Structural statistics: str target upper limits van der Waals torsion angles function # rms max # sum max # rms max 1 80.54 48 0.1153 1.26 52 54.2 0.43 6913.2454 79.70 2 92.10 50 0.1409 1.90 84 67.3 0.70 5912.6755 65.37 3 97.42 40 0.1358 1.76 75 61.4 0.65 6513.8721 67.36 4 97.87 49 0.1716 2.02 89 69.6 0.56 7211.6218 57.94 5 99.32 51 0.1394 1.42 79 63.6 0.50 7313.9335 65.42 6 99.49 59 0.1492 1.30 80 67.5 0.80 7513.3201 67.82 7 100.13 58 0.1434 1.81 87 68.2 0.54 7713.6645 61.58 8 100.18 64 0.1658 1.82 82 66.7 0.52 6612.6341 64.57 9 101.04 56 0.1666 1.81 98 62.8 0.50 7312.6009 69.61 10 101.91 47 0.1438 1.44 86 69.3 0.48 7113.9402 67.09 11 103.68 62 0.1717 1.78 108 82.5 0.57 7511.6754 56.96 12 104.15 68 0.1825 1.55 97 74.2 0.55 7111.8910 76.61 13 106.37 51 0.1467 1.46 78 65.8 0.64 7314.2197 57.22 14 106.55 55 0.1791 2.40 80 66.5 0.55 6112.7754 60.03 15 107.49 49 0.1288 1.35 96 72.5 0.51 9214.9652 75.20 16 109.39 56 0.1606 1.51 104 68.5 0.53 5213.9912 71.75 17 109.97 51 0.1703 2.08 80 69.4 0.73 7313.5686 55.63 18 110.22 50 0.1544 1.94 85 70.8 0.54 7114.3999 97.92 19 110.49 59 0.1514 1.28 91 70.8 0.58 8114.3949 66.74 20 110.52 51 0.1498 1.49 125 79.0 0.66 7813.7956 54.18 Ave 102.44 54 0.1534 1.67 88 68.5 0.58 7113.3592 66.93 +/- 7.15 6 0.0171 0.30 14 5.9 0.09 8 0.9237 9.92 Min 80.54 40 0.1153 1.26 52 54.2 0.43 5211.6218 54.18 Max 110.52 68 0.1825 2.40 125 82.5 0.80 9214.9652 97.92 Cut 0.30 0.20 5.00 Constraints violated in 6 or more structures: # mean max. 1 5 10 15 20 Upper HB3 LEU 15 - QD PHE 50 4.76 6 0.22 0.87 + + ++ * + peak 17 Upper QD1 LEU 15 - H GLN 51 4.43 8 0.30 1.33 +++*++ + + peak 1169 Upper HB3 LEU 17 - HB3 HIS 18 5.50 12 0.36 0.76 + *++ + ++ +++ + + peak 105 Upper QD1 LEU 17 - HB2 LEU 47 5.10 6 0.21 0.93 ++ * + + + peak 2283 Upper H HIS 18 - HD2 HIS 18 3.91 11 0.56 1.08 + +* +++ ++ + ++ peak 854 Upper HD2 HIS 18 - HB3 ARG 97 5.50 8 0.26 0.83 ++ * + + +++ peak 689 Upper HD2 HIS 18 - HZ3 TRP 118 5.50 14 0.41 0.82 +++ + +++ + + +++*+ peak 502 Upper HE1 HIS 18 - HD22 ASN 19 5.50 15 0.53 1.23 ++ +++++ +++ ++++* peak 1715 Upper H ASN 19 - HB3 ARG 97 4.59 14 0.35 0.83 +++++* ++ ++ +++ + peak 216 Upper H ASN 19 - HD3 ARG 97 3.94 15 0.54 0.98 ++++ + * + ++++++++ peak 211 Upper HD22 ASN 19 - HB3 TYR 116 3.89 13 0.41 1.15 ++ ++ + +++ *++++ peak 1708 