NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 C 4.3606 8.4544 118.0952 55.2689 42.0633 172.9685 2 E 4.2418 9.2819 116.3053 55.4934 26.8792 166.0140 3 E 3.8414 10.0676 132.3456 54.6932 28.3088 171.7649 4 P 3.7837 0.0000 0.0000 61.2300 32.1898 174.2420 5 P 4.4458 0.0000 0.0000 61.9393 32.2321 175.8203 6 T 4.4552 7.7531 111.1981 60.0842 70.4218 173.9467 7 F 4.8137 8.2508 121.8952 55.3204 42.3794 175.1528 8 E 3.9785 9.0145 122.4554 58.7154 29.7734 177.1035 9 A 3.7130 7.7632 116.7440 51.2384 20.2457 175.6194 10 M 5.1893 7.7444 115.0128 54.1229 35.6938 174.3447 11 E 4.9834 8.9836 122.4437 54.3900 34.1178 174.6996 12 L 4.2308 8.5556 124.2415 54.6574 43.3236 176.2325 13 I 3.9959 8.3416 127.8374 62.7664 37.3332 176.8556 14 G 3.9938 8.8480 112.5880 44.8436 0.0000 172.4868 15 K 4.0466 8.2028 119.3031 55.4382 32.4955 175.7821 16 P 4.5079 0.0000 0.0000 62.7097 31.9509 175.7335 17 K 4.6584 8.5168 120.4587 53.8604 34.8917 174.9712 18 P 4.7774 0.0000 0.0000 64.7609 31.5430 175.8508 19 Y 5.2216 7.6385 116.2131 55.8533 41.4605 173.9656 20 Y 4.6852 7.2359 120.6796 56.2634 42.1818 174.7661 21 E 4.4257 9.1939 122.5187 54.0742 31.8461 175.8025 22 I 3.8712 7.9470 121.4137 63.1893 37.4231 175.5187 23 G 4.1270 8.4102 113.1653 45.6142 0.0000 174.1764 24 E 4.2138 8.1904 119.4558 56.5229 30.4501 176.4240 25 R 5.3583 8.7130 123.1768 54.7029 33.4527 174.8483 26 V 4.5271 8.8273 117.2236 59.5923 35.3887 174.3845 27 D 5.1803 8.2608 121.6445 52.8420 44.9458 174.3458 28 Y 5.6863 8.8745 118.4966 55.6455 41.7759 174.8255 29 K 4.7089 8.3434 117.1831 55.6360 35.9505 176.2879 30 C 4.8265 8.9268 120.0864 57.3420 41.1504 173.9411 31 K 4.2972 8.6486 122.4962 55.6869 33.6147 175.9607 32 K 4.2469 8.5646 122.6090 58.6145 32.3141 176.7137 33 G 4.0370 9.6466 114.5311 45.1036 0.0000 171.5831 34 Y 5.5863 8.1215 116.2906 55.9918 41.6232 174.8213 35 F 5.2886 9.5216 117.0140 55.3445 41.6621 172.9360 36 Y 5.1295 8.7522 120.5184 56.4181 40.7324 174.0789 37 I 4.6272 7.9187 127.0127 58.3620 39.9994 173.9673 38 P 4.2629 0.0000 0.0000 61.8369 31.7579 174.1544 39 P 4.8086 0.0000 0.0000 62.1091 31.8970 175.2263 40 L 4.0381 7.7892 118.7654 55.2264 42.0922 176.4189 41 A 4.5646 8.1971 122.8704 52.1541 19.8201 177.2930 42 T 4.7298 8.4537 108.1712 61.3716 70.7632 172.4367 43 H 5.6691 7.7249 116.5697 55.0869 32.3355 171.8396 44 T 4.2853 8.1764 108.8931 61.7660 70.9758 171.7583 45 I 5.1907 8.0072 127.1401 59.5289 40.9805 175.2565 46 C 3.9462 8.4889 126.3284 56.1168 42.4688 172.8526 47 D 4.9248 8.3708 125.3034 52.5305 40.3027 177.7546 48 R 3.8216 7.7504 117.3322 59.2367 30.5969 177.7442 49 N 4.1061 7.5567 116.8540 55.3325 38.8410 175.6970 50 H 3.8179 8.9184 114.5268 56.4150 26.2981 174.2279 51 T 4.4158 7.3640 109.7376 59.6305 70.1169 173.7570 52 W 4.4889 8.7852 125.3802 57.0081 29.3519 175.6438 53 L 4.0481 8.1315 124.4000 52.7572 42.6670 175.6310 54 P 4.5927 0.0000 0.0000 62.8198 31.6739 176.5338 55 V 4.3727 8.3208 122.9206 60.2406 34.2316 173.4980 56 S 4.4829 8.1494 116.0576 56.5429 65.5429 172.9671 57 D 4.4682 7.8218 117.4408 52.9147 39.4311 176.8724 58 D 4.1718 7.6836 118.3100 56.0356 40.9129 176.6856 59 A 4.1807 7.6010 121.7905 52.3701 19.2095 176.8424 60 C 5.4078 7.7021 114.3010 55.4689 40.3003 173.4639 61 Y 4.4026 8.6565 122.4168 56.2159 40.0668 175.1295 62 R 3.9681 8.3800 122.1170 55.7028 30.7989 176.0710 63 E 4.4266 9.1246 126.1369 57.4043 30.8335 176.1220 64 T 4.9153 7.9107 111.4342 60.0377 71.7390 173.1342 65 C 4.3751 8.5975 120.7927 55.5470 41.1689 172.0202 66 P 4.4183 0.0000 0.0000 62.3823 31.6163 176.3837 67 Y 4.4087 8.2232 118.7894 58.3192 38.3238 175.8123 68 I 4.6242 8.6695 125.1704 59.6440 39.6036 175.5509 69 R 4.5335 8.4764 124.1707 54.3033 