258 2.56 281 175.1 0.79 8713.8674 55.00 2 362.32 19 0.1313 2.94 282 170.9 0.80 9213.7888 51.12 3 363.41 12 0.1186 1.98 320 192.9 0.75 10017.4603 64.86 4 372.69 20 0.1304 2.37 349 198.6 0.75 8313.5129 52.42 5 381.84 16 0.1311 2.73 341 188.5 0.87 9615.4848 66.98 6 384.53 21 0.1304 2.76 294 178.7 0.88 10315.6753 90.60 7 386.30 21 0.1356 3.01 319 188.9 0.98 9713.4796 53.45 8 410.20 20 0.1316 3.44 383 211.7 0.74 8716.2424 72.06 9 419.62 17 0.1373 2.79 354 208.7 0.82 10415.6351 81.88 10 424.28 17 0.1310 3.13 370 205.1 0.84 10318.3539 73.22 11 424.83 19 0.1367 3.10 343 191.2 0.89 10216.4616 62.12 12 432.82 24 0.1406 3.34 306 185.7 0.90 8316.1912 58.84 13 435.58 25 0.1376 2.95 363 211.1 0.98 9316.2553 61.97 14 437.16 23 0.1399 3.07 338 194.7 0.76 10416.5310 56.84 15 437.25 25 0.1350 2.83 338 194.6 0.83 10418.5491 63.25 16 437.27 24 0.1417 3.64 354 196.7 0.78 10115.7207 66.00 17 437.94 19 0.1384 3.03 326 190.7 0.93 10418.0427 84.45 18 438.44 22 0.1370 3.39 381 205.7 0.78 10417.6743 66.60 19 443.68 24 0.1395 2.52 381 210.3 0.90 10417.2112 81.20 20 452.89 31 0.1424 3.01 356 206.3 0.85 9917.5746 94.51 Ave 411.27 21 0.1346 2.93 339 195.3 0.84 9816.1856 67.87 +/- 32.29 4 0.0057 0.38 30 11.8 0.07 7 1.5430 12.49 Min 342.43 12 0.1186 1.98 281 170.9 0.74 8313.4796 51.12 Max 452.89 31 0.1424 3.64 383 211.7 0.98 10418.5491 94.51 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 3.90 11 1.50 1.98 + + ++ + ++++* + peak 2148 HA VAL 31 - HB ILE 32 HA VAL 31 - HG3 PRO 157 Upper HA LEU 17 - H ILE 102 3.51 8 1.57 3.13 ++ ++ * + ++ peak 467 HA VAL 100 - H ILE 102 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 HD21 ASN 19 - HB2 GLU 70 3.64 8 1.19 2.61 ++ + * ++ + + peak 618 HD21 ASN 19 - HB VAL 71 HD21 ASN 19 - HB3 MET 111 HG LEU 76 - HA GLU 85 HA GLU 85 - HB2 GLU 105 HA GLU 85 - HB3 ARG 137 Upper QG2 VAL 20 - H GLY 101 3.90 6 0.90 2.23 ++ ++ *+ peak 582 HG13 ILE 42 - H GLY 101 QD1 ILE 42 - H GLY 101 QG2 THR 46 - H GLY 101 H GLY 101 - QG2 VAL 103 QG2 VAL 31 - HB3 LEU 84 HB3 LEU 84 - HG3 ARG 137 Upper HA ASN 33 - H ASN 86 3.23 6 1.06 1.91 * + + + ++ peak 696 HA LEU 36 - H ASN 86 HA ASP 37 - H ASN 86 HA ARG 38 - H ASN 86 HA LYS 68 - H ASN 86 H ASN 86 - HA PRO 124 H VAL 22 - H LEU 76 H LEU 76 - H SER 81 Upper HA ASN 33 - H ASN 86 3.13 6 1.19 2.10 + +* ++ + peak 199 HA LEU 36 - H ASN 86 HA ASP 37 - H ASN 86 HA ARG 38 - H ASN 86 HA LYS 68 - H ASN 86 H ASN 86 - HA PRO 124 HB3 ASP 82 - H LEU 84 Upper HA GLU 41 - HB ILE 42 4.30 8 1.21 1.81 + * + ++ ++ + peak 271 HB ILE 42 - HA ASP 88 HB ILE 42 - HA GLU 105 Upper HA GLU 41 - HB2 LEU 84 3.51 7 1.26 1.95 + ++* + + + peak 482 HB2 LEU 84 - HA ALA 89 HB2 LEU 84 - HA LYS 121 HB2 LEU 84 - HA LEU 138 HB2 LEU 84 - HA PHE 143 HB2 CYS 62 - HD2 HIS 139 HD2 HIS 139 - HB3 PHE 147 Upper H THR 46 - HG13 ILE 102 3.90 8 1.16 3.44 * ++ ++++ + peak 1450 HA LYS 74 - H GLU 152 Upper HA THR 46 - H THR 115 4.03 8 1.39 2.06 + + + ++ ++* peak 1537 HA2 GLY 101 - H THR 115 HA VAL 113 - H THR 115 HB3 ASN 19 - HE1 TRP 130 HD3 ARG 97 - HE1 TRP 130 HB2 ASP 106 - HE1 TRP 130 Upper HB THR 46 - QD PHE 50 3.75 6 1.08 2.67 + + * +++ peak 594 QD PHE 50 - HA LEU 87 QD PHE 50 - HA VAL 90 QD PHE 50 - HD2 PRO 157 QD1 LEU 84 - HD2 ARG 97 Upper HD2 PRO 48 - H CYS 62 4.34 13 1.73 3.14 ++++ ++++++* + + peak 251 HD2 PRO 48 - H MET 77 HD2 PRO 48 - H ALA 112 HD2 PRO 48 - H GLN 158 HD2 PRO 40 - HG13 ILE 63 HD2 PRO 40 - HB3 LEU 84 Upper H ILE 63 - QD1 LEU 87 4.15 6 1.04 2.75 ++ * + + + peak 2330 H ILE 63 - QD2 LEU 84 QD2 LEU 84 - QE TYR 116 QD2 LEU 84 - H LYS 140 Upper H ILE 63 - QD1 LEU 87 3.88 6 0.94 2.65 ++ + + + * peak 654 QD1 LEU 87 - QE TYR 116 QD1 LEU 87 - H LYS 140 H LEU 59 - HD1 TRP 130 H VAL 98 - HD1 TRP 130 Upper HA GLU 83 - HB2 LEU 84 3.51 13 1.61 2.65 ++ +++ + + * ++ ++ + peak 2109 HB2 LEU 84 - HA ARG 137 HA ARG 137 - HD3 LYS 148 Upper HG LEU 84 - H VAL 103 3.94 6 1.00 2.09 * ++ + ++ peak 1118 H VAL 103 - HG2 ARG 104 VdW O VAL 20 - N LEU 76 2.75 12 0.33 0.98 ++ +++++ ++* ++ VdW O VAL 20 - H LEU 76 1.80 8 0.20 0.69 + +++ + * ++ VdW CG2 VAL 22 - C VAL 22 2.90 6 0.10 0.33 + + + + +* VdW O TYR 23 - C GLY 24 2.80 6 0.11 0.42 + + +* ++ VdW O PHE 26 - CB GLN 27 2.90 6 0.09 0.52 ++ +* + + VdW HA ASP 28 - CD PRO 29 2.60 6 0.10 0.31 + +* +++ VdW CB ASP 28 - CD PRO 29 3.20 7 0.21 0.82 + + *+ + + + VdW CB ASP 28 - HD2 PRO 29 2.60 7 0.19 0.87 + + + *+++ VdW O VAL 31 - N VAL 34 2.75 6 0.12 0.44 + ++ *++ VdW CG2 ILE 32 - CD1 ILE 32 3.00 9 0.18 0.33 +*+ + +++ ++ VdW CG2 ILE 32 - C ILE 32 2.90 14 0.23 0.33 *+ +++++ + + + ++++ VdW O ASN 33 - HA ASP 37 2.30 8 0.17 0.53 + +++ + ++ * VdW CG1 