NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 Q 4.3762 8.3293 119.6871 56.1734 30.7189 174.8813 6 T 4.4590 8.2327 113.8944 60.1758 69.8301 171.9920 7 M 4.6161 9.2737 123.0087 53.7694 35.0320 177.3437 8 K 4.1656 8.6768 125.8633 56.8793 33.7129 176.6935 9 G 3.7357 8.5069 108.7737 46.5140 0.0000 174.0995 10 L 4.5318 7.5444 118.3669 53.3935 43.1516 175.6041 11 D 4.5879 8.6384 127.5658 52.9996 39.5506 176.6900 12 I 3.9562 8.1970 127.2600 63.1987 38.3455 177.5638 13 Q 4.1552 8.2410 118.0308 57.7556 28.5652 176.7339 14 K 4.2768 7.7628 115.9816 56.3847 32.7947 177.4074 15 V 4.3858 7.3782 110.5174 61.7757 32.2165 176.4454 16 A 4.2015 8.0167 122.6207 53.2399 18.5585 177.0101 17 G 3.7359 8.8069 107.4305 43.9869 0.0000 172.8175 18 T 4.2421 7.8919 114.7313 61.9970 67.9896 174.5089 19 W 5.4516 8.7636 126.2074 55.4034 33.9491 173.8922 20 Y 4.7589 9.8005 118.5288 56.4420 41.3164 175.6524 21 S 4.8259 8.9626 119.9392 58.3328 62.7101 173.6562 22 L 4.4927 9.2610 128.2218 56.9015 43.1843 176.1896 23 A 5.3935 7.7992 119.0381 50.3037 22.8973 174.5132 24 M 5.1993 9.6420 118.9629 53.6065 35.9788 174.6474 25 A 5.5232 9.3203 124.1087 49.4583 23.2214 174.5154 26 A 5.0966 8.1275 119.1972 50.6536 22.1708 177.7891 27 S 4.4778 9.2197 116.4187 59.7713 64.0676 173.9885 28 D 4.8588 7.9016 120.3355 51.9755 43.5281 175.8343 29 I 3.7895 8.6573 127.8211 64.6000 37.2810 178.3190 30 S 4.3958 7.9619 113.0680 60.6634 63.0400 175.3880 31 L 4.1817 8.1877 121.4578 56.6741 41.6009 177.6667 32 L 4.5435 7.6112 116.5093 55.4221 43.7919 176.7030 33 D 4.1790 8.1769 117.5046 55.6954 41.8036 175.0058 34 A 4.0139 8.6817 128.4005 52.2649 18.1285 178.0667 35 Q 4.3246 8.5695 119.9868 56.9986 29.1910 176.5296 36 S 4.7277 7.7602 109.7860 58.9553 64.4660 174.4419 37 A 4.1846 7.5889 124.0746 51.3868 18.9886 175.4998 38 P 4.4107 0.0000 0.0000 63.5564 32.2529 176.9307 39 L 3.5927 8.4408 117.4562 55.7118 39.0001 174.8154 40 R 4.4016 7.1412 117.0982 56.2384 30.3331 176.9521 41 V 3.9271 7.4599 108.5251 61.2025 33.1688 176.2068 42 Y 4.6788 8.8585 120.5680 55.8163 40.1763 175.2229 43 V 3.7332 8.1958 124.6793 64.0828 31.9253 174.2011 44 E 4.5149 9.5605 125.3848 57.2650 31.8272 175.1613 45 E 5.1301 7.8643 118.9885 54.4226 33.9371 173.2321 46 L 4.8496 9.9472 126.5992 53.1434 44.3807 175.6873 47 K 4.7360 9.1065 124.2165 53.4457 34.2559 174.3548 48 P 5.0597 0.0000 0.0000 62.6555 32.8016 175.3152 49 T 4.6899 9.1847 109.6340 59.1012 71.5636 173.3777 50 P 4.2708 0.0000 0.0000 66.0819 31.4205 177.3726 51 E 4.1524 8.0574 114.2689 56.9564 29.4205 177.3876 52 G 4.0211 8.6409 108.9210 45.1164 0.0000 173.7134 53 D 4.8682 7.7663 119.2927 53.8834 42.8959 174.9743 54 L 4.7493 8.5870 120.8155 53.3540 45.3028 174.4151 55 E 4.8808 9.0204 128.0209 54.3038 32.0146 174.2727 56 I 4.8509 8.6766 121.2706 59.0572 40.2785 174.4326 57 L 5.2221 8.4576 126.3704 53.1567 44.6073 175.4573 58 L 4.8308 8.4588 121.4142 55.4294 44.5613 173.6148 59 Q 5.2133 8.7632 117.0044 54.3527 32.1055 175.1679 60 K 4.9237 9.6447 123.0049 54.5193 36.4540 175.0613 61 W 4.5770 8.9578 135.0000 57.3527 30.6184 174.3204 62 E 4.3227 8.7340 128.2357 57.3333 30.6289 180.8988 63 N 4.7351 8.1103 126.6030 54.1125 39.8699 174.4549 64 D 5.0406 8.4561 112.9758 55.1468 41.4680 175.6458 65 E 4.0070 6.7656 116.3339 54.2773 33.4100 175.9092 66 C 4.7232 7.7149 121.0668 55.3605 40.9965 172.6644 67 A 4.2733 9.1148 127.2390 51.3317 19.5950 175.6432 68 Q 5.0581 8.5274 121.0443 54.3408 31.6933 174.5959 69 K 4.7199 9.2065 124.6355 54.5898 36.9741 175.1837 70 K 4.4166 8.3227 121.3706 55.4134 33.7756 174.8355 71 I 4.2046 8.5378 128.8858 60.5328 38.6945 174.9471 72 I 4.6238 8.3663 126.9304 59.4391 39.4140 174.8513 73 A 4.8336 8.7846 129.3188 50.0030 20.7562 175.2520 74 E 4.8014 9.2974 123.2847 56.6552 30.6515 177.6397 75 K 4.4763 10.1546 125.2927 57.4232 33.8356 176.1198 76 T 4.6472 7.3662 109.5225 60.1363 71.5064 173.4092 77 K 