NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 8 S 4.4444 8.1814 115.4016 57.6540 63.8687 176.9536 9 G 3.2682 8.8553 106.9754 47.2441 0.0000 171.6817 10 M 3.8610 7.7245 115.8979 55.2630 37.0036 174.8230 11 Q 3.7814 8.1654 119.1087 59.1723 28.9151 178.1781 12 L 3.8247 7.9177 120.3130 58.2611 42.1399 178.5459 13 E 3.9288 8.0629 117.7389 59.6559 29.4575 179.2993 14 I 3.7905 7.6974 119.6804 64.4321 37.0560 178.4984 15 Q 3.9697 8.0925 118.9079 58.8685 28.6090 178.9932 16 V 3.5902 8.0108 119.1251 66.0827 31.6096 177.9241 17 A 4.1823 8.1973 120.3990 55.1985 18.1449 179.5924 18 L 3.9811 8.3919 117.9282 57.8810 41.4702 179.1165 19 N 4.3382 8.4179 117.0889 56.7692 38.6689 176.5959 20 F 4.2416 8.0317 120.4317 61.3400 39.7888 176.9049 21 I 3.7159 8.0250 119.5796 64.3362 37.1029 178.2472 22 I 3.8601 8.0758 113.0019 62.5630 37.3225 177.8954 23 S 4.3015 7.5462 115.8956 61.3304 62.8706 175.2251 24 Y 4.1040 7.5011 118.2593 59.2575 38.0200 176.6834 25 L 4.2048 7.5817 119.9262 55.5552 42.5293 176.6893 26 Y 4.4127 6.8941 115.6054 59.2260 38.3776 176.8847 27 N 4.5543 9.0496 117.8997 53.7349 37.0318 175.0287 28 K 4.4094 7.9145 115.9108 56.7799 34.3670 176.1045 29 L 4.7762 7.7673 116.1049 51.2412 45.0839 174.9433 30 P 4.1924 0.0000 0.0000 63.1446 32.2579 176.8557 31 R 4.0664 8.8635 123.0596 59.9352 30.0019 178.2232 32 R 3.9476 8.0124 117.5028 59.6610 30.0628 178.5416 33 R 4.0032 7.9458 117.3567 59.1005 30.0453 179.0275 34 V 3.4839 7.9492 118.2654 65.8003 31.3659 177.8951 35 N 4.4293 8.1984 116.0248 56.4958 38.3986 177.4571 36 I 3.7056 7.6665 120.7005 64.1738 37.0749 178.1138 37 F 4.1579 8.5549 121.8488 61.4195 39.2132 177.4616 38 G 3.5605 8.4609 105.3100 47.8318 0.0000 175.5303 39 E 3.9544 8.3022 121.0886 59.2033 29.3967 179.3667 40 E 3.8712 8.4517 119.0975 59.1244 29.4757 179.0662 41 L 3.6372 7.7523 120.6887 57.8005 42.0411 178.5635 42 E 3.7301 8.0247 119.2112 59.3597 29.7129 178.7962 43 R 3.7915 7.7190 118.4712 59.3544 30.0739 178.4383 44 L 3.8790 8.0709 119.1287 57.6642 41.6001 179.5461 45 L 3.3609 7.9897 119.2654 57.4197 41.5979 179.5351 46 K 3.7220 7.6609 118.4089 59.3500 31.7533 179.2903 47 K 3.9160 7.5388 118.2586 59.3799 32.2183 178.5242 48 K 4.2024 7.6958 118.8370 59.7773 32.4398 178.2102 49 Y 4.7304 8.5990 117.2600 59.3924 37.7778 175.6811 50 E 4.0269 7.4954 120.5377 57.9300 29.9203 177.2452 51 G 3.9955 9.2031 113.9036 45.9030 0.0000 172.6563 52 H 4.6089 8.4982 116.6699 54.9371 29.6371 174.3895 53 W 4.4489 7.3537 128.6825 55.9211 32.1651 173.6780 54 Y 4.5681 7.5743 124.6875 55.0730 37.8134 174.6137 55 P 4.1091 0.0000 0.0000 65.6422 31.6178 178.2120 56 E 4.2518 8.1657 115.6680 58.3963 29.9909 177.6876 57 K 4.2206 7.9750 118.6282 53.9650 33.0428 174.4963 58 P 3.9591 0.0000 0.0000 66.4378 31.8525 178.4158 59 Y 4.1221 7.0001 116.5473 58.9474 38.2702 175.5076 60 K 4.2227 7.1017 122.9400 57.4336 32.4794 176.8031 61 G 4.1340 9.1033 114.2504 46.0445 0.0000 174.6507 62 S 4.3913 8.2200 115.3370 61.2542 62.0927 176.4948 63 G 3.7984 8.1759 107.0862 47.8401 0.0000 174.9674 64 F 4.3839 8.3290 121.7122 61.1660 39.5695 176.9333 65 R 4.0266 8.2213 116.6661 57.5126 30.1589 176.7621 66 C 4.0598 7.6709 119.0860 60.2391 32.1635 173.3865 67 I 4.3641 8.7623 127.6932 60.7211 38.2923 174.2896 68 H 5.0319 8.6709 124.5366 54.4024 31.2485 174.4953 69 I 5.0767 9.1847 123.4618 58.4115 38.5903 174.7200 70 G 4.0287 9.3700 123.5473 44.0809 0.0000 172.7747 71 E 4.0619 8.7915 120.9415 58.0978 29.6273 177.1659 72 K 4.7236 7.8606 116.9652 54.2150 35.0026 175.2075 73 V 4.8659 7.8761 120.0417 