31.6277 175.8852 70 D 4.4177 8.7047 119.5504 54.4472 41.0351 175.5444 71 P 4.3703 0.0000 0.0000 62.1107 31.9640 175.4919 72 L 3.9871 8.1843 121.5808 56.0828 42.5614 176.1624 73 N 3.9200 9.2263 123.7255 53.7457 35.3408 173.2039 74 G 4.7537 7.2235 103.5572 46.0377 0.0000 172.9674 75 Q 4.9112 8.8723 117.9437 54.0419 32.7243 174.4967 76 A 4.5057 9.4525 126.2921 50.4006 20.5777 176.7017 77 V 4.1660 8.2084 116.2632 58.7085 35.4494 173.4844 78 P 4.3079 0.0000 0.0000 62.6477 30.7413 176.7475 79 A 3.8546 7.9633 126.8246 54.2066 18.4870 179.3470 80 N 4.6774 8.0213 109.9879 53.5113 39.5199 175.3217 81 G 3.9470 8.4307 104.7493 45.8563 0.0000 173.5167 82 T 4.3784 7.0558 108.3115 61.6272 70.3298 172.0422 83 Y 4.4319 8.3190 121.7208 57.7651 39.1329 176.1109 84 E 4.4799 7.9937 120.5596 55.9403 30.1992 176.5646 85 F 4.5527 7.6275 116.9053 58.4691 38.3214 175.7826 86 G 3.8366 9.6836 111.7443 45.2041 0.0000 171.9675 87 Y 5.0869 7.4591 116.7083 56.1500 42.2494 174.0521 88 Q 5.2238 9.4606 117.5177 54.7717 33.7834 174.3261 89 M 4.7027 8.9038 119.9965 54.0621 35.2144 173.8879 90 H 5.4009 8.7772 122.8610 53.9459 32.1589 172.9958 91 F 5.8300 8.6791 120.2663 54.8983 41.7762 174.8936 92 I 4.6737 8.2265 122.7295 59.7693 40.8383 175.0788 93 C 4.8779 8.9201 124.4657 55.8165 38.0799 173.4783 94 N 4.4719 8.5375 120.5757 53.0371 38.8559 175.5901 95 E 3.9329 8.9439 119.9646 59.2093 29.7608 177.7110 96 G 3.9082 8.3506 105.0093 45.5625 0.0000 171.7561 97 Y 5.0637 8.2451 116.7999 56.0113 42.1190 174.1978 98 Y 5.0323 8.4858 117.3675 54.8366 41.4030 174.9029 99 L 4.1515 8.8254 123.8158 54.7984 42.9306 176.6895 100 I 4.4764 8.1289 126.1287 58.3445 36.9285 175.8583 101 G 4.1252 7.4657 116.5178 46.6983 0.0000 173.9787 102 E 4.3670 8.6151 125.7870 55.2660 30.6232 175.8986 103 E 4.2459 9.0403 123.7400 59.1269 30.4469 176.8287 104 I 5.1503 7.7335 117.5026 59.3731 40.4453 175.0497 105 L 4.9414 8.5461 123.8465 53.2419 46.0160 175.0672 106 Y 5.0407 9.5879 120.9682 56.4189 40.3141 174.4772 107 C 4.3250 9.2332 125.8317 56.6243 39.1127 172.0646 108 E 5.0415 9.1487 126.0768 54.3805 32.3406 174.7452 109 L 4.5009 8.1141 123.9101 53.9322 43.0348 176.5212 110 K 4.3522 9.1330 126.1155 55.2694 34.7126 177.6572 111 G 3.9841 10.0469 118.0878 44.7735 0.0000 172.7568 112 S 4.6808 8.7511 112.2403 56.9514 64.0966 174.7876 113 V 4.4518 7.4346 120.0817 62.5186 35.2369 173.1551 114 A 4.9241 8.5960 130.0056 51.1367 19.6538 176.4827 115 I 4.5417 8.9744 115.9018 58.4713 41.7200 175.0486 116 W 4.9159 8.6138 124.2947 56.8470 30.1351 176.7669 117 S 4.4307 9.3085 116.5233 58.2018 62.4509 175.8442 118 G 4.1612 6.8833 107.1357 46.8461 0.0000 172.3190 119 K 4.6563 8.1670 121.9230 53.4589 35.4387 174.2377 120 P 3.5009 0.0000 0.0000 62.0923 31.7331 174.8160 121 P 4.5873 0.0000 0.0000 62.0493 33.7516 174.3321 122 I 4.7474 7.9307 118.0977 60.1620 42.0880 174.8738 123 C 5.5122 8.7599 120.5655 55.3435 36.5290 173.0219 124 E 4.9789 8.9270 124.8861 53.8868 31.9448 175.1610 125 K 3.2467 8.9371 125.7432 56.7620 32.7296 177.2671 126 V 2.9211 7.4886 117.1394 61.3787 31.3466 176.0275 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 1 C 8.45 4.36 0.00 2.20 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.28 4.24 0.00 2.32 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 0.00 2.35 2.61 0.00 3 E 10.07 3.84 0.00 2.45 2.16 0.00 0.00 0.00 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 2.44 0.00 4 P 0.00 3.78 0.00 1.65 0.95 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.44 0.00 5 P 0.00 4.45 0.00 1.40 1.54 0.00 3.42 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 6 T 7.75 4.46 4.18 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 0.00 0.00 0.00 1.15 0.00 0.00 7 