Structural statistics: str target upper limits van der Waals torsion angles function # sum max # sum max # sum max 1 95.51 40 73.2 1.39 75 55.1 0.56 49 870.6 66.46 2 95.54 40 70.2 1.86 83 59.2 0.54 43 751.3 49.26 3 108.10 41 69.4 1.46 92 65.6 0.65 51 977.3 49.54 4 110.18 36 67.5 1.86 93 69.0 0.68 52 882.8 50.64 5 110.65 49 75.0 1.71 88 63.8 0.61 46 898.9 58.36 6 110.99 44 72.8 1.73 88 67.0 0.70 55 942.8 50.21 7 111.37 34 69.6 2.24 72 55.5 0.53 51 1014.2 60.04 8 112.04 51 81.0 2.22 85 61.0 0.61 45 830.5 79.12 9 114.94 47 75.0 1.62 116 73.6 0.91 43 857.6 57.07 10 115.78 48 74.6 1.88 80 62.2 0.72 52 951.9 69.42 11 116.44 54 80.1 1.59 83 62.4 0.76 48 973.6 60.82 12 116.61 54 75.2 1.66 97 64.9 0.66 56 995.6 47.80 13 116.61 51 79.4 1.78 87 56.2 0.66 55 979.5 62.56 14 117.02 55 84.0 1.66 79 58.4 0.65 53 988.7 58.78 15 119.80 44 68.9 1.53 87 62.5 0.64 56 1077.3 97.20 16 119.87 34 70.2 2.03 98 68.0 0.78 55 1030.2 66.77 17 120.23 59 83.7 2.02 98 69.9 0.95 43 823.6 70.51 18 121.89 48 82.9 1.94 82 61.8 0.64 51 941.4 51.06 19 122.69 46 76.9 2.04 104 67.5 0.71 53 1082.3 66.10 20 125.71 45 74.7 2.04 102 67.1 0.55 47 1009.1 90.58 Ave 114.10 46 75.2 1.81 89 63.5 0.68 50 944.0 63.11 +/- 7.67 7 5.0 0.23 10 4.9 0.11 4 85.0 13.17 Min 95.51 34 67.5 1.39 72 55.1 0.53 43 751.3 47.80 Max 125.71 59 84.0 2.24 116 73.6 0.95 56 1082.3 97.20 Constraints violated in 6 or more structures: Cutoffs: Upper distance limits : 0.60 A Lower distance limits : 0.20 A Angle constraints : 5.00 deg # mean max. 1 5 10 15 20 Upper HA ILE 48 - QD1 LEU 74 5.50 11 0.65 1.30 + +++++++*++ # peak 119 # SUP 0.64 QD1 LEU 74 - HA ASN 89 # SUP 0.75 HA LEU 43 - QD1 LEU 74 # SUP 0.73 Upper HA VAL 73 - HN VAL 94 4.32 8 0.59 2.22 ++ * +++ + + # peak 287 # SUP 5.15 HN LEU 67 - HA VAL 73 # SUP 0.80 HA VAL 73 - HN VAL 105 # SUP 0.97 Upper HA ARG+ 53 - HB3 GLU- 54 4.60 8 0.50 0.82 ++++ +*+ + # peak 938 # SUP 1.82 Upper QD1 ILE 48 - HB3 LEU 67 4.30 7 0.42 1.37 +++ + + +* # peak 1153 # SUP 2.68 QD1 ILE 48 - HG LEU 74 # SUP 0.54 Upper HA ASN 89 - HD3 PRO 104 3.81 6 0.43 1.22 * + +++ + # peak 1325 # SUP 5.22 Upper HG LEU 74 - HD3 ARG+ 84 5.50 7 0.35 0.86 +++ + + + * # peak 1419 # SUP 1.59 QG2 VAL 73 - HD3 ARG+ 84 # SUP 0.27 HD3 ARG+ 84 - QG1 VAL 105 # SUP 0.26 HD3 ARG+ 84 - QG2 VAL 99 # SUP 0.02 HD3 ARG+ 84 - QG2 VAL 87 # SUP 0.02 HD3 ARG+ 84 - QG2 VAL 105 # SUP 0.02 Upper HB3 LYS+ 44 - HA1 GLY 58 5.50 6 0.40 1.22 * + +++ + # peak 1470 # SUP 0.97 HB3 LYS+ 44 - HA2 GLY 58 # SUP 0.65 HA1 GLY 