NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 N 4.6178 8.2785 119.2029 53.0040 39.2588 174.1516 8 A 3.7817 8.5355 127.9309 55.0749 17.0289 177.4425 9 M 3.7190 8.4003 118.2858 59.1604 32.1367 178.1037 10 Q 4.2062 7.8959 119.7936 59.2516 28.3408 179.8871 11 G 4.0367 6.9994 101.0208 44.3110 0.0000 173.9217 12 I 3.8121 7.1818 122.0708 61.4304 39.0618 175.0243 13 H 4.7770 8.9866 126.5842 55.3235 30.0780 174.2246 14 F 5.3983 8.9726 125.1293 57.0044 41.8630 173.7116 15 R 4.3174 7.4533 124.1625 53.4889 33.2151 176.7746 16 R 2.5956 7.4667 119.4615 59.3743 29.8806 177.4244 17 H 4.7643 7.6206 110.1539 56.0504 28.8137 174.6359 18 Y 4.8383 7.8186 117.1954 58.1060 37.8242 174.6837 19 V 5.2216 7.2818 118.6642 61.2870 34.3617 174.9592 20 R 4.8581 8.7543 121.8787 55.7302 33.0133 173.2818 21 H 5.1803 8.2496 116.0946 54.7554 30.2575 174.6256 22 L 4.9552 8.6437 122.4755 52.1590 44.7681 174.9200 23 P 4.5839 0.0000 0.0000 61.8745 32.3183 176.9528 24 K 4.2639 8.3964 116.2655 58.3465 32.5909 177.5910 25 E 4.2371 7.9411 118.5331 57.8962 30.0448 177.3264 26 V 3.8835 7.2771 113.4086 61.2962 32.1544 176.7871 27 S 4.6010 8.6251 119.6794 57.0223 65.9405 175.3047 28 Q 3.8423 8.2774 121.5773 59.4620 28.5704 177.8019 29 N 4.3112 8.0072 116.9664 56.2396 38.5284 176.8656 30 D 4.3654 8.1441 120.3526 57.4347 40.9339 178.8880 31 I 3.7371 7.9439 120.1145 64.5957 37.1689 178.4541 32 I 3.7794 7.9599 120.4995 64.4466 37.0725 178.6929 33 K 3.9663 8.3924 119.2107 59.5319 31.6979 179.3548 34 A 4.0733 8.2006 120.0561 54.8024 18.3165 179.0561 35 L 4.2656 7.8653 116.2787 57.0057 42.2461 178.8297 36 A 4.2334 8.3444 121.1502 54.8035 18.1884 179.1481 37 S 4.0611 7.9797 111.9563 61.4662 62.3801 174.8333 38 P 4.3236 0.0000 0.0000 66.0588 30.8169 178.2656 39 L 3.7945 7.6177 118.1136 57.3176 41.6125 179.2347 40 I 3.6562 7.9775 120.0753 64.6325 36.9050 178.3743 41 N 4.4362 8.2406 115.7353 55.7294 38.4163 176.2426 42 D 4.7641 7.8907 118.0417 53.4605 41.2783 176.9430 43 G 3.9363 7.8299 107.4028 46.6311 0.0000 175.0243 44 M 4.2683 8.3003 122.5009 57.3679 32.9211 176.6305 45 V 4.7532 7.2710 109.2373 59.0659 36.1391 175.6466 46 V 3.9833 8.6914 116.1479 61.2976 32.2638 177.9933 47 S 4.1341 8.8583 116.9454 61.0951 63.0532 174.8086 48 D 4.8034 7.9622 118.8175 52.9869 39.7701 177.5735 49 F 4.0689 8.1495 124.7256 62.1456 39.1364 176.9699 50 A 3.8466 7.9930 119.6225 55.3413 18.1746 179.2439 51 D 4.2410 7.8136 117.1707 57.5805 40.8234 178.7484 52 H 4.0358 7.6916 116.4894 58.6793 28.7072 177.8230 53 V 3.4713 7.5327 120.1622 65.7248 31.1191 178.3191 54 I 3.6912 7.6396 119.6872 64.6674 35.5519 178.4417 55 T 3.8688 8.0767 116.8743 66.5488 68.1420 176.7084 56 R 4.1169 8.0117 120.5740 59.4608 29.9972 177.9312 57 E 3.9285 8.2409 119.1399 59.7744 29.3548 178.8999 58 Q 4.0307 7.8341 116.4240 57.9778 28.7892 176.7097 59 N 4.6134 7.5315 114.1471 53.8307 40.1748 175.1777 60 F 4.7707 8.7656 117.0611 54.3598 39.4108 172.7957 61 P 5.0132 0.0000 0.0000 62.5857 32.5140 177.1553 62 T 4.7551 9.5615 107.7939 61.3943 70.4862 173.3937 63 G 3.7525 8.4465 110.2931 46.8823 0.0000 173.2150 64 L 5.0033 9.1205 126.3245 52.2947 43.8973 174.6219 65 P 4.8526 0.0000 0.0000 62.1551 29.4533 175.2814 66 V 4.4305 7.9063 119.9892 60.2147 34.2477 175.1696 67 E 4.6753 8.4892 122.7096 54.3216 31.2089 174.4401 68 P 4.4797 0.0000 0.0000 62.9443 32.1997 175.9086 69 V 4.2162 7.4621 119.1655 59.4468 32.1233 175.5939 70 G 3.8542 8.4702 112.7169 46.4917 0.0000 171.3030 71 V 5.4682 8.6071 120.8213 59.7249 35.6792 174.0375 72 A 5.1385 8.2345 125.0411 49.4612 22.6137 175.4237 73 I 5.7750 8.1600 111.6081 58.0377 36.3940 174.0530 74 