VAL 34 - C VAL 34 2.90 8 0.11 0.33 +++ + ++* + VdW O LEU 36 - CB ASP 37 2.90 8 0.15 0.47 ++* + + ++ + VdW CB ARG 38 - H THR 39 2.55 6 0.11 0.40 ++ + * ++ VdW HA THR 39 - CD PRO 40 2.60 10 0.20 0.30 + ++ +++ *+ ++ VdW CG1 ILE 42 - C ILE 42 2.90 7 0.16 0.33 + *++ +++ VdW CD1 ILE 42 - C ILE 42 3.10 8 0.15 0.53 * ++ + + + ++ VdW HA LEU 47 - CD PRO 48 2.60 6 0.11 0.31 + + +*+ + VdW HB2 LEU 47 - HD2 PRO 48 2.00 6 0.15 0.75 ++ + + * + VdW CD2 LEU 47 - C LEU 47 3.10 9 0.17 0.60 + ++++ *+ + + VdW O PRO 48 - C GLY 49 2.80 8 0.17 0.47 ++ + + + *++ VdW HA PHE 50 - O VAL 64 2.30 9 0.19 0.63 ++ + + *+++ + VdW HB2 PHE 50 - CG2 ILE 63 2.60 6 0.15 0.52 + ++* ++ VdW CD1 PHE 50 - C PHE 50 3.10 6 0.13 0.61 ++* + ++ VdW CD2 PHE 50 - CG2 ILE 63 3.20 6 0.10 0.40 + *+++ + VdW N GLN 51 - O VAL 64 2.75 6 0.12 0.67 + * ++ + + VdW O GLN 51 - HA ILE 63 2.30 10 0.27 0.75 +* +++ +++ + + VdW HA ARG 52 - O CYS 62 2.30 7 0.15 0.54 + + + ++ + * VdW N PHE 53 - CD1 PHE 53 3.05 7 0.11 0.46 + +* + ++ + VdW CB TYR 60 - CD PRO 61 3.20 19 0.44 0.85 +++ +++++++++++++++* VdW CB TYR 60 - HD2 PRO 61 2.60 7 0.17 0.83 + + + *+ + + VdW CB TYR 60 - HD3 PRO 61 2.60 11 0.19 0.54 + ++ ++++ + + +* VdW HB2 TYR 60 - CD PRO 61 2.60 7 0.14 0.64 ++ +++ + * VdW HB3 TYR 60 - CD PRO 61 2.60 6 0.15 0.74 + + + * + + VdW HB3 TYR 60 - HD2 PRO 61 2.00 6 0.11 0.71 + + + *+ + VdW C PRO 61 - SG CYS 62 3.30 8 0.12 0.51 + ++ + + + +* VdW N CYS 62 - SG CYS 62 3.05 7 0.11 0.26 + + * + +++ VdW CG2 ILE 63 - C ILE 63 2.90 9 0.15 0.33 ++* + ++++ + VdW CB VAL 64 - HD2 PRO 65 2.60 8 0.17 0.39 ++ + + + ++* VdW HB VAL 64 - CD PRO 65 2.60 6 0.10 0.43 * + + +++ VdW HB VAL 64 - HD2 PRO 65 2.00 13 0.28 0.69 +++* +++ ++++++ VdW CG2 VAL 64 - C VAL 64 2.90 6 0.10 0.33 +++ + + * VdW N VAL 71 - CG1 VAL 71 2.85 7 0.10 0.24 ++ + +* + + VdW CG2 VAL 71 - C VAL 71 2.90 9 0.15 0.33 ++ + + +* ++ + VdW N HIS 72 - CD2 HIS 72 3.05 7 0.16 0.40 + *+ ++ + + VdW CG2 VAL 79 - N THR 80 3.05 9 0.18 0.55 ++++ + ++ *+ VdW CG2 VAL 79 - H THR 80 2.55 9 0.21 0.76 + +* + + + + ++ VdW C LEU 84 - H ASN 86 2.45 9 0.15 0.42 ++ ++ + *+++ VdW HA GLU 85 - CB ALA 89 2.60 8 0.18 0.63 + + *+ + + ++ VdW CG1 VAL 90 - C VAL 90 2.90 8 0.16 0.33 ++ ++ + + *+ VdW O VAL 90 - C GLU 91 2.80 6 0.10 0.47 + + + ++* VdW CG2 VAL 98 - C VAL 98 2.90 8 0.13 0.33 + ++ + + ++* VdW CG2 VAL 98 - N THR 99 3.05 6 0.10 0.51 + + + + * + VdW HA THR 99 - HA LYS 114 2.00 6 0.13 0.54 + + + * + + VdW N VAL 100 - O VAL 113 2.75 6 0.15 0.61 +++ + * + VdW CG2 VAL 100 - C VAL 100 2.90 6 0.10 0.33 + + * + + + VdW O VAL 100 - O VAL 113 2.60 7 0.18 0.75 + + ++* + + VdW O ASP 106 - CB ASN 107 2.90 7 0.17 0.60 * ++ + + + + VdW C ASN 107 - H GLU 109 2.45 6 0.14 0.69 ++ +* + + VdW O SER 108 - CB GLU 109 2.90 7 0.15 0.59 +++ *+ + + VdW CG TRP 118 - O TRP 118 2.90 6 0.13 0.66 ++ *+ + + VdW C ILE 119 - H LYS 121 2.45 6 0.11 0.40 + + + * + + VdW O ASN 120 - CB LYS 121 2.90 9 0.16 0.53 +*+ ++++ + + VdW O PRO 124 - CB ASP 125 2.90 6 0.12 0.54 ++ ++ + * VdW C TRP 135 - H ARG 137 2.45 8 0.17 0.71 ++ ++*+ + + VdW O LYS 136 - C ARG 137 2.80 6 0.12 0.30 ++ + +* + VdW C LYS 140 - H LYS 142 2.45 6 0.11 0.63 + + + + + * VdW O ILE 144 - C GLU 145 2.80 7 0.11 0.39 + ++* + + + VdW O ILE 144 - N PHE 147 2.75 8 0.15 0.45 + +*++ + ++ VdW HA LYS 148 - CE LYS 148 2.60 6 0.13 0.65 ++ + *+ + VdW CG2 ILE 150 - C ILE 150 2.90 12 0.21 0.33 ++ + ++++ ++ ++ * VdW CG2 ILE 150 - N MET 151 3.05 10 0.17 0.41 * + ++ + + +++ + Angle PSI HIS 18 139.00 159.00 11 7.96 30.37 +++ + ++ + * + ++ Angle PSI ASN 19 126.00 156.00 11 9.74 54.91 + ++ + *++++++ Angle PHI VAL 20 -132.00 -112.00 14 13.25 34.97 ++++ ++ + +++ *+++ Angle PSI VAL 20 124.00 144.00 8 11.58 46.69 + +++ + *+ + Angle PHI PHE 21 -129.00 -95.00 14 14.80 56.84 + + + + ++ +*++++++ Angle PSI PHE 21 124.00 148.00 11 8.67 43.28 + + + ++++* +++ Angle PHI VAL 22 -139.00 -103.00 12 13.84 52.10 + + *+ + ++++ ++ + Angle PSI VAL 22 135.00 169.00 13 12.39 36.51 ++ +++ ++ ++++* + Angle PHI TYR 23 -141.00 -87.00 9 6.44 24.66 + +++ + +++ * Angle PSI TYR 23 130.00 164.00 9 5.70 17.72 ++ +++ + ++ * Angle PSI PRO 29 -39.00 -29.00 13 10.05 32.23 + + ++ + ++ *+++++ Angle PHI VAL 31 -76.00 -56.00 14 15.05 73.22 +++ +++*+ ++ ++ ++ Angle PSI VAL 31 -53.00 -31.00 12 9.87 51.68 ++ + ++ + + ++*++ Angle PHI ILE 32 -73.00 -53.00 12 10.39 32.12 ++ + ++ *++++++ Angle PSI ILE 32 -54.00 -34.00 8 7.66 51.94 + + ++ + *+ + Angle PHI ASN 33 -74.00 -54.00 9 8.79 63.25 + +++ + * ++ + Angle PSI ASN 33 -52.00 -32.00 15 10.39 43.96 ++++++* +++++ + ++ Angle PHI VAL 34 -81.00 -61.00 12 9.95 25.75 +++++* ++ + +++ Angle PSI VAL 34 -51.00 -31.00 