NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4196 8.3231 115.4127 60.4386 64.7251 171.9171 2 G 3.8449 8.6222 112.5716 43.2201 0.0000 172.8301 3 R 4.0276 8.8036 122.4109 59.1800 32.7796 174.2473 4 G 4.2030 7.7216 107.7308 44.2729 0.0000 174.1391 5 K 4.4902 8.3221 115.3064 55.8336 36.1820 175.9814 6 Q 4.4164 8.4061 120.5076 55.8960 29.6337 175.7752 7 G 4.1603 7.6179 118.9992 44.1429 0.0000 174.6984 8 G 4.5470 9.2914 109.0462 45.8841 0.0000 175.9162 9 K 4.3061 7.2329 117.3461 54.5041 31.1317 180.0346 10 A 5.0001 7.9542 129.8474 53.0449 19.8366 175.1144 11 R 4.6036 7.9554 125.4835 57.1665 30.5693 177.0474 12 A 4.6251 7.7943 119.0311 51.0737 20.0105 175.8782 13 K 4.2927 7.9276 121.2804 56.4921 34.2959 175.9274 14 A 4.1716 8.2806 121.1195 52.4690 18.7366 177.6582 15 K 4.4299 8.1738 118.2949 53.6510 34.9123 177.3380 16 S 4.2234 8.7297 119.5350 59.0328 64.5807 175.6827 17 R 3.9593 8.5385 121.8562 59.2803 29.8741 179.6606 18 S 4.1279 7.9862 114.8156 61.5764 62.9853 176.3235 19 S 4.0756 8.6751 116.1357 61.5100 61.9429 176.1015 20 R 3.9246 8.0618 119.9326 58.8770 29.8328 177.2759 21 A 4.5213 7.9256 117.8161 50.9699 19.2412 176.9516 22 G 3.8331 8.0030 105.4986 46.8706 0.0000 173.9647 23 L 4.8895 8.1791 118.2561 52.7120 44.7317 176.8921 24 Q 4.3283 9.6279 120.2460 58.1537 29.4527 177.3761 25 F 3.9967 8.6319 114.8684 56.7330 39.7161 173.8617 26 P 4.5757 0.0000 0.0000 61.9252 31.8197 176.9878 27 V 3.7493 8.9048 124.8338 65.9938 31.5471 178.1104 28 G 3.6602 8.0880 105.0055 47.6259 0.0000 175.5872 29 R 3.9288 7.9066 120.5442 59.2403 30.1942 178.4798 30 V 3.6122 7.9155 118.1317 66.2306 31.5104 177.4488 31 H 4.2140 8.4309 117.9839 59.3104 29.7523 177.2585 32 R 3.9080 8.0294 120.4582 59.5378 29.9631 178.5395 33 L 4.1288 8.7310 119.1043 57.5882 41.8586 179.6126 34 L 4.2810 8.2817 119.5179 58.0373 41.4260 179.7189 35 R 3.8540 8.0746 117.0416 58.6266 30.2935 178.6117 36 K 4.3305 8.3315 118.3722 58.6664 32.7840 178.4334 37 G 3.4021 7.7427 104.4903 43.8828 0.0000 172.8627 38 N 4.0955 7.2380 116.2329 54.4880 36.1692 173.9371 39 Y 4.5024 7.3762 113.8495 59.4796 39.6464 176.4144 40 A 4.6170 7.5230 119.0743 50.9491 22.1055 175.7817 41 E 4.1530 8.9736 119.3477 58.8892 29.6812 178.2794 42 R 4.6537 7.7421 114.7898 54.0693 33.4516 175.0688 43 V 4.2800 8.2370 120.2953 60.6578 33.2316 175.7610 44 G 3.7747 8.4973 116.2402 45.1324 0.0000 173.3437 45 A 3.9816 8.7139 123.8608 55.0895 18.6250 180.2258 46 G 3.7391 8.0910 101.6463 47.1529 0.0000 175.2339 47 A 3.9824 7.7451 123.1815 55.2431 18.3368 178.0188 48 P 4.2260 0.0000 0.0000 65.6330 31.4969 178.7645 49 V 3.5580 7.7299 117.7228 66.1155 31.6630 177.2188 50 Y 3.9027 8.3461 119.5788 60.5968 38.6367 177.7109 51 L 4.0650 8.3660 121.2242 58.1391 42.1445 178.7530 52 A 4.1006 8.6839 120.9664 55.0347 18.1673 179.5327 53 A 3.8434 7.8900 119.0344 55.2736 18.3491 180.0824 54 V 3.5818 7.7400 116.6187 66.0044 31.6050 178.3851 55 L 3.8830 8.0363 118.8707 57.6087 41.4640 178.9196 56 E 2.5400 7.6522 119.4667 58.7653 29.3542 178.1470 57 Y 4.0170 7.9726 119.5963 60.8487 38.8044 178.2231 58 L 3.5047 8.0596 120.3102 57.8085 41.7122 179.6842 59 T 3.8407 7.9197 109.5127 64.3808 68.6360 176.6594 60 A 3.8928 7.8541 123.9378 54.8459 18.5227 179.0715 61 E 