P 4.6301 0.0000 0.0000 63.6530 33.0521 176.8782 75 H 5.0605 8.3807 116.9704 55.7565 31.5948 171.2360 76 T 4.6782 8.1381 111.5534 60.4284 70.5777 172.1052 77 D 4.8157 8.8674 120.6481 54.1685 41.9215 177.5585 78 S 4.3085 8.4568 119.1200 60.2681 63.0148 176.4821 79 K 3.8671 7.6801 119.1141 59.1679 32.3442 177.1651 80 Y 4.6086 7.7980 116.4769 58.1068 38.3902 174.7234 81 V 4.3924 7.4849 120.7793 61.2378 33.1065 175.3766 82 R 4.2556 8.8226 127.2746 58.5440 30.5467 176.9835 83 Q 4.6943 7.6771 114.8227 53.6615 32.8267 175.0871 84 N 4.8418 8.7629 119.5289 53.7667 39.8999 173.8542 85 A 5.0947 8.8309 122.8477 51.3494 23.4611 174.8341 86 I 5.0783 8.6055 118.9425 59.2682 41.1145 174.5742 87 S 5.0962 9.2794 123.6276 56.4937 65.3980 172.4825 88 V 4.8886 9.4864 127.2868 61.0606 34.1447 174.2992 89 G 4.4319 8.9939 114.7687 44.3985 0.0000 171.4734 90 I 4.9139 8.4553 124.8052 59.3321 39.4992 174.6665 91 L 4.6910 8.8862 127.8871 53.5279 42.3259 176.9156 92 A 4.2329 8.4798 126.1326 54.6745 18.6801 177.5616 93 E 4.8298 7.9042 111.5557 53.5904 33.5179 174.3999 94 P 4.7218 0.0000 0.0000 62.8670 32.5208 176.0199 95 V 4.5100 8.5153 122.6304 60.9455 34.5885 174.3890 96 N 5.2539 9.0275 125.6175 53.5151 39.2103 174.3507 97 F 4.8932 9.0736 122.1058 55.3314 42.7269 175.0639 98 E 4.4398 8.7245 121.2092 56.1250 31.0660 175.9751 99 D 4.8162 8.7337 122.3893 54.0850 41.8440 177.2241 100 A 4.3582 8.6550 130.0814 54.5550 18.5179 178.4838 101 G 3.7077 8.8155 103.5118 46.4194 0.0000 174.7772 102 G 3.9566 8.0754 108.4443 45.0420 0.0000 173.9456 103 E 4.1817 7.7428 118.6741 55.5219 30.0709 175.4515 104 P 4.3891 0.0000 0.0000 65.4369 31.8924 176.7989 105 D 4.5775 7.9004 118.8526 52.8195 41.4839 174.2596 106 P 4.5616 0.0000 0.0000 62.9311 32.8210 175.4511 107 V 4.2941 8.7985 121.4629 60.7857 33.1366 173.3697 108 P 4.8785 0.0000 0.0000 62.4224 30.6879 175.1059 109 V 3.8964 8.7639 127.8981 63.2958 32.4125 176.2082 110 R 4.5457 9.1844 125.3383 55.8683 33.8261 175.5365 111 V 4.6036 7.5944 118.6973 60.8069 34.5714 174.2160 112 V 4.4882 8.7168 128.3720 61.2754 33.8636 174.4426 113 F 5.0815 8.9743 127.7126 56.0123 39.8957 173.7252 114 M 4.8646 9.3083 125.0746 55.2253 33.2864 174.5422 115 L 4.9729 8.6903 126.3460 53.0954 44.0128 176.2401 116 A 4.6256 9.1375 125.7475 50.1313 20.8391 173.9660 117 L 4.8959 8.0683 120.8033 53.6708 43.7339 178.2134 118 G 3.5800 10.1907 114.3972 47.0044 0.0000 173.1175 119 N 4.7702 7.5611 118.3998 50.5938 41.8716 174.9881 120 W 4.3964 8.6461 125.4488 59.6007 28.9715 178.1725 121 F 4.8407 8.3323 116.9207 59.9252 38.6061 176.5609 122 D 4.6058 8.2236 118.5515 56.2552 40.6709 178.1681 123 I 3.8576 7.9729 119.6720 63.9674 37.8501 178.0725 124 T 3.9315 7.9548 116.5009 66.5845 68.5622 175.6780 125 N 4.3667 8.3035 118.4831 56.9395 38.7890 176.7836 126 V 3.5914 7.8092 119.1695 66.0222 31.6116 177.9172 127 L 4.0334 8.3926 119.1392 57.6216 41.3760 179.0236 128 W 4.5610 8.5434 128.4355 60.6237 30.6571 177.8297 129 W 3.7844 8.2551 127.7334 60.4464 30.1481 177.9214 130 I 3.2901 8.2062 120.0675 64.5346 36.2554 178.2113 131 M 3.8590 8.1382 119.7128 58.3969 31.5596 178.1821 132 D 3.8729 6.8425 116.7109 57.0717 41.4797 178.4057 133 V 3.0721 6.6415 118.2713 65.6310 31.3874 178.0466 134 I 3.9225 7.5905 110.4461 62.9204 37.4725 176.4712 135 Q 4.1466 7.3394 118.8646 56.3422 29.1094 176.1714 136 D 4.5650 7.9735 119.4705 52.7027 40.5731 175.9882 137 E 4.0277 8.5863 129.1314 59.9622 29.7233 179.3017 138 D 4.3902 8.1383 120.6542 58.0352 39.9721 180.2457 139 F 4.2572 8.4759 121.5048 61.6867 39.2236 177.2933 140 M 4.1579 8.2367 117.1839 58.4075 32.0095 178.3820 141 Q 4.1419 