3.9501 8.7489 119.1981 59.4139 32.5224 177.3058 78 I 4.2225 7.3815 120.2122 59.1488 37.9745 175.1782 79 P 4.0876 0.0000 0.0000 64.9143 31.5906 177.0708 80 A 4.3169 7.7232 119.1977 52.1647 19.4661 175.9516 81 V 4.7470 6.9848 116.5987 60.8818 33.9117 174.6348 82 F 5.3753 9.2154 125.8002 55.7378 43.1397 173.6845 83 K 5.1081 9.8729 124.1550 55.0216 34.3248 175.2352 84 I 4.9676 8.2252 119.2067 58.6993 41.8649 174.3128 85 D 5.1699 8.5015 118.3515 52.4152 41.3888 174.1781 86 A 4.6652 7.3102 119.7433 51.4490 22.6232 176.6032 87 L 3.5885 9.1496 117.4505 55.6848 39.0148 175.0264 88 N 4.2883 8.3948 112.4002 54.1040 36.0242 173.6262 89 E 4.7474 7.9388 118.4954 54.9368 32.0649 175.9085 90 N 6.0481 8.2544 112.4568 51.7810 40.3204 174.0155 91 K 4.9708 8.3536 119.1023 54.6589 36.6710 175.3774 92 V 4.8589 9.2977 123.8086 61.3480 34.3616 173.9732 93 L 4.9107 8.5794 128.5345 53.1721 43.7212 175.8961 94 V 4.3098 8.2768 124.6323 62.2672 31.5684 175.6993 95 L 4.3087 9.6181 130.0668 57.3871 41.6905 176.8587 96 D 4.7170 7.4878 116.1172 53.8276 44.7414 173.5577 97 T 3.1919 7.8103 113.9302 61.4439 69.6571 172.5416 98 D 4.4125 6.9777 125.6858 52.7389 40.3494 176.2772 99 Y 4.4842 7.6831 121.7397 58.7308 37.2893 170.6512 100 K 4.2225 8.1169 116.5144 57.9962 32.9152 176.8046 101 K 4.6613 9.8207 117.4242 57.2346 33.5495 175.9655 102 Y 5.8222 8.1560 116.4762 55.2915 42.1554 173.2920 103 L 4.6831 9.1103 121.8576 53.2887 45.8642 174.7977 104 L 5.3515 9.8558 127.1474 53.0899 44.0782 175.5315 105 F 5.4688 8.9763 117.8275 55.4565 42.0609 172.7770 106 C 5.2049 9.7878 116.4511 55.3975 41.6455 172.9851 107 M 5.4809 9.1055 120.2681 53.8792 35.5602 174.7040 108 E 5.0607 8.6770 117.7593 56.1625 33.7593 173.4990 109 N 5.8575 8.8690 121.3325 51.5340 39.7127 175.8129 110 S 4.0605 9.3748 121.6048 61.3877 63.2184 175.4778 111 A 4.1420 8.7375 123.6488 54.9934 17.9350 177.7935 112 E 4.7281 8.2842 116.7322 54.1301 31.1228 173.1669 113 P 4.4079 0.0000 0.0000 65.2043 32.1001 178.4311 114 E 3.9106 8.4904 115.9328 59.3963 29.3169 177.9934 115 Q 4.5811 8.1286 114.1365 55.6518 28.9208 176.0192 116 S 4.6682 7.5024 111.3413 57.3107 65.1223 174.0969 117 L 4.4011 8.0911 124.8762 55.5434 42.8722 176.0805 118 V 4.9126 9.1989 126.0554 60.1627 34.8681 173.7874 119 C 5.2762 9.0328 121.4542 55.1110 38.0292 173.0106 120 Q 5.1257 8.7851 121.5470 54.1771 32.4303 173.9180 121 C 4.7588 7.6924 122.2693 57.8947 33.2191 172.3331 122 L 5.4616 9.2396 126.8143 53.3280 44.1984 176.0277 123 V 5.3548 9.3397 114.8865 59.9250 35.5159 177.0262 124 R 3.5749 8.6325 123.0788 58.4627 30.3693 177.3171 125 T 4.5782 7.7529 107.3203 59.0471 71.3028 172.4871 126 P 3.6323 0.0000 0.0000 62.5860 30.9796 176.0048 127 E 4.6175 7.3145 115.8260 54.7705 33.4521 176.5295 128 V 3.5734 8.4189 121.5198 63.7280 32.0063 175.5374 129 D 4.7353 8.3630 125.2621 51.2606 41.6702 174.8839 130 D 4.5205 8.6177 125.9946 57.2230 39.5734 177.9926 131 E 3.9070 7.6957 117.1551 59.3691 29.3860 179.3611 132 A 3.6876 8.4302 120.7292 55.0330 18.8387 179.6778 133 L 4.0423 7.9174 116.8911 57.7132 41.7385 179.2096 134 E 3.9178 7.9038 119.5943 59.4583 29.0837 179.2058 135 K 4.0407 7.4822 118.2888 59.0202 31.7617 179.2276 136 F 4.4155 8.1448 120.8065 61.3294 39.5886 176.6377 137 D 4.3596 8.5438 119.1757 57.2575 40.2792 178.8321 138 K 3.8803 7.9336 118.6727 60.0692 32.0965 178.9389 139 A 3.7602 7.4484 120.3294 54.6822 18.4416 179.0287 140 L 3.9892 7.7297 116.5475 56.2811 41.5516 179.4043 141 K 3.9076 7.2027 118.0625 59.5163 32.2059 178.2845 142 A 4.0901 7.8285 119.3270 53.8261 18.7476 177.2135 143 L 4.4115 7.0843 116.7852 53.0031 43.0778 176.1334 144 P 4.4948 0.0000 0.0000 61.7464 30.2516 175.2399 145 M 4.4594 7.3714 118.8700 55.7337 33.4586 176.4303 146 H 4.9083 8.6444 118.5480 55.6009 30.7066 174.1223 147 I 4.7108 7.5211 118.6806 59.2040 41.7304 173.5375 148 R 5.1347 8.5837 127.8087 54.7486 32.8018 173.8979 149 L 5.0112 