11 6.75 20.27 +* +++ ++ ++ ++ Angle PHI MET 35 -78.00 -58.00 11 7.37 19.11 + ++ + ++ +++ + * Angle PHI THR 39 -125.00 -97.00 12 8.90 34.46 +++ +++ + ++*++ Angle PSI THR 39 120.00 150.00 11 13.15 55.33 ++++ ++ *++ ++ Angle PSI PRO 40 116.00 150.00 17 15.89 34.93 *+++++ ++ +++++++++ Angle PHI ILE 42 -128.00 -98.00 8 6.74 21.33 ++ + ++ + *+ Angle PSI ILE 42 123.00 143.00 8 8.12 40.33 + + ++ *+ + + Angle PHI VAL 43 -130.00 -110.00 14 8.27 23.19 + +++++ + ++ +*+++ Angle PSI VAL 43 120.00 146.00 16 18.78 84.45 + +++++ ++++++*+++ Angle PHI SER 44 -115.00 -77.00 16 16.94 57.40 ++++ + +++++ ++++ *+ Angle PSI SER 44 123.00 143.00 10 10.28 51.49 + + + ++ *+ ++ + Angle PHI ALA 45 -145.00 -125.00 15 12.25 35.18 +++ +++ + +*++++++ Angle PSI ALA 45 131.00 157.00 12 12.73 30.85 + + * + +++++ +++ Angle PHI THR 46 -134.00 -92.00 11 15.18 66.32 ++ ++ + ++ ++*+ Angle PSI THR 46 118.00 138.00 12 14.55 52.84 + + ++ + ++ ++*++ Angle PHI LEU 47 -131.00 -99.00 11 6.07 19.26 + + * ++ ++ ++ + + Angle PSI LEU 47 94.00 144.00 13 17.47 55.56 ++ + +++ + *+++++ Angle PSI PRO 48 136.00 156.00 16 10.97 27.89 ++++++++++ ++ ++ +* Angle PHI PHE 50 -149.00 -103.00 12 10.90 51.45 ++ ++++ +++ + +* Angle PSI PHE 50 145.00 175.00 12 14.71 81.20 +++++ + + ++ +*+ Angle PHI GLN 51 -165.00 -141.00 8 7.10 45.31 ++++ + + + * Angle PSI GLN 51 141.00 167.00 8 4.25 16.45 + + ++ * + ++ Angle PHI ARG 52 -141.00 -101.00 11 7.62 19.35 ++ ++++ + * + ++ Angle PSI ARG 52 118.00 150.00 9 5.85 20.84 ++ +++ + * ++ Angle PHI CYS 62 -151.00 -119.00 7 3.93 18.50 + + + + + +* Angle PSI CYS 62 148.00 170.00 15 11.81 26.98 + +*+++++ ++++++ + Angle PHI ILE 63 -151.00 -129.00 16 16.16 60.82 ++ ++++ *+++++++++ Angle PSI ILE 63 146.00 170.00 7 7.09 34.41 +++ + + * + Angle PHI VAL 64 -148.00 -124.00 7 3.18 16.71 + ++ + ++ * Angle PSI GLU 67 -36.00 -14.00 7 4.38 16.41 + * + + + + + Angle PSI LYS 68 1.00 25.00 9 5.38 17.99 + + ++++ + + * Angle PSI VAL 71 120.00 142.00 11 8.27 28.31 +++ + + + ++*++ Angle PHI LYS 74 -148.00 -128.00 10 8.05 28.27 *+ ++ + ++++ + Angle PSI LYS 74 146.00 170.00 10 8.45 30.23 * ++ ++++++ + Angle PHI VAL 75 -136.00 -112.00 13 8.84 33.06 + + +++++++ +*++ Angle PSI VAL 75 117.00 149.00 7 4.88 28.88 ++* + + + + Angle PHI LEU 76 -116.00 -96.00 14 14.78 33.07 +++ * ++ +++++++ + Angle