58 - HB3 LYS+ 63 # SUP 0.34 HA1 GLY 58 - HB VAL 73 # SUP 0.12 Upper HB3 LEU 23 - HZ2 TRP 51 5.29 6 0.34 1.21 + + + * + + # peak 1514 # SUP 1.50 HB3 LEU 90 - HE22 GLN 102 # SUP 0.69 Upper HG3 GLU- 45 - HG3 GLU- 56 4.16 13 0.70 1.09 + ++++ + +++*+++ # peak 1838 # SUP 0.55 HG3 GLU- 45 - HA1 GLY 58 # SUP 0.51 HG2 GLU- 45 - HG3 GLU- 56 # SUP 0.61 HB3 LEU 43 - HG2 GLU- 45 # SUP 1.21 HB3 LEU 43 - HG3 GLU- 45 # SUP 1.29 HG2 GLU- 45 - HA1 GLY 58 # SUP 1.21 HG3 GLU- 45 - HB VAL 47 # SUP 0.25 HG2 GLU- 45 - HB VAL 47 # SUP 0.30 Upper HA ASN 89 - HB3 LYS+ 117 5.50 9 0.49 1.07 + ++ *++ + ++ # peak 2000 # SUP 2.06 HA ASN 89 - HB2 LYS+ 117 # SUP 1.54 HA ASN 89 - HB3 PRO 116 # SUP 1.44 Upper QB ALA 91 - HB2 PRO 116 5.31 6 0.46 1.31 + + + * + + # peak 2058 # SUP 1.81 Upper HB3 GLU- 107 - HB2 LYS+ 108 2.61 16 0.79 1.48 ++++ +++ * ++++++ ++ # peak 2222 # SUP 2.75 HB3 GLU- 107 - HB3 GLU- 109 # SUP 0.95 Upper HG3 GLU- 45 - HB2 GLU- 50 5.50 6 0.33 1.06 ++ + * + + # peak 2315 # SUP 2.58 HG2 GLU- 45 - HB2 GLU- 50 # SUP 2.65 HB2 GLU- 50 - HA1 GLY 58 # SUP 0.22 Upper HB2 GLU- 45 - HB2 GLU- 50 4.56 7 0.43 1.49 + +++ +* + # peak 2325 # SUP 3.78 HB3 GLU- 45 - HB2 GLU- 50 # SUP 4.59 HB2 LYS+ 44 - HB2 GLU- 50 # SUP 1.30 Upper HA ILE 48 - QD2 LEU 74 5.42 8 0.56 1.29 +* + + + ++ + # peak 2672 # SUP 0.75 QD2 LEU 74 - HA ASN 89 # SUP 0.75 HA LEU 43 - QD2 LEU 74 # SUP 0.43 QD2 LEU 74 - HD3 PRO 104 # SUP 0.45 Upper HA1 GLY 30 - HG3 PRO 31 5.24 6 0.36 0.70 ++ * +++ # peak 2696 # SUP 2.89 Upper HG2 LYS+ 20 - HG LEU 74 3.33 11 0.58 1.14 ++ + +++++ + * + # peak 2783 # SUP 3.25 HG2 LYS+ 20 - HG13 ILE 100 # SUP 2.30 Upper QD2 LEU 23 - HA PRO 116 5.50 9 0.56 1.37 ++ + + + +++ * # peak 2866 # SUP 1.13 QD2 LEU 23 - HA ASN 89 # SUP 1.31 QD2 LEU 23 - HA MET 97 # SUP 1.14 QD2 LEU 23 - HA ASP- 115 # SUP 1.39 QD2 LEU 23 - HA LYS+ 113 # SUP 0.42 Upper HA PRO 31 - QG1 VAL 99 5.50 8 0.43 1.10 + + + ++ ++ * # peak 2973 # SUP 0.94 HA2 GLY 30 - QG1 VAL 99 # SUP 0.02 HA ASN 89 - QG1 VAL 99 # SUP 0.18 Upper QG2 VAL 87 - QD1 LEU 90 2.40 7 0.48 1.24 * + ++ + ++ # peak 3350 # SUP 2.38 QD1 LEU 90 - QG2 VAL 105 # SUP 0.75 Upper QD1 LEU 23 - HG2 GLN 102 5.36 6 0.29 0.97 + ++ + *+ # peak 3374 # SUP 0.37 QD1 LEU 23 - HA1 GLY 58 # SUP 0.75 QD1 LEU 23 - HB2 LYS+ 113 # SUP 0.30 QD1 LEU 23 - HG2 MET 126 # SUP 0.02 Upper QD1 LEU 23 - HA MET 97 5.26 9 0.56 1.32 + +++ ++ ++* # peak 3376 # SUP 0.99 QD1 LEU 23 - HA ASN 89 # SUP 0.85 QD1 LEU 23 - HA ASP- 115 # SUP 0.96 QD1 LEU 23 - HA PRO 116 # SUP 