9.4792 126.5648 53.2728 46.0464 175.5065 150 S 5.1006 7.8455 112.3078 57.7285 65.2223 174.1878 151 F 5.1698 9.2692 121.5764 55.7417 41.8350 174.9649 152 N 4.8500 8.8920 118.1200 51.1660 39.1741 174.3737 153 P 4.1645 0.0000 0.0000 66.2635 31.0772 178.6497 154 T 3.8542 7.9642 112.7353 67.2048 68.5714 175.9404 155 Q 4.1480 8.6824 119.7128 59.0010 28.4976 178.9859 156 L 4.0685 7.8863 119.4190 57.0227 41.6875 178.5110 157 E 4.3367 7.7593 116.0734 56.9180 30.3525 176.8113 158 E 4.1326 6.9842 119.0240 55.8878 30.1699 176.5827 159 Q 4.0660 8.5368 120.8309 56.3307 28.8380 177.1541 160 C 4.2602 8.7863 119.8641 57.4242 41.4983 173.2547 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 5 Q 8.33 4.38 0.00 2.06 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.68 0.00 0.00 0.00 0.00 0.00 2.26 2.30 0.00 6 T 8.23 4.46 4.25 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 1.27 0.00 0.00 7 M 9.27 4.62 0.00 2.13 2.06 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.60 0.00 8 K 8.68 4.17 0.00 1.81 1.73 0.00 1.97 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.45 1.39 7.81 9 G 8.51 3.74 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 0.00 0.00 0.00 10 L 7.54 4.53 0.00 1.65 1.66 1.07 1.49 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 11 D 8.64 4.59 0.00 2.71 2.33 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 0.00 0.00 0.00 0.00 12 I 8.20 3.96 2.07 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.99 1.04 0.00 0.00 13 Q 8.24 4.16 0.00 2.20 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.50 0.00 0.00 0.00 0.00 0.00 2.39 2.46 0.00 14 K 7.76 4.28 0.00 0.90 1.15 0.00 1.26 0.00 0.00 1.32 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.17 1.25 7.81 15 V 7.38 4.39 2.19 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 0.96 0.00 0.00 1.03 0.00 0.00 16 A 8.02 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 17 G 8.81 3.74 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 0.00 0.00 0.00 18 T 7.89 4.24 4.13 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 1.09 0.00 0.00 19 W 8.76 5.45 0.00 3.07 3.06 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 20 Y 9.80 4.76 0.00 2.95 2.85 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 21 S 8.96 4.83 0.00 3.95 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 9.26 4.49 0.00 1.80 1.66 1.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 23 A 7.80 5.39 1.15 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 0.00 0.00 24 M 9.64 5.20 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.99 2.65 0.00 25 A 9.32 5.52 1.19 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 0.00 0.00 26 A 8.13 5.10 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 0.00 0.00 0.00 0.00 0.00 0.00 27 S 9.22 4.48 0.00 3.89 4.01 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.90 4.86 0.00 2.73 2.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 I 8.66 3.79 1.86 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 1.54 0.41 0.91 0.00 0.00 30 S 7.96 4.40 0.00 3.98 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.19 4.18 0.00 1.82 1.77 0.98 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.61 4.54 0.00 1.60 1.70 0.94 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 33 D 8.18 4.18 0.00 2.84 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.68 4.01 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.57 4.32 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.79 0.00 0.00 0.00 0.00 0.00 2.27 2.23 0.00 36 S 7.76 4.73 0.00 4.13 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 37 A 7.59 4.18 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 4.41 0.00 2.24 2.20 0.00 3.83 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 39 L 8.44 3.59 0.00 1.82 1.82 0.98 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 40 R 7.14 4.40 0.00 1.86 1.98 0.00 3.39 0.00 0.00 3.40 