59.3594 34.3795 175.0511 74 D 4.4056 8.6437 122.5476 53.6944 41.8442 175.2825 75 P 4.2659 0.0000 0.0000 66.0927 31.1682 179.1673 76 V 3.7717 8.3215 111.1778 64.4124 31.3438 178.7262 77 I 3.7533 7.8181 119.6635 64.3401 37.0051 178.2717 78 E 4.0163 8.1093 118.9955 59.4728 29.4486 179.3515 79 Q 3.9333 8.5413 118.2836 58.9276 28.5986 178.5138 80 A 3.8841 7.9288 120.8035 55.0712 18.5539 179.6425 81 S 4.4515 8.2937 113.6321 61.9701 62.8564 177.1550 82 K 4.1409 7.9227 118.9791 58.4097 31.7961 178.1328 83 E 4.6249 7.6774 116.7414 55.8574 29.9849 176.1163 84 S 4.5464 7.8685 111.6030 57.1936 64.3117 174.8341 85 G 3.8866 8.4404 108.4568 46.0028 0.0000 173.0764 86 L 4.5417 7.5305 118.2633 52.6061 43.6134 175.6130 87 D 4.5188 8.3047 121.9958 53.4493 42.1111 176.7132 88 I 3.6469 8.5864 126.3381 64.6900 37.8312 177.5607 89 D 4.3368 8.8127 119.7905 57.1463 40.3412 178.4764 90 D 4.2970 7.8384 119.1442 57.0039 41.1874 178.6582 91 V 3.5134 7.5072 118.2533 66.1583 31.6749 178.1453 92 R 3.9868 8.2885 118.2521 59.2517 29.6420 179.3737 93 G 3.5458 8.0691 104.6698 47.2107 0.0000 174.8163 94 N 4.6102 7.6791 116.4844 53.2968 39.2386 175.4485 95 L 3.9597 6.4385 119.3624 52.4219 42.9617 174.8527 96 P 4.1640 0.0000 0.0000 62.2558 31.7842 176.5057 97 Q 3.8536 8.5962 123.5266 57.8778 30.1334 175.9389 98 D 4.3283 8.5758 123.1343 55.2804 38.6219 172.9582 99 L 4.8789 7.9823 121.1422 54.6522 44.3754 176.3642 100 S 4.7168 8.8175 121.3017 56.4734 66.4457 173.0300 101 V 4.7195 8.2820 124.6123 60.9202 34.2100 173.9919 102 W 5.0970 9.5144 129.0027 55.3402 31.0681 175.4490 103 I 4.9456 8.7213 125.3097 59.9073 38.9376 174.4917 104 D 4.5537 9.1418 126.3316 50.9876 44.7295 173.8396 105 P 4.1671 0.0000 0.0000 63.9266 31.5686 177.0014 106 F 4.1625 9.8837 120.2388 57.7422 37.5253 173.9263 107 E 5.2803 8.1368 120.0089 55.3259 33.6907 174.1476 108 V 5.2271 9.2693 126.9695 61.3464 35.0008 174.3751 109 S 5.2573 9.2944 121.1539 57.8892 67.3280 171.8348 110 Y 5.4744 8.8387 117.8083 56.5847 42.0925 173.4783 111 Q 4.9083 9.2802 120.0054 55.1334 33.0192 173.2111 112 I 4.5637 8.7723 127.7148 63.2247 38.6019 175.2599 113 G 4.0403 9.2924 115.6219 45.2284 0.0000 172.5762 114 E 3.9124 8.8942 124.2996 58.9164 29.5443 177.8502 115 K 4.4987 7.9857 114.3541 55.9506 32.4671 176.3894 116 G 4.0442 8.5806 108.8480 43.3688 0.0000 172.2860 117 P 4.3597 0.0000 0.0000 62.2494 32.0800 176.1067 118 V 4.1143 8.1453 120.8088 62.4565 32.1144 175.0307 119 K 4.3737 8.7653 128.4169 54.7035 34.2482 175.6196 120 V 4.4554 8.1531 124.6358 61.8271 32.0276 175.2383 121 L 4.4354 8.7908 128.8570 57.1555 42.4898 176.9444 122 Y 5.0917 7.8965 118.9257 55.8275 42.4612 174.4071 123 V 4.3724 7.5620 124.0772 60.7306 34.2949 173.3931 124 D 4.7575 8.7771 126.0671 51.4915 41.2017 175.0695 125 D 4.4720 8.0238 129.0098 52.9353 40.2563 177.1071 126 N 4.4338 7.8187 121.6648 54.9808 39.1281 174.6293 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 8 S 8.18 4.44 0.00 4.00 3.60 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 9 G 8.86 3.