PSI LEU 76 104.00 128.00 13 12.58 34.45 ++ + *+++ ++ +++ + Angle PHI MET 77 -128.00 -72.00 8 7.97 44.67 *+ + + + ++ + Angle PSI THR 80 159.00 179.00 14 8.15 20.76 ++ ++++*+++ +++ + Angle PHI SER 81 -70.00 -50.00 7 5.92 28.36 * + + + ++ + Angle PSI SER 81 -48.00 -28.00 12 5.65 14.25 + +++++ +++*+ + Angle PHI ASP 82 -77.00 -57.00 12 8.72 24.82 +++ ++ ++ + + *++ Angle PSI ASP 82 -52.00 -32.00 14 13.88 59.09 *+ ++++++ ++ ++ ++ Angle PHI GLU 83 -78.00 -58.00 12 9.63 24.59 ++* ++ ++ + ++++ Angle PSI GLU 83 -49.00 -29.00 9 6.55 29.76 ++ + + + + + *+ Angle PSI LEU 84 -51.00 -31.00 12 11.06 39.32 + + ++ +++ +*+ + + Angle PHI GLU 85 -76.00 -56.00 7 3.94 13.61 + + + + + +* Angle PSI GLU 85 -52.00 -32.00 16 16.40 35.22 ++ +++++++ +++*++ + Angle PHI ASN 86 -76.00 -56.00 13 10.90 24.12 ++++ +++ ++++* + Angle PSI ASN 86 -50.00 -30.00 8 7.58 28.24 +* + ++ +++ Angle PHI LEU 87 -72.00 -52.00 19 26.29 47.33 +++++++++++ ++*+++++ Angle PSI LEU 87 -51.00 -31.00 10 13.42 52.29 ++ +*++++ + + Angle PHI ASP 88 -73.00 -53.00 15 17.38 61.41 ++++++ ++*++++ + + Angle PSI ASP 88 -48.00 -28.00 16 15.26 33.76 ++ ++ *+ ++ ++++++++ Angle PHI ALA 89 -73.00 -53.00 8 6.87 29.50 +++ + *+ + + Angle PSI ALA 89 -52.00 -32.00 13 9.05 30.46 + +* + ++ ++++++ + Angle PHI VAL 90 -77.00 -57.00 11 8.23 36.81 +++ + ++*+ + ++ Angle PSI VAL 90 -56.00 -32.00 8 6.11 19.93 + + + ++ * ++ Angle PHI TYR 95 -144.00 -114.00 10 6.84 16.76 +++ + +*+++ + Angle PSI TYR 95 142.00 162.00 10 9.43 34.06 + + * ++ +++ ++ Angle PHI GLU 96 -157.00 -125.00 15 13.93 39.97 +++++++ +* +++ + ++ Angle PSI GLU 96 129.00 163.00 9 13.21 58.84 + + + ++* + ++ Angle PHI ARG 97 -112.00 -88.00 12 12.63 33.98 ++ *+ + +++++++ Angle PSI ARG 97 115.00 135.00 7 10.28 54.68 ++ + + *+ + Angle PHI VAL 98 -147.00 -123.00 11 11.28 40.30 ++ * ++ ++ ++ ++ Angle PSI VAL 98 146.00 170.00 14 15.81 53.20 + +++ +++ ++*+++ + Angle PHI THR 99 -108.00 -88.00 13 9.14 30.67 ++ ++++ + + +*+ ++ Angle PSI THR 99 127.00 151.00 16 17.08 54.33 +++++++++*++ + +++ Angle PHI VAL 100 -148.00 -128.00 9 6.76 41.02 +++++ +* ++ Angle PSI VAL 100 149.00 169.00 15 14.47 36.68 *+++++++++++ + ++ Angle PHI GLY 101 -140.00 -82.00 10 9.58 48.63 + +++ + ++++* Angle PSI GLY 101 123.00 153.00 15 16.12 47.24 +++ ++++++ ++ ++ +* Angle PHI ILE 102 -140.00 -120.00 