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.36 0.00 41 V 7.46 3.93 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 0.72 0.00 0.00 0.93 0.00 0.00 42 Y 8.86 4.68 0.00 2.96 2.78 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.20 3.73 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 0.69 0.00 0.00 0.94 0.00 0.00 44 E 9.56 4.51 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.45 0.00 45 E 7.86 5.13 0.00 1.95 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 46 L 9.95 4.85 0.00 1.84 1.62 0.71 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 47 K 9.11 4.74 0.00 1.74 1.67 0.00 1.64 0.00 0.00 1.94 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.32 1.33 7.81 48 P 0.00 5.06 0.00 2.05 2.02 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.22 0.00 49 T 9.18 4.69 4.23 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 0.00 0.00 0.00 1.24 0.00 0.00 50 P 0.00 4.27 0.00 2.06 2.18 0.00 3.67 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 51 E 8.06 4.15 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 52 G 8.64 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 0.00 0.00 0.00 53 D 7.77 4.87 0.00 2.86 2.63 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 0.00 0.00 0.00 0.00 54 L 8.59 4.75 0.00 1.15 0.71 0.70 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.02 4.88 0.00 2.00 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 0.00 2.15 2.17 0.00 56 I 8.68 4.85 1.68 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.51 0.67 0.00 0.00 57 L 8.46 5.22 0.00 1.64 1.57 0.95 0.33 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 58 L 8.46 4.83 0.00 1.82 1.76 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 8.76 5.21 0.00 2.24 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.78 0.00 0.00 0.00 0.00 0.00 2.26 2.36 0.00 60 K 9.64 4.92 0.00 1.67 1.60 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.36 1.35 7.81 61 W 8.96 4.58 0.00 3.63 3.24 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 0.00 0.00 0.00 0.00 62 E 8.73 4.32 0.00 1.90 1.73 0.00 0.00 0.00 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 2.17 0.00 63 N 8.11 4.74 0.00 2.60 2.53 0.00 0.00 6.94 8.47 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 64 D 8.46 5.04 0.00 2.73 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 65 E 6.77 4.01 0.00 1.59 1.49 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 2.10 1.97 0.00 66 C 7.71 4.72 0.00 3.18 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 A 9.11 4.27 1.23 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 0.00 0.00 0.00 0.00 0.00 0.00 68 Q 8.53 5.06 0.00 2.03 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.71 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 69 K 9.21 4.72 0.00 1.65 1.67 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.33 1.34 7.81 70 K 8.32 4.42 0.00 1.68 1.65 0.00 1.76 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.44 1.38 7.81 71 I 8.54 4.20 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.57 0.89 0.00 0.00 72 I 8.37 4.62 1.86 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 1.26 0.41 0.91 0.00 0.00 73 A 8.78 4.83 1.09 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 0.00 0.00 0.00 0.00 0.00 0.00 74 E 9.30 4.80 0.00 2.07 1.94 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 2.36 2.29 0.00 75 K 10.15 4.48 0.00 1.69 2.11 0.00 1.58 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.39 7.81 76 T 7.37 4.65 4.19 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 1.20 0.00 0.00 77 K 8.75 3.95 0.00 1.73 1.90 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.40 7.81 78 I 7.38 4.22 1.77 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.91 0.88 0.00 0.00 79 P 0.00 4.09 0.00 2.00 2.09 0.00 3.60 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 2.05 0.00 80 A 7.72 4.32 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 81 V 6.98 