8.3613 118.4827 59.2754 28.9024 179.1360 142 Q 3.9610 8.1193 118.7082 58.6975 28.4406 178.6996 143 L 3.9419 7.3302 118.7005 56.8698 41.6602 178.3590 144 L 4.4117 7.6908 117.0599 55.1495 41.9828 177.3161 145 V 4.3511 7.6288 110.9730 61.5815 34.0654 176.3297 146 M 4.4157 7.8873 118.3940 55.0195 32.5414 176.0201 147 N 4.7820 8.8680 119.8938 51.8206 40.4620 175.9494 148 D 4.4656 8.5979 119.7467 57.7254 40.7683 178.8782 149 D 4.4178 8.1461 118.5965 57.6705 40.9868 178.6597 150 E 4.0672 9.2483 119.2412 59.3877 29.3498 179.5993 151 I 3.7659 8.1264 120.0946 64.3730 37.2060 177.6596 152 Y 4.4767 8.2147 120.3712 61.1996 38.6845 178.3114 153 Q 3.9633 8.2371 118.8130 58.9115 28.8001 179.0013 154 S 4.2145 8.3034 114.1153 61.4505 62.5348 176.3123 155 I 4.0464 8.3949 122.9540 64.6395 36.6924 177.5044 156 Y 4.1563 8.4180 119.4243 61.3044 38.8924 178.2270 157 T 3.9996 8.1448 116.2970 66.7012 68.3577 176.6027 158 R 3.9449 7.9416 119.3814 59.5383 30.1875 178.1488 159 I 3.4828 8.1989 119.0619 63.5562 37.0457 176.1700 160 S 4.3225 7.5438 119.0386 58.4732 62.9469 173.7462 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 7 N 8.28 4.62 0.00 2.81 2.78 0.00 0.00 6.93 7.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 A 8.54 3.78 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 M 8.40 3.72 0.00 1.66 1.87 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 2.65 0.00 10 Q 7.90 4.21 0.00 2.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.76 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 11 G 7.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 I 7.18 3.81 1.86 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.79 0.87 0.00 0.00 13 H 8.99 4.78 0.00 3.42 3.33 0.00 5.61 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 8.97 5.40 0.00 3.02 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 7.45 4.32 0.00 0.67 1.06 0.00 2.52 0.00 0.00 3.00 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.13 0.00 16 R 7.47 2.60 0.00 0.80 1.40 0.00 2.90 0.00 0.00 2.99 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.43 0.00 17 H 7.62 4.76 0.00 3.31 3.28 0.00 5.57 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 Y 7.82 4.84 0.00 3.02 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 V 7.28 5.22 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 1.29 0.00 0.00 20 R 8.75 4.86 0.00 1.96 2.01 0.00 2.85 0.00 0.00 3.20 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 21 H 8.25 5.18 0.00 3.00 3.29 0.00 5.80 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.64 4.96 0.00 1.59 1.56 0.96 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 23 P 0.00 4.58 0.00 2.49 2.21 0.00 3.71 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.96 0.00 24 K 8.40 4.26 0.00 1.90 1.98 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.47 7.81 25 E 7.94 4.24 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.39 0.00 26 V 7.28 3.88 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 1.00 0.00 0.00 27 S 8.63 4.60 0.00 4.03 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 8.28 3.84 0.00 1.76 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.96 6.94 0.00 0.00 0.00 0.00 0.00 2.12 1.51 0.00 29 N 8.01 4.31 0.00 2.74 2.82 0.00 0.00 7.11 8.