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 M 7.72 3.86 0.00 1.33 0.83 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.83 0.00 11 Q 8.17 3.78 0.00 2.09 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.65 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 12 L 7.92 3.82 0.00 1.74 1.54 0.76 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.06 3.93 0.00 2.41 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 0.00 2.95 2.65 0.00 14 I 7.70 3.79 1.91 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.78 0.81 0.00 0.00 15 Q 8.09 3.97 0.00 2.25 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.47 0.00 16 V 8.01 3.59 2.28 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 1.14 0.00 0.00 0.78 0.00 0.00 17 A 8.20 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 18 L 8.39 3.98 0.00 1.92 1.76 0.91 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.42 4.34 0.00 2.98 3.10 0.00 0.00 6.88 7.25 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 20 F 8.03 4.24 0.00 3.08 3.32 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 21 I 8.02 3.72 2.06 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.23 0.99 0.00 0.00 22 I 8.08 3.86 1.47 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.89 1.01 0.00 0.00 23 S 7.55 4.30 0.00 3.88 4.15 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 24 Y 7.50 4.10 0.00 2.89 3.10 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 25 L 7.58 4.20 0.00 1.37 1.37 0.34 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 26 Y 6.89 4.41 0.00 3.03 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 27 N 9.05 4.55 0.00 2.91 3.00 0.00 0.00 6.77 7.61 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 28 K 7.91 4.41 0.00 1.81 1.77 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.69 7.81 29 L 7.77 4.78 0.00 1.44 1.44 0.72 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 30 P 0.00 4.19 0.00 2.14 2.01 0.00 3.58 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 2.15 0.00 31 R 8.86 4.07 0.00 1.97 2.00 0.00 3.36 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.90 0.00 32 R 8.01 3.95 0.00 1.94 1.93 0.00 3.24 0.00 0.00 3.35 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 33 R 7.95 4.00 0.00 2.01 2.03 0.00 3.16 0.00 0.00 3.40 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.68 0.00 34 V 7.95 3.48 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 0.25 0.00 0.00 0.74 0.00 0.00 35 N 8.20 4.43 0.00 3.08 2.91 0.00 0.00 7.01 6.79 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 36 I 7.67 3.71 2.04 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 1.42 0.84 0.92 0.00 0.00 37 F 8.55 4.16 0.00 3.15 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 38 G 8.46 3.56 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 0.00 0.00 0.00 39 E 8.30 3.95 0.00 2.16 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 0.00 2.31 2.48 0.00 40 E 8.45 3.87 0.00 1.88 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 2.47 2.40 0.00 41 L 7.75 3.64 0.00 1.17 1.47 0.68 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.02 3.73 0.00 2.05 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 2.20 2.22 0.00 43 R 7.72 3.79 0.00 1.86 1.96 0.00 3.10 0.00 0.00 3.11 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 44 L 8.07 3.88 0.00 1.70 1.54 0.79 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 45 L 7.99 3.36 0.00 1.28 0.88 0.79 0.46 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 46 K 7.66 3.72 0.00 1.83 1.74 0.00 1.55 0.00 0.00 1.46 0.00 0.00 2.76 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.41 7.81 47 K 7.54 3.92 0.00 1.73 1.90 0.00 1.79 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.43 7.81 48 K 7.70 4.20 0.00 1.75 1.79 0.00 1.72 0.00 0.00 1.62 0.00 0.00 2.13 0.00 0.00 2.40 0.00 0.00 0.00 0.00 1.61 1.55 7.81 49 Y 8.60 4.73 0.00 2.93 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 50 E 7.50 4.03 0.00 2.14 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 0.00 2.34 2.27 0.00 51 G 9.20 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 