4.75 1.94 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 0.93 0.00 0.00 0.88 0.00 0.00 82 F 9.22 5.38 0.00 2.99 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 83 K 9.87 5.11 0.00 1.74 1.69 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.50 7.81 84 I 8.23 4.97 1.89 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.75 0.97 0.00 0.00 85 D 8.50 5.17 0.00 2.60 2.59 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.31 4.67 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 9.15 3.59 0.00 1.84 1.80 0.95 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.39 4.29 0.00 2.89 2.95 0.00 0.00 6.97 7.66 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 89 E 7.94 4.75 0.00 2.15 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 90 N 8.25 6.05 0.00 2.79 2.98 0.00 0.00 6.49 6.48 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 91 K 8.35 4.97 0.00 1.93 1.72 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.79 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.36 1.51 7.81 92 V 9.30 4.86 2.27 0.00 0.00 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 1.05 0.00 0.00 93 L 8.58 4.91 0.00 1.63 1.61 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 94 V 8.28 4.31 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.13 0.00 0.00 95 L 9.62 4.31 0.00 1.76 1.77 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 96 D 7.49 4.72 0.00 2.87 2.68 0.00 0.00 0.00 0.00 0.00 0.00 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 T 7.81 3.19 3.90 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 0.00 0.00 0.64 0.00 0.00 98 D 6.98 4.41 0.00 2.83 2.80 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 0.00 0.00 0.00 0.00 99 Y 7.68 4.48 0.00 3.26 3.36 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.12 4.22 0.00 1.81 1.89 0.00 1.79 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.73 7.81 101 K 9.82 4.66 0.00 2.35 2.03 0.00 1.70 0.00 0.00 1.82 0.00 0.00 3.09 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.46 7.81 102 Y 8.16 5.82 0.00 3.10 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 0.00 103 L 9.11 4.68 0.00 0.53 0.33 0.48 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 104 L 9.86 5.35 0.00 1.76 1.75 1.14 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 105 F 8.98 5.47 0.00 3.14 2.96 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 0.00 106 C 9.79 5.20 0.00 2.79 2.90 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 0.00 0.00 0.00 107 M 9.11 5.48 0.00 2.04 1.88 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.59 0.00 108 E 8.68 5.06 0.00 2.00 2.00 0.00 0.00 0.00 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 2.08 0.00 109 N 8.87 5.86 0.00 2.97 2.74 0.00 0.00 6.82 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 S 9.37 4.06 0.00 4.02 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.74 4.14 1.34 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 0.00 0.00 112 E 8.28 4.73 0.00 1.92 1.78 0.00 0.00 0.00 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 2.42 0.00 113 P 0.00 4.41 0.00 2.21 2.24 0.00 3.67 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.12 0.00 114 E 8.49 3.91 0.00 2.22 2.14 0.00 0.00 0.00 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 2.36 0.00 115 Q 8.13 4.58 0.00 2.25 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.72 0.00 0.00 0.00 0.00 0.00 2.40 2.41 0.00 116 S 7.50 4.67 0.00 4.16 3.90 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 0.00 0.00 0.00 117 L 8.09 4.40 0.00 1.98 1.59 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 118 V 9.20 4.91 2.06 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 0.75 0.00 0.00 0.98 0.00 0.00 119 C 9.03 5.28 0.00 2.89 3.06 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 0.00 120 Q 8.79 5.13 0.00 1.65 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.23 2.09 0.00 121 C 7.69 4.76 0.00 1.60 2.22 0.00 0.00 0.00 0.00 0.00 0.00 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 L 9.24 5.46 0.00 1.42 1.54 0.48 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 123 V 9.34 5.35 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 1.00 0.00 0.00 1.27 0.00 0.00 124 R 8.63 3.57 0.00 1.53 1.71 0.00 2.59 0.00 0.00 2.