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 D 8.14 4.37 0.00 2.98 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 7.94 3.74 2.19 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.92 1.03 0.00 0.00 32 I 7.96 3.78 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.77 0.89 0.00 0.00 33 K 8.39 3.97 0.00 1.98 1.87 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.61 7.81 34 A 8.20 4.07 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.87 4.27 0.00 1.72 1.79 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 36 A 8.34 4.23 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.98 4.06 0.00 3.96 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.32 0.00 2.31 2.60 0.00 3.76 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 39 L 7.62 3.79 0.00 1.60 1.45 0.73 -0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 40 I 7.98 3.66 2.03 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.95 0.93 0.00 0.00 41 N 8.24 4.44 0.00 2.72 2.90 0.00 0.00 7.10 8.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 D 7.89 4.76 0.00 2.89 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 G 7.83 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 M 8.30 4.27 0.00 1.85 1.96 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.78 0.00 45 V 7.27 4.75 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.54 0.00 0.00 46 V 8.69 3.98 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 1.25 0.00 0.00 47 S 8.86 4.13 0.00 4.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 D 7.96 4.80 0.00 2.74 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 F 8.15 4.07 0.00 3.21 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 A 7.99 3.85 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 D 7.81 4.24 0.00 2.62 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 H 7.69 4.04 0.00 2.84 2.98 0.00 5.62 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 V 7.53 3.47 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.11 0.00 0.00 54 I 7.64 3.69 1.92 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.72 0.88 0.00 0.00 55 T 8.08 3.87 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 56 R 8.01 4.12 0.00 1.99 2.16 0.00 3.53 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.80 0.00 57 E 8.24 3.93 0.00 2.32 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.40 0.00 58 Q 7.83 4.03 0.00 2.01 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.54 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 59 N 7.53 4.61 0.00 2.78 2.37 0.00 0.00 6.76 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 F 8.77 4.77 0.00 3.02 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 5.01 0.00 2.48 2.24 0.00 3.83 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 1.94 0.00 62 T 9.56 4.76 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 63 G 8.45 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 9.12 5.00 0.00 1.56 1.62 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 65 P 0.00 4.85 0.00 2.09 2.12 0.00 3.76 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.20 0.00 66 V 7.91 4.43 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 1.02 0.00 0.00 67 E 8.49 4.68 0.00 1.94 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.22 0.00 68 P 0.00 4.48 0.00 2.17 2.16 0.00 3.72 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 69 V 7.46 4.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.92 0.00 0.00 70 G 8.47 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.61 5.47 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 1.08 0.00 0.00 72 A 8.23 5.14 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 I 8.16 5.77 2.01 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.36 1.06 0.00 0.00 74 P 0.00 4.63 0.00 2.24 2.43 0.00 4.17 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.98 0.00 75 H 8.38 5.06 0.00 3.27 3.45 0.00 5.47 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 T 8.14 4.68 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 77 D 8.87 4.82 0.00 2.94 