Upper H VAL 20 - HB3 LEU 76 3.59 16 0.81 1.41 ++++++ +++++ + +++ * peak 797 Upper QG1 VAL 20 - QD PHE 21 3.26 8 0.28 0.65 + ++ + + * + + peak 134 Upper QG2 VAL 20 - H VAL 113 4.19 7 0.21 0.84 ++ + +* + + peak 892 Upper H VAL 22 - HA ARG 97 4.65 11 0.44 1.42 + + + * + ++ + + ++ peak 1501 Upper QD PHE 26 - QG1 VAL 31 3.99 8 0.30 1.08 ++ +* + ++ + peak 224 Upper HB2 ASP 30 - HB VAL 31 3.62 10 0.52 1.70 ++ +++ *+ + + + peak 44 Upper HB2 ASP 30 - QG1 VAL 31 3.87 6 0.22 0.92 + ++ + + * peak 156 Upper HB2 ASP 30 - H ILE 32 3.50 20 0.95 1.82 +++++++*++++++++++++ peak 381 Upper HB2 ASP 30 - H VAL 34 3.74 7 0.40 1.81 + + +* + + + peak 397 Upper HB3 ASP 30 - H VAL 34 3.94 7 0.35 1.51 ++ * + + ++ peak 398 Upper HB VAL 31 - H ASN 33 3.43 8 0.45 1.53 + +++* ++ + peak 348 Upper HB VAL 31 - H VAL 34 4.31 8 0.47 1.36 + ++ ++ * + + peak 404 Upper HB VAL 31 - HD3 PRO 124 3.91 6 0.38 2.18 + ++ ++ * peak 937 Upper QG1 VAL 31 - HA ILE 32 5.10 11 0.26 0.39 + * + ++ ++++++ peak 1425 Upper QG2 VAL 31 - H CYS 153 4.48 10 0.27 0.81 +++ + + + + ++* peak 1740 HG2 ARG 137 - H CYS 153 Upper H ASN 33 - QB ALA 122 4.93 6 0.25 1.09 + * + + + + peak 347 Upper HB2 ASN 33 - H ASP 125 4.19 6 0.21 0.78 + + ++ * + peak 1093 Upper H VAL 34 - H ASP 125 5.23 9 0.33 1.26 * +++ + ++ + + peak 1099 Upper H ILE 42 - HG13 ILE 42 3.33 8 0.41 1.13 * + ++++ ++ peak 55 Upper HG13 ILE 42 - H VAL 75 4.16 6 0.22 0.46 *+ + + + + peak 829 Upper HA ALA 45 - HG2 MET 77 4.31 7 0.25 1.21 + + + + + +* peak 1794 HA ALA 45 - HG3 MET 77 Upper QB ALA 45 - HA VAL 75 4.85 7 0.28 0.98 + *++++ + peak 278 Upper H LEU 47 - H GLY 78 4.88 6 0.18 0.78 + + + * ++ peak 664 Upper HB2 LEU 47 - HH2 TRP 118 5.50 8 0.24 0.86 ++ ++ + * + + peak 2286 Upper HB3 LEU 47 - HZ3 TRP 118 5.50 10 0.32 0.78 + + +++ + *+ ++ peak 380 Upper HB3 LEU 47 - HH2 TRP 118 4.75 8 0.27 0.74 + + +++++ * peak 351 Upper HG LEU 47 - HB2 PHE 50 4.76 7 0.23 0.73 + + + *+ + + peak 1564 HG LEU 47 - HB3 PHE 50 Upper HG LEU 47 - QD PHE 50 4.34 8 0.24 0.68 + + * ++ ++ + peak 176 Upper QD1 LEU 47 - H GLN 51 5.50 10 0.34 0.83 ++ * ++ + + ++ + peak 1173 Upper QD2 LEU 47 - H GLY 78 4.76 6 0.18 0.82 + + * + ++ peak 1531 Upper H GLY 49 - H PHE 50 3.00 6 0.17 0.62 ++++ + * peak 365 Upper H GLY 49 - HB3 GLN 51 4.72 7 0.32 2.40 + + ++ * + + peak 1182 Upper H GLY 49 - HG3 