0.52 QD1 LEU 23 - HA LYS+ 113 # SUP 0.46 Upper HA ASN 89 - HG2 LYS+ 117 5.50 7 0.41 0.99 + +*+ + ++ # peak 3425 # SUP 3.40 HA ASN 89 - HG3 LYS+ 117 # SUP 3.29 Upper HA ILE 68 - QB ALA 70 5.50 9 0.44 0.98 + ++ + * ++ ++ # peak 3811 # SUP 1.22 Upper QD PHE 21 - HB3 ARG+ 22 4.92 11 0.64 1.27 +*+ + + + + ++++ # peak 302 # SUP 2.28 Upper QD2 LEU 74 - QD TYR 83 5.46 8 0.45 1.41 + * +++ +++ # peak 553 # SUP 3.05 Upper HA ASN 89 - HN GLN 102 4.86 8 0.46 1.72 ++ + ++ ++* # peak 45 # SUP 4.57 HA VAL 73 - HN GLN 102 # SUP 1.50 Upper QG2 VAL 94 - HN MET 97 4.26 7 0.49 1.88 + ++* + + + # peak 69 # SUP 0.82 HN MET 97 - QG2 ILE 101 # SUP 1.22 HG LEU 67 - HN MET 97 # SUP 0.09 Upper HN MET 97 - HA HIS+ 98 4.30 13 0.81 1.66 ++ + + ++ +* +++++ # peak 71 # SUP 1.71 HN MET 97 - HA GLN 102 # SUP 0.12 Upper HA ASN 89 - HN THR 95 3.57 10 0.72 2.04 +++ ++ + + +*+ # peak 91 # SUP 4.16 HA VAL 73 - HN THR 95 # SUP 4.78 Upper HN LYS+ 20 - QG2 VAL 94 4.27 10 0.50 1.39 * ++ + + ++ ++ + # peak 126 # SUP 1.47 Upper HN ARG+ 22 - HN ASP- 28 5.18 10 0.60 1.94 ++ + + ++++ *+ # peak 138 # SUP 0.85 Upper HA ASN 89 - HN THR 96 4.24 9 0.47 1.02 + ++ * + +++ + # peak 161 # SUP 5.49 HN THR 96 - HA LYS+ 113 # SUP 0.10 Upper HG2 PRO 86 - HN THR 96 5.39 13 0.85 2.03 + + ++ +++ ++ *++ + # peak 168 # SUP 0.85 HG3 PRO 86 - HN THR 96 # SUP 1.48 HB3 GLU- 75 - HN THR 96 # SUP 0.63 HN THR 96 - HB2 PRO 112 # SUP 0.31 HN THR 96 - HB3 LYS+ 110 # SUP 0.61 HB3 PRO 31 - HN THR 96 # SUP 0.02 HN THR 96 - HB3 PRO 112 # SUP 0.02 Upper HN HIS+ 98 - QG2 ILE 101 5.50 11 0.72 1.73 + + * + +++++ + + # peak 184 # SUP 1.02 QG2 VAL 94 - HN HIS+ 98 # SUP 0.22 QG2 VAL 40 - HN HIS+ 98 # SUP 1.41 HG LEU 67 - HN HIS+ 98 # SUP 0.33 Upper HA VAL 73 - HN THR 96 3.48 14 0.87 1.58 + +++++*+ +++ +++ # peak 185 # SUP 3.34 HA ASN 89 - HN THR 96 # SUP 5.49 HA SER 88 - HN THR 96 # SUP 2.11 Upper HA ASN 89 - HN THR 96 3.99 10 0.63 1.22 + ++ + +++++* # peak 207 # SUP 5.49 HA2 GLY 30 - HN THR 96 # SUP 0.35 Upper HN VAL 73 - HG3 PRO 104 3.76 14 0.86 1.54 ++ +++*++ ++++++ # peak 218 # SUP 0.75 HN VAL 73 - HB2 GLU- 75 # SUP 0.64 HG3 PRO 31 - HN VAL 73 # SUP 0.02 HN VAL 73 - HG2 PRO 112 # SUP 0.02 Upper HG2 PRO 104 - HN CYS 121 4.67 7 0.43 1.24 + * +++++ # peak 363 # SUP 1.10 HB3 PRO 104 - HN CYS 121 # SUP 0.86 HB3 PRO 104 - HN VAL 122 # SUP 0.93 HG2 PRO 104 - HN VAL 122 # SUP 0.77 Upper HN SER 69 - HN LYS+ 72 4.46 10 0.63 1.86 *++++ + + + + + # peak 447 # SUP 0.24 HN LYS+ 72 - HN THR 95 # SUP 2.41 Upper HN ILE 68 - HG LEU 74 4.82 9 0.51 1.78 + ++ + + + + +* # peak 458 # SUP 2.60 QG2 THR 39 - HN ILE 68 # SUP 1.08 QG2 THR 38 - HN ILE 68 # SUP 0.17 Upper HN ILE 68 - HN HIS+ 98 5.01 11 0.73 1.74 + ++ ++++ + + +* # peak 460 # SUP 0.28 HN ILE 68 - HN ALA 70 # SUP 0.99 Upper QB ALA 91 - HN VAL 94 4.25 12 0.74 1.43 ++ * +++ +++ ++ + # peak 506 # SUP 1.08 HG LEU 74 - HN VAL 94 # SUP 1.84 HB3 LYS+ 20 - HN VAL 94 # SUP 1.51 HB2 LYS+ 20 - HN VAL 94 # SUP 1.58 HD3 LYS+ 20 - HN VAL 94 # SUP 0.75 HG3 LYS+ 20 - HN VAL 94 # SUP 1.72 Upper HN VAL 99 - HG2 GLN 102 4.18 10 0.60 1.50 + ++* + + ++++ # peak 536 # SUP 0.85 HB3 GLU- 75 - HN VAL 99 # SUP 0.50 HA1 GLY 58 - HN VAL 99 # SUP 0.54 HB2 ASP- 82 - HN VAL 99 # SUP 0.02 Upper HA ASN 89 - HN VAL 105 3.32 7 0.45 1.10 + + ++*+ + # peak 555 # SUP 5.42 HA VAL 73 - HN VAL 94 # SUP 5.15 HA ASN 89 - HN VAL 94 # SUP 5.17 HA VAL 73 - HN VAL 105 # SUP 0.97 HA SER 88 - HN VAL 105 # SUP 1.29 HA SER 88 - HN VAL 94 # SUP 1.68 Upper HA ASN 89 - HN LYS+ 110 4.21 13 0.73 2.24 ++ + *+++ ++++ ++ # peak 565 # SUP 2.84 HA1 GLY 92 - HN LYS+ 110 # SUP 0.02 Upper HN SER 85 - HA ASN 89 4.67 12 0.74 1.69 ++++ ++ ++ * +++ # peak 585 # SUP 1.58 HN SER 85 - HA MET 97 # SUP 0.35 Upper HA ASN 76 - HN VAL 80 4.11 11 0.63 1.24 ++*++ + ++ ++ + # peak 660 # SUP 0.75 HA SER 77 - HN VAL 80 # SUP 0.85 HN VAL 80 - HA CYS 123 # SUP 0.63 Upper HA ASN 89 - HN THR 106 4.93 6 0.57 1.71 * + ++++ # peak 702 # SUP 1.47 HN THR 106 - HA MET 118 # SUP 0.42 Upper HN THR 106 - HD3 LYS+ 108 5.02 6 0.42 1.07 ++ + +* + # peak 724 # SUP 0.47 QB ALA 70 - HN THR 106 # SUP 0.02 QB ALA 70 - HN LYS+ 81 # SUP 0.02 HB2 LYS+ 72 - HN THR 106 # SUP 0.02 Upper HA1 GLY 30 - HN LYS+ 44 4.58 12 0.65 1.46 + +++++ + + ++ * + # peak 777 # SUP 0.59 HD3 PRO 31 - HN LYS+ 44 # SUP 3.02 HN LYS+ 44 - HB3 SER 69 # SUP 0.14 HN LYS+ 44 - HA ILE 48 # SUP 0.36 Upper HN GLY 30 - HN LYS+ 32 5.50 7 0.38 1.02 + + + * +++ # peak 919 # SUP 1.30 Upper HA ASN 89 - HN GLY 92 3.71 13 0.79 1.78 + + *++++++ ++ ++ # peak 1017 # SUP 2.96 HN GLY 92 - HA GLU- 109 # SUP 0.85 HN GLY 92 - HA LYS+ 110 # SUP 0.31 Upper HN GLY 71 - QG2 VAL 94 4.23 7 0.42 1.52 *++ + + + + # peak 1074 # SUP 1.80 QG1 VAL 62 - HN GLY 71 # SUP 0.02 Upper HN PHE 21 - HB ILE 29 5.03 9 0.51 1.23 + + *+ + ++ ++ # peak 1144 # SUP 4.10 Angle PSI LYS+ 20 128.00 162.00 9 6.44 34.45 + ++ + * ++++ Angle PHI PHE 21 237.00 261.00 16 15.13 43.32 +++++*+ +++ ++++ ++ Angle PSI PHE 21 106.00 132.00 13 11.47 62.56 ++++++ + + * ++ ++ Angle PHI