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.46 4.31 0.00 3.84 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 K 7.68 3.87 0.00 1.64 1.78 0.00 1.33 0.00 0.00 1.47 0.00 0.00 2.98 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.83 0.21 7.81 80 Y 7.80 4.61 0.00 3.38 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 7.48 4.39 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 0.92 0.00 0.00 82 R 8.82 4.26 0.00 1.81 1.93 0.00 3.19 0.00 0.00 3.19 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 83 Q 7.68 4.69 0.00 1.88 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.94 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 84 N 8.76 4.84 0.00 2.61 2.69 0.00 0.00 6.74 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.83 5.09 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 I 8.61 5.08 1.91 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.01 0.99 0.00 0.00 87 S 9.28 5.10 0.00 3.75 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 9.49 4.89 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.26 0.00 0.00 89 G 8.99 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.46 4.91 1.56 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.72 0.91 0.00 0.00 91 L 8.89 4.69 0.00 1.48 1.71 1.03 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.48 4.23 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 E 7.90 4.83 0.00 1.83 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.25 0.00 94 P 0.00 4.72 0.00 1.96 2.01 0.00 3.63 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 95 V 8.52 4.51 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.08 0.00 0.00 96 N 9.03 5.25 0.00 2.67 2.79 0.00 0.00 6.92 7.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 F 9.07 4.89 0.00 2.95 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 E 8.72 4.44 0.00 1.97 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 99 D 8.73 4.82 0.00 2.88 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 A 8.66 4.36 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 G 8.82 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 G 8.08 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 E 7.74 4.18 0.00 2.14 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 2.26 0.00 104 P 0.00 4.39 0.00 2.18 2.18 0.00 3.77 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 105 D 7.90 4.58 0.00 2.71 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 P 0.00 4.56 0.00 2.27 2.09 0.00 3.76 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 107 V 8.80 4.29 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.01 0.00 0.00 108 P 0.00 4.88 0.00 2.14 2.12 0.00 3.84 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 109 V 8.76 3.90 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.82 0.00 0.00 110 R 9.18 4.55 0.00 1.69 1.87 0.00 3.28 0.00 0.00 3.14 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.67 0.00 111 V 7.59 4.60 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.38 0.00 0.00 0.84 0.00 0.00 112 V 8.72 4.49 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.77 0.00 0.00 113 F 8.97 5.08 0.00 3.05 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 M 9.31 4.86 0.00 2.31 2.06 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.72 0.00 115 L 8.69 4.97 0.00 1.62 1.57 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 116 A 9.14 4.63 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.07 4.90 0.00 1.26 1.53 0.86 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 118 G 10.19 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 N 7.56 4.77 0.00 2.59 2.79 0.00 0.00 7.23 