12 8.43 26.56 ++*+ +++ ++ ++ + Angle PSI ILE 102 136.00 160.00 13 12.48 36.43 + + + ++ ++ + +++ *+ Angle PHI VAL 103 -130.00 -84.00 13 11.00 38.72 ++ + *+++ ++++++ Angle PSI VAL 103 108.00 152.00 10 7.44 29.68 + + + +* + + +++ Angle PHI GLU 105 -69.00 -49.00 6 4.18 26.13 + ++ * + + Angle PSI GLU 105 -55.00 -35.00 13 7.88 19.73 + +++ +++ + +*+++ Angle PHI ASP 106 -81.00 -55.00 6 4.67 26.70 + ++ *+ + Angle PHI SER 108 -88.00 -50.00 7 4.81 25.00 + + ++ *+ + Angle PSI SER 108 -45.00 9.00 8 5.75 26.90 + + + + ++ *+ Angle PHI LYS 110 -109.00 -67.00 11 7.30 23.54 + + +++ +++* ++ Angle PSI LYS 110 125.00 147.00 12 9.81 22.69 + ++++* ++ +++ + Angle PHI MET 111 -157.00 -93.00 8 5.80 25.07 + ++ +* ++ + Angle PSI MET 111 134.00 160.00 11 12.21 40.01 +++ + +* ++ + + + Angle PHI ALA 112 -119.00 -87.00 19 28.81 64.38 ++++ +++++++++++*+++ Angle PSI ALA 112 118.00 144.00 15 15.64 37.59 ++++++ + ++ + ++*++ Angle PHI VAL 113 -146.00 -126.00 10 9.28 32.19 ++ + ++++ + +* Angle PSI VAL 113 147.00 173.00 18 15.37 31.06 +++ ++++*+ +++++++++ Angle PHI LYS 114 -141.00 -95.00 8 7.10 37.14 + + + + +++* Angle PSI LYS 114 134.00 164.00 17 23.57 66.98 ++++*++ +++ +++++++ Angle PHI THR 115 -156.00 -112.00 12 11.71 56.08 + +*+ + ++++ +++ Angle PSI THR 115 123.00 171.00 12 16.65 94.51 + +++ ++ +++++* Angle PHI TYR 116 -125.00 -97.00 12 17.70 48.37 ++ ++ ++++++ + * Angle PSI TYR 116 109.00 139.00 9 11.40 61.98 + *+ + ++++ + Angle PHI MET 117 -141.00 -103.00 13 13.21 53.78 ++++++ ++++ +* + Angle PSI MET 117 113.00 151.00 11 14.72 46.45 + + ++ ++*+ + + + Angle PHI TRP 118 -103.00 -65.00 10 12.92 50.54 + +++ ++++* + Angle PSI TRP 118 113.00 153.00 10 17.16 62.82 + + +++ +++ + * Angle PHI ILE 119 -78.00 -50.00 13 18.07 58.88 ++*+++ ++ + ++ + + Angle PSI ILE 119 -43.00 -21.00 14 18.30 54.19 + + +++++*+ +++ + + Angle PHI ASN 120 -107.00 -79.00 13 19.75 61.31 + + * ++++ + ++ +++ Angle PSI ASN 120 -9.00 11.00 12 10.36 32.46 +++++ ++ +* + ++ Angle PHI TRP 130 -129.00 -85.00 8 3.89 10.85 *+ +++ + + + Angle PSI PHE 132 -54.00 -34.00 8 7.90 33.36 *+ + + + ++ + Angle PHI GLU 133 -73.00 -53.00 9 6.11 19.58 ++ * ++ ++ + + Angle PSI GLU 133 -49.00 -29.00 12 10.09 37.56 + ++ + ++*++ ++ + Angle PHI GLU 134 -77.00 -57.00 11 8.69 48.19 + + + + ++*++ ++ Angle PSI GLU 134 -50.00 -30.00 