F 8.25 4.81 0.00 2.80 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 8 E 9.01 3.98 0.00 1.92 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 2.29 2.32 0.00 9 A 7.76 3.71 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.74 5.19 0.00 1.65 1.52 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 11 E 8.98 4.98 0.00 1.99 1.82 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 2.25 2.25 0.00 12 L 8.56 4.23 0.00 1.39 1.45 0.39 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 13 I 8.34 4.00 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.67 0.88 0.00 0.00 14 G 8.85 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 0.00 0.00 0.00 15 K 8.20 4.05 0.00 1.76 1.78 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.45 1.41 7.81 16 P 0.00 4.51 0.00 2.08 2.04 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 17 K 8.52 4.66 0.00 0.79 1.30 0.00 1.54 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.27 1.31 7.81 18 P 0.00 4.78 0.00 2.22 2.15 0.00 3.78 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.06 0.00 19 Y 7.64 5.22 0.00 2.80 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 20 Y 7.24 4.69 0.00 2.87 2.60 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.19 4.43 0.00 1.99 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 22 I 7.95 3.87 1.82 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 1.29 0.18 0.85 0.00 0.00 23 G 8.41 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 0.00 0.00 0.00 0.00 24 E 8.19 4.21 0.00 2.17 2.13 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 2.41 2.41 0.00 25 R 8.71 5.36 0.00 1.87 1.83 0.00 3.28 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 26 V 8.83 4.53 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 0.00 0.00 0.27 0.00 0.00 27 D 8.26 5.18 0.00 2.54 2.45 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 0.00 0.00 0.00 0.00 28 Y 8.87 5.69 0.00 2.85 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 29 K 8.34 4.71 0.00 1.80 1.86 0.00 1.54 0.00 0.00 1.83 0.00 0.00 2.87 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.52 7.81 30 C 8.93 4.83 0.00 3.13 3.26 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 31 K 8.65 4.30 0.00 1.82 1.88 0.00 1.69 0.00 0.00 1.89 0.00 0.00 2.80 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.30 7.81 32 K 8.56 4.25 0.00 1.76 1.79 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.62 1.46 7.81 33 G 9.65 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 34 Y 8.12 5.59 0.00 3.04 2.93 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 0.00 0.00 0.00 0.00 35 F 9.52 5.29 0.00 3.16 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 36 Y 8.75 5.13 0.00 3.16 2.93 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 0.00 0.00 0.00 0.00 37 I 7.92 4.63 1.74 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.46 0.68 0.00 0.00 38 P 0.00 4.26 0.00 2.19 2.18 0.00 3.20 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.93 0.00 39 P 0.00 4.81 0.00 2.20 2.18 0.00 3.76 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.95 0.00 40 L 7.79 4.04 0.00 1.60 1.65 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 41 A 8.20 4.56 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.45 4.73 4.26 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 1.30 0.00 0.00 43 H 7.72 5.67 0.00 3.32 3.40 0.00 5.57 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 T 8.18 4.29 4.33 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 1.30 0.00 0.00 45 I 8.01 5.19 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.18 1.06 0.00 0.00 46 C 8.49 3.95 0.00 1.23 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 0.00 0.00 0.00 0.00 47 D 8.37 4.92 