ARG+ 22 225.00 267.00 7 8.26 39.94 +++ + + * + Angle PSI ARG+ 22 107.00 141.00 6 5.06 23.35 * +++ ++ Angle PHI ASP- 28 210.00 256.00 12 8.12 25.60 ++ + + +++* +++ + Angle PSI ASP- 28 127.00 157.00 6 4.23 24.87 + + ++ + * Angle PSI ILE 29 109.00 149.00 6 4.48 18.68 + +++ +* Angle PSI PRO 31 128.00 150.00 14 11.27 26.16 ++++++++ *+++++ Angle PHI LYS+ 32 205.00 253.00 11 6.83 16.62 +++ *++ + ++++ Angle PSI LYS+ 32 137.00 157.00 6 3.46 11.32 ++++ *+ Angle PHI ALA 33 246.00 278.00 7 2.97 8.91 + +++++ * Angle PHI VAL 40 282.00 302.00 9 4.32 12.49 * ++ ++ + +++ Angle PHI SER 41 281.00 301.00 12 5.62 13.30 + +++ + ++ ++ +* + Angle PSI SER 41 309.00 329.00 7 5.46 21.52 *+ + + ++ + Angle PHI ALA 42 282.00 302.00 9 5.03 14.67 + +*+ + + +++ Angle PSI ALA 42 314.00 334.00 15 8.96 24.95 +++*++ +++++ + +++ Angle PHI LEU 43 283.00 303.00 8 5.08 18.05 + + + +++ + * Angle PSI LEU 43 314.00 338.00 12 9.15 21.65 *++++++ + ++++ Angle PHI LYS+ 44 263.00 301.00 12 8.00 24.84 ++++ + *+++ +++ Angle PSI LYS+ 44 314.00 10.00 9 5.05 19.04 + + ++ ++ ++* Angle PHI GLU- 45 283.00 303.00 6 3.64 11.97 + + + + * + Angle PSI GLU- 45 311.00 337.00 14 7.21 15.28 *+ +++ + ++++++++ Angle PHI THR 46 286.00 306.00 7 3.87 11.72 ++ +* ++ + Angle PSI THR 46 307.00 333.00 11 9.30 25.23 + + ++++ +*+ + + Angle PHI VAL 47 286.00 306.00 17 19.35 53.77 +++++++ +++++++*+ + Angle PSI VAL 47 304.00 324.00 8 5.55 18.83 ++ + *+ + + + Angle PHI ILE 48 291.00 311.00 10 6.56 20.44 + + + *+++ ++ + Angle PSI ILE 48 308.00 328.00 10 5.16 12.82 ++ ++ ++ + + + * Angle PSI TRP 51 110.00 138.00 18 14.61 32.80 ++*+++++++++++++ ++ Angle PSI ARG+ 53 314.00 334.00 20 24.67 49.26 +*++++++++++++++++++ Angle PHI GLU- 54 256.00 286.00 19 18.82 36.02 +++ +++++++++++++++* Angle PSI GLU- 54 331.00 13.00 10 5.26 13.85 ++++ + + + +*+ Angle PHI THR 61 232.00 276.00 13 8.55 32.22 +++ + ++++ +* + ++ Angle PSI THR 61 147.00 175.00 6 5.04 28.66 + + *++ + Angle PHI VAL 62 289.00 309.00 10 6.11 21.31 + + ++ + *++ + + Angle PSI VAL 65 92.00 130.00 8 5.09 17.20 + + + * + ++ + Angle PHI LYS+ 66 235.00 281.00 8 4.64 13.38 +++ +* + + + Angle PSI LYS+ 66 118.00 152.00 7 4.36 16.14 + * +++ + + Angle PHI LEU 67 223.00 259.00 10 7.96 24.12 + + + +++++* + Angle PSI LEU 67 135.00 155.00 15 11.82 27.57 * ++++++ ++ +++ +++ Angle PHI ILE 68 227.00 253.00 9 6.58 20.27 *+ + + + + + + + Angle PSI ILE 68 110.00 146.00 7 4.16 19.45 ++ + *+ + + Angle PSI SER 69 110.00 134.00 19 14.41 24.18 + +++++++++*++++++++ Angle PHI LYS+ 72 