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 W 8.65 4.40 0.00 3.25 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 F 8.33 4.84 0.00 3.09 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 D 8.22 4.61 0.00 2.93 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 I 7.97 3.86 2.21 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.59 1.24 0.00 0.00 124 T 7.95 3.93 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 125 N 8.30 4.37 0.00 2.80 3.03 0.00 0.00 6.74 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 V 7.81 3.59 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.96 0.00 0.00 127 L 8.39 4.03 0.00 1.97 1.82 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 128 W 8.54 4.56 0.00 3.47 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 W 8.26 3.78 0.00 3.54 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 I 8.21 3.29 1.98 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.76 0.76 0.00 0.00 131 M 8.14 3.86 0.00 1.80 1.95 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 3.01 0.00 132 D 6.84 3.87 0.00 1.91 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 133 V 6.64 3.07 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 0.00 0.00 -0.62 0.00 0.00 134 I 7.59 3.92 1.89 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.64 0.97 0.00 0.00 135 Q 7.34 4.15 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.09 0.00 0.00 0.00 0.00 0.00 2.34 2.15 0.00 136 D 7.97 4.56 0.00 2.60 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 E 8.59 4.03 0.00 2.05 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.36 0.00 138 D 8.14 4.39 0.00 2.68 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 F 8.48 4.26 0.00 3.36 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 M 8.24 4.16 0.00 2.07 2.16 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 3.13 0.00 141 Q 8.36 4.14 0.00 2.16 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.79 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 142 Q 8.12 3.96 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.58 2.50 0.00 143 L 7.33 3.94 0.00 1.75 1.66 1.01 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 144 L 7.69 4.41 0.00 1.73 1.70 0.91 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 145 V 7.63 4.35 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.97 0.00 0.00 146 M 7.89 4.42 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.51 0.00 147 N 8.87 4.78 0.00 2.99 2.95 0.00 0.00 7.22 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 D 8.60 4.47 0.00 2.74 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 D 8.15 4.42 0.00 2.91 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 E 9.25 4.07 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.49 0.00 151 I 8.13 3.77 2.12 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.78 1.07 0.00 0.00 152 Y 8.21 4.48 0.00 3.05 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.24 3.96 0.00 2.46 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.60 0.00 0.00 0.00 0.00 0.00 2.38 2.24 0.00 154 S 8.30 4.21 0.00 3.92 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 I 8.39 4.05 2.05 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.75 0.65 0.00 0.00 156 Y 8.42 4.16 0.00 2.54 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 T 8.14 4.00 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 158 R 7.94 3.94 0.00 2.01 2.36 0.00 3.19 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.61 0.00 159 I 8.20 3.48 1.75 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.49 0.54 0.00 0.00 160 S 7.54 4.32 0.00 3.75 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00