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 48 R 7.75 3.82 0.00 1.79 1.94 0.00 3.25 0.00 0.00 3.18 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.74 0.00 49 N 7.56 4.11 0.00 2.68 2.92 0.00 0.00 7.27 8.04 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 50 H 8.92 3.82 0.00 3.17 3.39 0.00 5.64 0.00 0.00 0.00 0.00 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 T 7.36 4.42 4.26 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 1.25 0.00 0.00 52 W 8.79 4.49 0.00 3.20 3.21 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 0.00 0.00 0.00 0.00 53 L 8.13 4.05 0.00 1.66 1.68 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.59 0.00 1.95 2.02 0.00 3.69 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 55 V 8.32 4.37 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 0.75 0.00 0.00 0.78 0.00 0.00 56 S 8.15 4.48 0.00 3.70 3.61 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 57 D 7.82 4.47 0.00 2.54 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 0.00 0.00 0.00 58 D 7.68 4.17 0.00 2.58 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 A 7.60 4.18 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 60 C 7.70 5.41 0.00 2.87 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 61 Y 8.66 4.40 0.00 1.70 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 62 R 8.38 3.97 0.00 1.49 1.85 0.00 2.72 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.50 0.00 63 E 9.12 4.43 0.00 2.26 1.95 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 2.56 2.44 0.00 64 T 7.91 4.92 4.21 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 0.00 0.00 0.00 1.33 0.00 0.00 65 C 8.60 4.38 0.00 1.94 1.45 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 0.00 0.00 0.00 0.00 66 P 0.00 4.42 0.00 2.35 2.08 0.00 3.66 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.10 0.00 67 Y 8.22 4.41 0.00 3.01 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 I 8.67 4.62 1.87 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.84 1.04 0.00 0.00 69 R 8.48 4.53 0.00 1.83 1.87 0.00 3.23 0.00 0.00 3.24 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.67 0.00 70 D 8.70 4.42 0.00 2.65 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 71 P 0.00 4.37 0.00 2.04 2.13 0.00 3.75 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 2.21 2.20 0.00 72 L 8.18 3.99 0.00 1.56 1.55 0.90 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 73 N 9.23 3.92 0.00 2.35 1.43 0.00 0.00 6.84 7.60 0.00 0.00 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 G 7.22 4.75 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 75 Q 8.87 4.91 0.00 2.04 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.74 0.00 0.00 0.00 0.00 0.00 2.23 2.25 0.00 76 A 9.45 4.51 1.02 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 77 V 8.21 4.17 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.86 0.00 0.00 78 P 0.00 4.31 0.00 1.96 1.80 0.00 3.55 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 2.10 1.90 0.00 79 A 7.96 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 8.02 4.68 0.00 2.37 2.72 0.00 0.00 7.06 7.65 0.00 0.00 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 G 8.43 3.95 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 0.00 0.00 0.00 82 T 7.06 4.38 3.93 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 0.00 0.00 0.00 0.31 0.00 0.00 83 Y 8.32 4.43 0.00 3.07 2.91 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 0.00 0.00 0.00 84 E 7.99 4.48 0.00 2.18 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 2.48 2.30 0.00 85 F 7.63 4.55 0.00 2.91 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 86 G 9.68 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 Y 7.46 5.09 0.00 2.98 3.02 