0.00 0.00 0.00 52 H 8.50 4.61 0.00 3.33 3.35 0.00 5.80 0.00 0.00 0.00 0.00 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 W 7.35 4.45 0.00 3.18 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 54 Y 7.57 4.57 0.00 2.83 2.75 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 55 P 0.00 4.11 0.00 2.14 2.24 0.00 3.74 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.15 0.00 56 E 8.17 4.25 0.00 1.99 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 2.35 0.00 57 K 7.98 4.22 0.00 0.79 1.61 0.00 1.13 0.00 0.00 1.59 0.00 0.00 2.78 0.00 0.00 2.58 0.00 0.00 0.00 0.00 1.16 1.05 7.81 58 P 0.00 3.96 0.00 2.11 2.28 0.00 3.62 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.06 0.00 59 Y 7.00 4.12 0.00 3.21 3.25 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 60 K 7.10 4.22 0.00 1.49 1.67 0.00 1.43 0.00 0.00 0.64 0.00 0.00 2.36 0.00 0.00 2.37 0.00 0.00 0.00 0.00 1.30 1.25 7.81 61 G 9.10 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 62 S 8.22 4.39 0.00 4.09 3.97 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 0.00 0.00 0.00 0.00 63 G 8.18 3.80 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 0.00 0.00 0.00 64 F 8.33 4.38 0.00 3.11 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 65 R 8.22 4.03 0.00 1.76 1.51 0.00 2.46 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.90 0.00 66 C 7.67 4.06 0.00 3.23 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 67 I 8.76 4.36 1.82 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 1.24 0.61 0.88 0.00 0.00 68 H 8.67 5.03 0.00 3.08 3.15 0.00 5.76 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 I 9.18 5.08 1.81 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 1.14 0.67 0.86 0.00 0.00 70 G 9.37 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.79 4.06 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.29 0.00 72 K 7.86 4.72 0.00 1.76 1.65 0.00 1.58 0.00 0.00 1.85 0.00 0.00 2.95 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.37 7.81 73 V 7.88 4.87 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 0.72 0.00 0.00 0.93 0.00 0.00 74 D 8.64 4.41 0.00 2.83 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.27 0.00 2.16 2.09 0.00 3.62 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 76 V 8.32 3.77 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 0.74 0.00 0.00 0.91 0.00 0.00 77 I 7.82 3.75 2.01 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 1.51 0.85 1.04 0.00 0.00 78 E 8.11 4.02 0.00 2.16 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 2.40 2.34 0.00 79 Q 8.54 3.93 0.00 2.13 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 80 A 7.93 3.88 0.73 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 0.00 0.00 81 S 8.29 4.45 0.00 4.14 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 0.00 82 K 7.92 4.14 0.00 1.88 1.88 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.60 7.81 83 E 7.68 4.62 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 2.24 2.46 0.00 84 S 7.87 4.55 0.00 4.19 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 85 G 8.44 3.89 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 0.00 0.00 0.00 0.00 0.00 0.00 86 L 7.53 4.54 0.00 1.57 1.44 0.48 0.95 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 87 D 8.30 4.52 0.00 2.64 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 88 I 8.59 3.65 1.87 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 1.92 1.31 0.90 0.00 0.00 89 D 8.81 4.34 0.00 2.81 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 90 D 7.84 4.30 0.00 2.76 