GLU 85 4.08 16 0.70 1.37 + *+++ ++++++++++ + peak 1180 Upper HA3 GLY 49 - QD PHE 50 4.28 10 0.38 0.93 ++ + + * + ++ ++ peak 179 Upper HA3 GLY 49 - QG2 VAL 64 5.18 7 0.32 1.43 + ++ + + *+ peak 1756 Upper H PHE 50 - H SER 66 4.24 11 0.36 1.44 + ++++ *++ ++ + peak 1258 Upper H PHE 50 - HB3 GLU 85 4.59 9 0.29 0.84 + + + ++ *+++ peak 1731 Upper H PHE 50 - QD1 LEU 87 4.90 12 0.48 1.43 + +* ++ + ++ ++ ++ peak 1735 Upper H THR 80 - H LEU 84 4.65 14 0.74 2.02 +++* +++++ + + + + + peak 206 Upper H LEU 84 - QB ALA 89 5.20 9 0.56 1.90 *+ ++ + + + + + peak 202 Upper H LEU 84 - QG1 VAL 90 4.92 10 0.31 0.95 + +++ + + *+ ++ peak 201 Upper H LEU 84 - QG2 VAL 90 4.56 7 0.33 1.15 + + + * + ++ peak 197 Upper HG LEU 84 - QG1 VAL 90 4.08 7 0.41 2.08 + + + + + * + peak 590 Upper HB2 LEU 87 - HA THR 115 5.50 9 0.39 1.01 +*+ ++ + + ++ peak 2308 Upper QD1 LEU 87 - H TYR 116 5.26 10 0.26 0.70 +++++ + * + + + peak 147 Upper HA ASP 88 - H THR 115 4.15 14 0.66 1.94 ++ ++++ ++ + ++*++ peak 549 Upper H ALA 89 - HA THR 115 4.00 11 0.46 1.16 ++ +++ ++* ++ + peak 1134 Upper H GLU 96 - HB VAL 113 4.71 18 0.57 1.41 ++++++++ +* ++++++++ peak 440 Upper H GLU 96 - H ILE 119 4.87 14 0.53 1.35 + +++ +++++++ *+ + peak 889 Upper HA GLU 96 - HB ILE 119 5.45 7 0.27 0.84 + + + ++ +* peak 1996 Upper H VAL 98 - HB VAL 113 4.24 19 1.03 1.54 ++++++*+++++++++++ + peak 114 Upper HA ASP 106 - H SER 108 2.99 17 0.41 0.72 +++++ ++++*+ +++++ + peak 604 Upper QG2 VAL 113 - HB2 LYS 114 5.50 6 0.18 0.72 + + * + ++ peak 870 Upper HG3 LYS 121 - H ASP 123 3.63 8 0.29 0.69 *++ + + + + + peak 728 HD3 LYS 121 - H ASP 123 Upper HA GLU 133 - HA ILE 150 2.81 16 0.47 1.51 +++ +++ +++++++*++ peak 962 Upper H GLU 134 - HA ILE 150 4.68 13 0.40 1.20 + + ++ +++ + *++++ peak 178 Upper HB3 LYS 136 - H HIS 139 4.58 16 0.35 0.55 +*+++++ + +++ +++ ++ peak 535 Upper H ARG 137 - HD3 LYS 141 3.91 12 0.30 0.46 + ++++++ ++ +* + peak 1374 Upper HB3 ARG 137 - H LYS 154 4.73 9 0.28 0.76 ++ + +++ *+ + peak 258 Upper HA MET 151 - H CYS 153 4.22 12 0.33 0.59 ++ ++++++ ++ * + peak 475 VdW CG HIS 18 - C HIS 18 2.90 8 0.10 0.25 + + ++ + ++ * VdW CG2 VAL 20 - C VAL 20 2.90 8 0.12 0.33 *+ + + ++ ++ VdW O VAL 20 - HA ARG 97 2.30 7 0.14 0.50 + + + +++* VdW O VAL 20 - N VAL 98 2.75 6 0.12 0.39 * + +++ + VdW CG PHE 21 - C PHE 21 2.90 8 0.15 0.25 ++ +* + +++ VdW CB ASP 28 - CD PRO 29 3.20 7 0.12 0.47 ++ ++ + * + VdW CB ASP 30 - H VAL 31 2.55 12 0.16 0.36 +++ + * + + +++++ VdW HB3 ASP 30 - N VAL 31 2.45 10 0.13 0.28 +++ * + + + ++ + VdW HB3 ASP 30 - H VAL 31 1.95 10 0.14 0.33 +++ * + + + ++ + VdW O LEU 36 - CB ASP 37 2.90 6 0.11 0.37 + +*++ + VdW HA THR 39 - CD PRO 40 2.60 8 0.20 0.30 * + ++ +++ + VdW HG12 ILE 42 - C ILE 42 2.50 7 0.16 0.35 + + + *+ ++ VdW HA LEU 47 - CD PRO 48 2.60 13 0.21 0.31 ++ ++++ + ++* +++ VdW CD1 LEU 47 - O LEU 47 2.90 7 0.20 0.56 + +*+ +++ VdW CD2 LEU 47 - C LEU 47 3.10 8 0.17 0.40 + ++ +*+ + + VdW HA VAL 64 - CD PRO 65 2.60 8 0.16 0.24 +++ ++ * ++ VdW CB VAL 79 - H THR 80 2.55 10 0.17 0.42 + +++ +* + + + + VdW HB VAL 79 - H THR 80 1.95 6 0.09 0.32 + + +* + + VdW O THR 80 - N GLU 83 2.75 7 0.12 0.33 ++ + + + * + VdW C GLU 83 - N GLU 85 2.95 8 0.15 0.40 * + ++ + + + + VdW C GLU 83 - H GLU 85 2.45 7 0.16 0.55 + + +++ * + VdW O GLU 83 - N GLU 85 2.75 8 0.16 0.70 * + ++ + + + + VdW C GLU 85 - H LEU 87 2.45 6 0.12 0.44 ++ * + + + VdW CB ASN 86 - H LEU 87 2.55 6 0.11 0.40 + + * + + + VdW O ASN 86 - C LEU 87 2.80 9 0.17 0.46 +* +++ + + + + VdW O ASN 86 - N ALA 89 2.75 6 0.14 0.61 + ++ + * + VdW CB ASP 88 - HA THR 115 2.60 7 0.16 0.43 ++ + * + + + VdW N VAL 90 - CG2 VAL 90 2.85 7 0.14 0.24 + + + + ++ * VdW H VAL 90 - CG2 VAL 90 2.55 12 0.24 0.43 ++ *+++ + ++ + ++ VdW CG1 VAL 113 - C VAL 113 2.90 9 0.13 0.33 + + + + +++ +* VdW C LYS 114 - OG1 THR 115 2.80 7 0.08 0.23 + + +* + + + VdW O LYS 114 - CB THR 115 2.90 16 0.25 0.42 ++ ++* ++ ++ +++++++ VdW O LYS 114 - OG1 THR 115 2.60 11 0.17 0.40 ++ +* ++ + + ++ + VdW O LYS 114 - CG2 THR 115 2.90 6 0.13 0.48 + + + + *+ VdW N TRP 118 - CG TRP 118 2.85 13 0.20 0.22 +++++ * +++ ++ + + VdW H TRP 118 - CG TRP 118 2.55 11 0.21 0.42 + ++ +++++* + + VdW C ASN 120 - H ALA 122 2.45 6 0.16 0.46 + + + *++ VdW O ALA 122 - CB ASP 123 2.90 6 0.11 0.54 * + + ++ + VdW O GLU 133 - HB2 ARG 137 2.30 9 0.17 0.43 + +++ +* ++ + VdW C LYS 136 - N LEU 138 2.95 17 0.21 0.23 + +++++ +++++*+++++ VdW C LYS 136 - H LEU 138 2.45 18 0.25 0.32 ++++++++++*+++++++ VdW C ARG 137 - HD2 LYS 141 2.50 19 0.31 0.45 ++++*+++++ +++++++++ VdW O HIS 139 - CB LYS 142 2.90 7 0.17 0.32 + * ++ + + + VdW HA LYS 141 - CB GLU 145 2.60 7 0.15 0.30 ++++ *+ + VdW CB LYS 141 - HG12 ILE 