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 88 Q 9.46 5.22 0.00 1.89 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.76 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 89 M 8.90 4.70 0.00 1.58 1.37 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.72 0.00 90 H 8.78 5.40 0.00 3.01 3.01 0.00 5.62 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 91 F 8.68 5.83 0.00 2.83 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 92 I 8.23 4.67 1.88 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 1.33 0.83 0.93 0.00 0.00 93 C 8.92 4.88 0.00 2.95 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 94 N 8.54 4.47 0.00 2.71 2.77 0.00 0.00 6.48 7.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.94 3.93 0.00 1.95 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 2.31 2.35 0.00 96 G 8.35 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 8.25 5.06 0.00 2.73 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 98 Y 8.49 5.03 0.00 2.94 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 99 L 8.83 4.15 0.00 1.72 1.64 0.96 0.95 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 0.00 100 I 8.13 4.48 1.89 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.88 0.96 0.00 0.00 101 G 7.47 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 0.00 0.00 0.00 0.00 102 E 8.62 4.37 0.00 1.89 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 0.00 2.27 2.29 0.00 103 E 9.04 4.25 0.00 1.94 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 2.43 2.36 0.00 104 I 7.73 5.15 1.74 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 1.01 0.48 0.38 0.00 0.00 105 L 8.55 4.94 0.00 1.54 1.69 0.73 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 9.59 5.04 0.00 3.01 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 0.00 107 C 9.23 4.32 0.00 2.24 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 0.00 108 E 9.15 5.04 0.00 1.95 1.80 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 2.30 2.59 0.00 109 L 8.11 4.50 0.00 0.44 1.02 0.69 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 110 K 9.13 4.35 0.00 1.70 1.64 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.29 1.46 7.81 111 G 10.05 3.98 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 0.00 0.00 0.00 112 S 8.75 4.68 0.00 3.94 3.88 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 0.00 113 V 7.43 4.45 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 0.94 0.00 0.00 0.90 0.00 0.00 114 A 8.60 4.92 1.21 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 0.00 0.00 0.00 0.00 0.00 0.00 115 I 8.97 4.54 1.89 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 1.18 0.81 0.88 0.00 0.00 116 W 8.61 4.92 0.00 3.43 3.21 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 0.00 0.00 0.00 0.00 117 S 9.31 4.43 0.00 4.11 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 0.00 118 G 6.88 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.17 4.66 0.00 1.68 1.63 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.43 7.81 120 P 0.00 3.50 0.00 1.82 1.63 0.00 3.56 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.89 0.00 121 P 0.00 4.59 0.00 1.91 2.05 0.00 2.20 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 122 I 7.93 4.75 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.54 0.92 0.00 0.00 123 C 8.76 5.51 0.00 2.91 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 0.00 124 E 8.93 4.98 0.00 2.21 2.32 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 2.50 2.58 0.00 125 K 8.94 3.25 0.00 1.55 1.54 0.00 0.85 0.00 0.00 1.21 0.00 0.00 2.69 0.00 0.00 2.52 0.00 0.00 0.00 0.00 1.08 1.25 7.81 126 V 7.49 2.92 1.74 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 0.08 0.00 0.00 0.74 0.00 0.00