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.51 3.51 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 0.87 0.00 0.00 0.60 0.00 0.00 92 R 8.29 3.99 0.00 1.83 1.92 0.00 3.16 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.83 0.00 93 G 8.07 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.68 4.61 0.00 2.65 3.03 0.00 0.00 7.00 7.24 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 95 L 6.44 3.96 0.00 1.58 1.28 0.82 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 4.16 0.00 1.90 1.91 0.00 3.07 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.21 0.00 97 Q 8.60 3.85 0.00 1.99 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.74 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 98 D 8.58 4.33 0.00 2.87 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 99 L 7.98 4.88 0.00 1.92 1.59 1.17 0.69 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 0.00 100 S 8.82 4.72 0.00 3.19 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 0.00 101 V 8.28 4.72 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 1.13 0.00 0.00 1.06 0.00 0.00 102 W 9.51 5.10 0.00 3.40 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 0.00 103 I 8.72 4.95 2.23 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.83 1.31 0.00 0.00 104 D 9.14 4.55 0.00 2.58 2.43 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 0.00 105 P 0.00 4.17 0.00 1.54 1.14 0.00 3.13 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.44 0.00 106 F 9.88 4.16 0.00 3.25 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 0.00 107 E 8.14 5.28 0.00 2.04 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 2.25 2.42 0.00 108 V 9.27 5.23 2.35 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 1.12 0.00 0.00 1.26 0.00 0.00 109 S 9.29 5.26 0.00 4.10 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 0.00 110 Y 8.84 5.47 0.00 3.11 2.92 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 0.00 0.00 0.00 111 Q 9.28 4.91 0.00 2.56 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.81 0.00 0.00 0.00 0.00 0.00 2.45 2.68 0.00 112 I 8.77 4.56 2.02 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 1.02 0.00 0.00 113 G 9.29 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 0.00 114 E 8.89 3.91 0.00 1.95 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 0.00 2.34 2.48 0.00 115 K 7.99 4.50 0.00 1.79 1.81 0.00 1.83 0.00 0.00 1.74 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.37 7.81 116 G 8.58 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 0.00 117 P 0.00 4.36 0.00 2.16 2.06 0.00 3.80 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 1.97 1.96 0.00 118 V 8.15 4.11 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 0.64 0.00 0.00 0.81 0.00 0.00 119 K 8.77 4.37 0.00 0.79 1.30 0.00 1.25 0.00 0.00 1.57 0.00 0.00 2.79 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.23 1.13 7.81 120 V 8.15 4.46 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 0.82 0.00 0.00 0.88 0.00 0.00 121 L 8.79 4.44 0.00 1.73 1.83 0.72 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 122 Y 7.90 5.09 0.00 3.08 2.84 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 0.00 123 V 7.56 4.37 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 0.56 0.00 0.00 0.88 0.00 0.00 124 D 8.78 4.76 0.00 2.60 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 0.00 125 D 8.02 4.47 0.00 2.74 2.65 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 0.00 0.00 0.00 0.00 126 N 7.82 4.43 0.00 2.84 2.74 0.00 0.00 6.67 6.89 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