235.00 261.00 8 4.96 19.03 + + + ++++* Angle PSI LYS+ 72 116.00 150.00 11 8.01 28.91 +*+ + +++ ++ ++ Angle PHI VAL 73 244.00 278.00 12 9.59 30.79 *+++ ++++++ ++ Angle PSI VAL 73 107.00 137.00 8 7.63 33.61 + + ++++* + Angle PHI THR 79 222.00 272.00 10 4.83 10.98 ++++++ + *+ + Angle PSI THR 79 148.00 174.00 16 16.29 30.47 +++++++ + ++++ *+ ++ Angle PSI VAL 80 313.00 333.00 7 3.85 13.20 + + + + * + + Angle PHI SER 85 256.00 276.00 13 7.57 17.22 + + ++ ++++++++* Angle PHI LEU 90 254.00 298.00 13 7.59 16.80 + +++*++ ++++ ++ Angle PSI LEU 90 119.00 151.00 13 8.51 26.13 ++ +++ ++ +++++ * Angle PHI GLY 92 77.00 97.00 11 8.76 31.66 + +++*+++ + + + Angle PSI GLY 92 349.00 11.00 7 4.98 16.65 + + + + + * + Angle PHI ALA 93 251.00 297.00 6 4.30 22.93 + + ++ * + Angle PSI ALA 93 109.00 151.00 15 21.90 57.88 +++ +++++ + ++* +++ Angle PHI VAL 94 245.00 279.00 18 21.19 66.77 ++++ ++++++++++* +++ Angle PSI VAL 94 119.00 147.00 12 10.99 44.41 + + +++ +++++*+ Angle PHI THR 95 219.00 273.00 11 11.82 42.74 +++ ++ +++*++ Angle PSI THR 95 113.00 139.00 9 22.17 90.58 + + ++ ++ + + * Angle PHI THR 96 246.00 294.00 14 15.56 52.06 +++ * +++ ++ +++++ Angle PSI THR 96 116.00 146.00 17 20.66 36.99 +++++++ +*+++++++ + Angle PHI MET 97 248.00 292.00 17 19.87 48.17 ++ +*+++++++++++++ Angle PSI MET 97 120.00 166.00 17 34.81 79.12 ++++ ++*+ ++++++ +++ Angle PHI HIS+ 98 248.00 288.00 20 24.18 59.36 +++++++*++++++++++++ Angle PSI HIS+ 98 121.00 149.00 19 38.88 97.20 ++++++++++++++*++++ Angle PHI VAL 99 242.00 268.00 20 37.72 61.28 ++++++++++++++*+++++ Angle PSI VAL 99 121.00 143.00 20 34.85 66.10 ++++++++++++++++++*+ Angle PHI ILE 100 227.00 273.00 20 24.13 44.83 +++++++++*++++++++++ Angle PSI ILE 100 113.00 143.00 16 20.01 60.04 ++++++*+ + ++ +++++ Angle PHI ILE 101 252.00 274.00 13 19.28 61.34 + +++ + + +*+++++ Angle PSI ILE 101 107.00 131.00 12 10.14 30.08 ++ ++++ ++ + ++* Angle PHI GLN 102 231.00 287.00 12 13.65 41.09 + +++ + + + ++++* Angle PSI GLN 102 122.00 152.00 13 11.04 34.85 +++++ + ++ +*++ + Angle PHI VAL 105 255.00 287.00 10 8.64 34.46 + + + ++++++* Angle PSI VAL 105 109.00 151.00 11 8.39 25.90 + + ++ ++ *+++ + Angle PHI THR 106 251.00 289.00 10 6.88 29.70 +++++ + +*++ Angle PSI THR 106 112.00 150.00 12 6.72 15.56 ++ +++ ++ ++++ * 55 violated distance constraints. 80 violated angle constraints. RMSDs for residues 20..123: Average backbone RMSD to mean : 6.09 +/- 1.83 A (4.07..9.86 A) Average heavy atom RMSD to mean : 6.71 +/- 1.90 A (4.57..10.25 A)