12 14.79 51.33 ++ + +++ ++*+++ Angle PHI TRP 135 -74.00 -54.00 13 10.98 27.17 +++ +++ ++ +++ +* Angle PSI TRP 135 -52.00 -32.00 11 19.89 81.88 + + +++ * + ++++ Angle PHI LYS 136 -72.00 -52.00 10 11.66 53.02 + ++ + + + +++* Angle PSI LYS 136 -49.00 -29.00 15 21.60 53.45 ++++++*+++ + ++ ++ Angle PHI ARG 137 -74.00 -54.00 16 14.49 55.00 *++++ +++++ +++ +++ Angle PSI ARG 137 -51.00 -31.00 16 15.48 44.31 ++++*++++++ ++ +++ Angle PHI LEU 138 -91.00 -71.00 15 18.47 50.73 ++ +* +++++ ++++++ Angle PSI LEU 138 -45.00 -15.00 15 21.80 40.13 ++++++ + * ++++ ++ + Angle PHI HIS 139 -115.00 -77.00 17 31.20 64.60 ++ ++*+++++++++ ++ + Angle PSI HIS 139 -37.00 5.00 11 11.17 34.59 ++ ++ ++ + +++* Angle PHI LYS 140 -70.00 -50.00 9 7.88 30.22 ++++ ++ ++ * Angle PSI LYS 140 -53.00 -33.00 15 20.93 64.86 ++*+ + +++++ ++ +++ Angle PHI LYS 141 -75.00 -55.00 13 17.32 62.24 + *+ +++++ ++ +++ Angle PSI LYS 141 -50.00 -30.00 12 16.71 52.93 ++++ ++++* ++ + Angle PHI LYS 142 -75.00 -55.00 10 10.86 37.21 +*++ ++ + ++ + Angle PSI LYS 142 -51.00 -31.00 13 12.71 48.61 + +++ +++++++*+ Angle PHI PHE 143 -76.00 -56.00 16 16.79 72.06 ++ ++*+++++++ ++++ Angle PSI PHE 143 -53.00 -33.00 12 13.04 43.28 + + + * +++ +++++ Angle PHI ILE 144 -73.00 -53.00 13 10.46 37.51 + ++++++ * + ++++ Angle PSI ILE 144 -54.00 -34.00 16 36.03 90.60 + ++*+++++ + ++++++ Angle PHI GLU 145 -72.00 -52.00 15 23.16 65.42 + +++++++ + +++*++ Angle PSI GLU 145 -51.00 -31.00 11 6.77 27.01 + + + +++++ *+ + Angle PHI THR 146 -81.00 -61.00 10 8.44 47.17 + + ++ ++ *+ ++ Angle PSI THR 146 -49.00 -29.00 7 5.30 22.41 * ++ ++ + + Angle PHI PHE 147 -76.00 -56.00 8 6.68 21.24 + + ++ + *+ + Angle PHI LYS 148 -74.00 -54.00 6 4.88 20.28 + + + * ++ Angle PSI LYS 148 -49.00 -29.00 8 6.27 27.03 * ++ + +++ + Angle PHI LYS 149 -74.00 -54.00 11 9.79 39.10 ++++ + + * ++++ Angle PSI LYS 149 -49.00 -29.00 14 10.13 36.55 +++ ++ ++++*+ +++ Angle PHI ILE 150 -74.00 -54.00 9 4.67 11.34 + +++*++ + + Angle PSI MET 151 -48.00 -28.00 6 3.06 15.75 ++ + * ++ Angle PHI GLU 152 -76.00 -56.00 10 6.06 14.88 + +++ + + ++ +* 16 violated distance constraints. 160 violated angle constraints. RMSDs for residues 18..164: Average backbone RMSD to mean : 8.30 +/- 1.09 A (6.09..10.40 A) Average heavy atom RMSD to mean : 8.86 +/- 1.05 A (6.64..10.92 A)