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 1.49 0.00 125 T 7.75 4.58 4.19 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 1.17 0.00 0.00 126 P 0.00 3.63 0.00 1.77 0.83 0.00 3.50 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.74 0.00 127 E 7.31 4.62 0.00 1.88 1.79 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 2.11 2.13 0.00 128 V 8.42 3.57 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 0.81 0.00 0.00 0.95 0.00 0.00 129 D 8.36 4.74 0.00 2.69 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 0.00 130 D 8.62 4.52 0.00 2.72 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 E 7.70 3.91 0.00 2.40 1.98 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 2.33 2.35 0.00 132 A 8.43 3.69 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 0.00 133 L 7.92 4.04 0.00 1.79 1.85 0.99 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 134 E 7.90 3.92 0.00 2.12 2.04 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 2.29 2.35 0.00 135 K 7.48 4.04 0.00 1.92 1.77 0.00 1.52 0.00 0.00 0.67 0.00 0.00 2.81 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.37 1.33 7.81 136 F 8.14 4.42 0.00 2.89 3.24 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 0.00 0.00 0.00 0.00 137 D 8.54 4.36 0.00 2.87 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 0.00 138 K 7.93 3.88 0.00 2.00 2.06 0.00 1.29 0.00 0.00 1.65 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.58 7.81 139 A 7.45 3.76 1.34 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 0.00 0.00 140 L 7.73 3.99 0.00 1.62 1.50 0.38 -0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 141 K 7.20 3.91 0.00 1.81 1.83 0.00 1.66 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.41 7.81 142 A 7.83 4.09 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 0.00 143 L 7.08 4.41 0.00 1.63 1.52 0.83 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 144 P 0.00 4.49 0.00 2.17 2.17 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.96 0.00 145 M 7.37 4.46 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 146 H 8.64 4.91 0.00 2.99 3.29 0.00 5.80 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 I 7.52 4.71 1.88 0.00 0.00 0.87 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 1.48 1.00 0.00 0.00 148 R 8.58 5.13 0.00 1.79 1.74 0.00 3.20 0.00 0.00 3.23 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 149 L 9.48 5.01 0.00 1.53 1.20 0.99 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 150 S 7.85 5.10 0.00 3.85 3.82 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 0.00 151 F 9.27 5.17 0.00 2.89 3.08 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 0.00 0.00 0.00 0.00 152 N 8.89 4.85 0.00 2.99 2.95 0.00 0.00 7.25 7.72 0.00 0.00 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 P 0.00 4.16 0.00 2.15 2.23 0.00 3.63 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 2.10 2.27 0.00 154 T 7.96 3.85 4.47 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 1.21 0.00 0.00 155 Q 8.68 4.15 0.00 2.60 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.80 0.00 0.00 0.00 0.00 0.00 2.51 2.48 0.00 156 L 7.89 4.07 0.00 1.71 1.57 0.87 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 157 E 7.76 4.34 0.00 2.15 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 2.45 2.49 0.00 158 E 6.98 4.13 0.00 2.09 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.42 0.00 159 Q 8.54 4.07 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.20 0.00 0.00 0.00 0.00 0.00 2.38 2.35 0.00 160 C 8.79 4.26 0.00 3.42 3.29 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 0.00