150 2.60 6 0.10 0.31 + + ++ * + VdW O LYS 141 - N THR 146 2.75 8 0.12 0.30 * ++ + ++ ++ VdW CB PHE 143 - H ILE 144 2.55 16 0.23 0.34 +++ +++ +++++ +*+ ++ VdW CG2 ILE 144 - CD1 ILE 144 3.00 20 0.28 0.33 +++++*++++++++++++++ VdW CG2 ILE 150 - C ILE 150 2.90 11 0.17 0.33 +++ +++ ++ + +* Angle PHI HIS 18 -140.00 -116.00 8 4.10 13.66 ++ + *+ + ++ Angle PSI HIS 18 138.00 158.00 13 9.28 23.89 ++++ * ++ ++ ++++ Angle PHI ASN 19 -138.00 -88.00 11 9.41 22.25 ++*++ + + ++++ Angle PSI ASN 19 124.00 156.00 9 5.48 20.39 + + + + + + ++ * Angle PHI VAL 20 -133.00 -113.00 6 3.49 19.15 + + + + +* Angle PSI VAL 20 118.00 144.00 6 4.64 28.90 ++ + + + * Angle PHI PHE 21 -128.00 -94.00 7 4.60 26.01 + + + + + *+ Angle PSI PRO 29 -39.00 -29.00 19 13.11 32.23 ++++++++++ ++++++++* Angle PHI ASP 30 -76.00 -56.00 17 11.00 26.70 +++ +* ++++++++++++ Angle PSI ASP 30 -48.00 -28.00 17 33.62 61.58 ++++++* ++ ++ ++++++ Angle PHI VAL 31 -76.00 -56.00 20 46.14 59.46 ++++++*+++++++++++++ Angle PSI VAL 31 -53.00 -31.00 17 25.75 42.52 ++++++++ ++ + +++++* Angle PHI ILE 32 -73.00 -53.00 17 40.52 59.91 ++*+++++ ++ + ++++++ Angle PHI ASN 33 -74.00 -54.00 16 7.11 15.69 ++ ++* +++ ++ ++++++ Angle PHI VAL 34 -81.00 -61.00 11 6.76 31.48 ++ ++* +++ + ++ Angle PSI ILE 42 124.00 144.00 13 7.69 20.54 ++ ++ *+++ + + +++ Angle PHI VAL 43 -132.00 -112.00 9 4.80 18.03 + ++ *++ + ++ Angle PSI VAL 43 115.00 145.00 9 5.33 19.48 +++ ++ + *++ Angle PHI SER 44 -113.00 -77.00 12 6.40 18.93 +++ +++ *++ + ++ Angle PSI ALA 45 131.00 157.00 9 6.21 38.88 + ++ +* + + ++ Angle PHI THR 46 -134.00 -92.00 6 3.66 16.18 * +++ + + Angle PSI THR 46 118.00 138.00 12 7.80 23.35 +*+ + + ++ + +++ + Angle PHI LEU 47 -131.00 -99.00 9 6.57 28.87 + +++ + + +*+ Angle PSI LEU 47 93.00 143.00 6 3.60 21.25 + ++ ++* Angle PSI PRO 48 133.00 147.00 7 5.49 26.26 + + +++ *+ Angle PHI PHE 50 -149.00 -103.00 8 5.79 29.06 + + + + +*+ + Angle PSI PHE 50 145.00 175.00 6 5.66 25.87 ++++ + * Angle PHI GLN 51 -164.00 -140.00 6 4.41 11.42 +++ + + * Angle PHI VAL 64 -151.00 -127.00 6 3.96 21.90 ++ + + + * Angle PHI VAL 71 -140.00 -110.00 6 2.87 8.13 *+++ + + Angle PSI LYS 74 148.00 172.00 13 8.83 26.50 + ++ + + +++* ++++ Angle PHI VAL 75 -138.00 -108.00 17 11.75 29.22 +++++ ++ ++++++ +*++ Angle PSI VAL 75 116.00 146.00 15 9.12 26.78 +++ +++++ ++++ +*+ Angle PHI LEU 76 -116.00 -96.00 16 11.22 42.32 +++ ++++++++ + ++*+ Angle PSI LEU 76 104.00 128.00 6 2.77 9.61 + + + * + + Angle PSI MET 77 118.00 174.00 7 4.33 15.17 +++ + + +* Angle PHI THR 80 -117.00 -71.00 11 6.79 18.20 + + + + +++++ *+ Angle PSI THR 80 159.00 179.00 14 10.25 26.34 + *+++ ++ + +++++ + Angle PHI SER 81 -70.00 -50.00 10 5.59 28.09 +++ + +++ + *+ Angle PSI SER 81 -47.00 -27.00 7 5.48 21.53 + + + + ++* Angle PHI ASP 82 -77.00 -57.00 6 6.52 48.69 * + + ++ + Angle PSI ASP 82 -50.00 -30.00 12 9.28 38.69 ++*+++ + + + + ++ Angle PHI GLU 83 -79.00 -59.00 10 6.13 22.82 + ++ + +++ * + + Angle PSI GLU 83 -49.00 -29.00 18 16.92 46.66 +++ +++ ++++++*+++++ Angle PHI LEU 84 -74.00 -54.00 15 14.87 75.20 +++ ++ + +++ *+++++ Angle PSI LEU 84 -52.00 -32.00 14 14.11 32.78 + ++ +++++ +*+ ++ + Angle PHI GLU 85 -75.00 -55.00 11 10.17 28.53 ++++ ++++ +* + Angle PSI GLU 85 -51.00 -31.00 14 18.82 65.42 +++*+ + + +++++++ Angle PHI ASN 86 -76.00 -56.00 12 15.92 60.03 +++ ++ + +* +++ + Angle PSI ASN 86 -52.00 -32.00 18 41.24 79.70 *+++ ++++++++++++ ++ Angle PHI LEU 87 -72.00 -52.00 16 34.04 76.61 +++++++ ++*++++ ++ Angle PSI LEU 87 -51.00 -31.00 13 21.31 97.92 ++ +++++++ + +*+ Angle PHI ASP 88 -72.00 -52.00 13 15.86 51.49 ++++ ++ + *+ ++++ Angle PSI ASP 88 -50.00 -30.00 9 5.51 23.96 + +++ + + *++ Angle PHI ALA 89 -73.00 -53.00 10 6.77 22.79 * + +++ + + +++ Angle PSI ALA 89 -52.00 -32.00 9 7.19 35.87 + ++++ + + + * Angle PHI VAL 90 -76.00 -56.00 13 8.10 22.56 ++ +++ +++++ ++ * Angle PSI GLU 91 -43.00 -1.00 6 4.07 16.04 +++ + * + Angle PSI TYR 95 143.00 163.00 12 6.53 14.89 + +++ ++++*+ ++ Angle PHI VAL 98 -133.00 -111.00 6 3.75 20.41 + +++ + * Angle PSI LYS 110 126.00 148.00 7 4.06 17.42 + * + ++ ++ Angle PHI MET 111 -155.00 -93.00 6 4.21 21.41 + * ++ ++ Angle PHI ALA 112 -118.00 -86.00 7 4.53 14.71 ++++ * + + Angle PHI VAL 113 -146.00 -126.00 11 6.45 19.15 + ++ ++++ + +* + Angle PSI VAL 113 147.00 173.00 10 6.03 16.82 + ++++ + * + + + Angle PSI LYS 114 134.00 164.00 20 37.85 48.99 +++++++++++++++++++* Angle PHI THR 115 -163.00 -113.00 20 38.68 63.21 ++*+++++++++++++++++ Angle PSI THR 115 124.00 174.00 6 3.70 24.01 + + * ++ + Angle PHI TYR 116 -124.00 -96.00 10 6.47 19.54 + + ++ ++* + ++ Angle PSI TYR 116 108.00 138.00 19 22.14 33.73 ++ +++++++++*+++++++ Angle PHI MET 117 -145.00 -107.00 20 18.51 50.32 ++++++++++++*+++++++ Angle PSI MET 117 118.00 156.00 7 5.16 17.70 + *++++ + Angle PSI TRP 118 117.00 157.00 16 11.69 25.82 + ++++++*+++ ++++ + Angle PHI ILE 119 -72.00 -52.00 11 6.34 14.23 + +++++* ++ + + Angle PHI ASN 120 -104.00 -78.00 9 5.21 14.49 + + ++ +++ + * Angle PSI ASN 120 -11.00 9.00 12 7.93 18.79 + ++ ++++ + *++ + Angle PSI PHE 132 -54.00 -34.00 11 5.65 15.73 * + ++ + ++ + +++ Angle PHI GLU 133 -76.00 -56.00 7 4.63 11.54 * ++ ++ ++ Angle PSI LYS 136 -52.00 -32.00 17 7.91 14.97 + ++ ++++++++*+ ++++ Angle PHI ARG 137 -74.00 -54.00 9 5.15 10.11 + +++ *++ ++ Angle PSI ARG 137 -51.00 -31.00 20 13.95 19.07 ++++++++++*+++++++++ Angle PSI LEU 138 -45.00 -15.00 20 22.82 26.97 +++++++++++++*++++++ Angle PHI HIS 139 -107.00 -71.00 20 34.89 38.87 +++++++++++++++++*++ Angle PSI LYS 141 -51.00 -31.00 9 4.82 10.18 + ++* + +++ + Angle PHI LYS 142 -75.00 -55.00 17 8.17 12.56 +*+++++ + +++++ ++++ Angle PSI LYS 142 -49.00 -29.00 9 4.41 8.32 + ++* +++ ++ Angle PSI PHE 143 -54.00 -34.00 20 38.94 50.92 +++++++++++++++*++++ Angle PHI ILE 144 -73.00 -53.00 20 41.46 46.99 *+++++++++++++++++++ Angle PSI GLU 145 -51.00 -31.00 15 7.43 14.19 ++++++++++*+ + ++ Angle PHI THR 146 -79.00 -59.00 16 8.91 14.81 +++++++++ *++ + + ++ Angle PSI THR 146 -48.00 -28.00 11 7.82 26.96 + + ++ + + + * +++ Angle PHI PHE 147 -77.00 -57.00 16 18.88 32.37 +++++++*+ +++ + + ++ Angle PSI PHE 147 -50.00 -30.00 17 14.18 27.80 ++++++ ++ *++ ++++++ Angle PHI LYS 148 -74.00 -54.00 8 10.55 54.39 + + ++ * + + + Angle PSI LYS 148 -48.00 -28.00 16 22.58 41.16 ++++++++* +++ + + ++ Angle PHI LYS 149 -74.00 -54.00 19 20.60 36.10 ++++ +++++++++*+++++ Angle PSI LYS 149 -48.00 -28.00 13 9.54 27.28 ++ ++ + *+ ++ ++++ Angle PHI ILE 150 -74.00 -54.00 17 7.63 11.87 +*+++++++ +++ + ++++ Angle PSI ILE 150 -52.00 -32.00 12 5.32 13.02 ++* ++ +++ + + ++ Angle PHI MET 151 -76.00 -56.00 18 8.58 18.42 ++++*+++ ++++ ++++++ Angle PHI CYS 153 -73.00 -53.00 13 5.75 13.70 + ++ ++ +++ *++++ Angle PSI CYS 153 -50.00 -30.00 13 7.15 16.25 +++ + ++ ++ + *+ ++ 71 violated distance constraints. 102 violated angle constraints. RMSDs for residues 18..164: Average backbone RMSD to mean : 6.36 +/- 1.17 A (4.67..9.09 A) Average heavy atom RMSD to mean : 6.97 +/- 1.15 A (5.28..9.55 A)