3.6768 7.9465 117.9970 59.5548 29.6290 179.1523 62 I 3.6774 7.8584 120.0376 64.4172 37.1543 178.5335 63 L 3.9922 8.4602 120.1684 57.4363 41.4717 179.1786 64 E 3.8684 8.2977 119.4915 59.3840 29.6694 178.9850 65 L 3.9784 7.7905 118.4110 57.6382 41.6133 179.4160 66 A 4.0756 8.4368 121.2939 55.0793 18.3160 179.7122 67 G 3.6566 8.4923 104.7001 48.2976 0.0000 175.5980 68 N 4.3303 8.1061 118.0923 55.9384 38.3818 177.4373 69 A 4.1906 7.9873 122.0308 54.7171 18.3143 179.5705 70 A 3.3904 8.2076 119.9370 55.2469 18.4770 179.7613 71 R 3.7893 7.9679 117.2495 59.7806 29.9242 178.4520 72 D 4.4390 8.3984 117.7539 56.4838 40.7771 177.3790 73 N 4.7386 7.4595 114.9555 51.7641 39.1327 174.7474 74 K 3.8803 8.0702 118.5141 57.8181 30.1030 175.4680 75 K 4.7410 8.1935 115.9963 55.0930 35.5027 176.7347 76 T 4.2568 8.4317 116.5277 63.9368 69.6218 175.0601 77 R 4.5230 7.6766 121.2432 53.8703 31.5127 175.4093 78 I 3.9453 8.4798 127.0195 61.4899 37.7316 175.3052 79 I 4.5757 8.1307 117.5242 57.7209 40.6328 174.3353 80 P 4.2092 0.0000 0.0000 65.9011 30.8060 178.5915 81 R 3.8457 7.9496 116.7641 59.9476 29.9038 178.1000 82 H 4.2798 8.0613 115.6883 58.8614 28.6247 177.7426 83 L 4.0221 7.9121 120.2841 57.8276 41.4132 179.3939 84 Q 3.9678 8.2560 117.9096 59.1411 28.7380 178.7315 85 L 3.8884 8.2988 120.0168 58.0056 41.4241 179.6778 86 A 4.0300 7.9325 119.6760 55.0021 18.3110 179.5644 87 I 3.8244 8.0416 118.7650 64.7130 37.0568 178.9595 88 R 4.0104 8.5362 117.8138 58.7321 29.9940 178.0311 89 N 4.7550 8.0144 114.3181 52.9605 38.9555 174.1693 90 D 4.7933 7.4142 121.3481 52.2812 42.4460 176.0560 91 E 3.9640 9.0833 127.2128 59.9137 29.4034 179.4311 92 E 3.9544 8.1416 117.5448 59.4791 29.6152 179.2401 93 L 3.9970 8.5564 119.4035 57.7073 41.3025 179.0642 94 N 4.2670 8.4974 117.4386 56.6329 38.6683 176.9035 95 K 3.8263 8.1271 120.2515 59.2840 32.3504 178.2955 96 L 4.1621 8.2677 120.4427 56.9830 42.4159 177.4064 97 L 4.7638 8.1567 119.0064 54.1186 42.2458 178.7942 98 G 3.7613 7.6136 110.0330 47.7994 0.0000 175.2772 99 K 4.6030 7.9038 118.5680 56.0387 32.8970 175.7376 100 V 4.4527 7.5345 117.1140 61.0998 34.0188 174.4228 101 T 4.4873 8.3110 119.5477 60.1727 69.9037 173.2321 102 I 4.1333 8.1789 129.1458 59.5091 37.4757 175.1330 103 A 4.1555 8.4933 128.9179 53.7097 18.6409 176.5941 104 Q 3.5759 8.7247 118.8893 56.9482 26.3443 174.9529 105 G 3.7337 8.0202 107.8531 44.9647 0.0000 176.3610 106 G 3.8479 7.9717 107.7385 45.1422 0.0000 171.9250 107 V 4.5315 7.9679 111.5978 59.1474 35.4355 174.7673 108 L 4.3388 8.1445 120.3076 53.4092 42.2860 175.5601 109 P 4.2284 0.0000 0.0000 62.9041 31.6014 175.7632 110 N 4.3103 8.2263 117.6489 53.1264 41.0919 173.2975 111 I 4.4777 8.2719 126.9334 59.0347 39.7493 175.6892 112 Q 4.0203 8.6705 124.4208 55.8646 29.4788 177.2130 113 A 4.0044 8.9045 125.5716 55.5392 18.5007 180.0668 114 V 3.7537 7.7539 107.2064 64.0770 31.7574 177.5695 115 L 4.1714 7.7916 119.2110 56.9050 41.7686 177.7966 116 L 4.1668 7.5177 118.3245 53.5926 42.0924 175.2389 117 P 4.3166 0.0000 0.0000 62.7822 32.1514 175.9895 118 K 4.2648 8.7388 120.9428 56.0877 32.5781 175.1464 119 K 4.2964 8.5608 125.9605 57.5400 32.3375 178.8897 120 T 3.0541 9.5049 120.2538 61.8857 68.7819 175.5451 121 D 4.0445 6.2441 118.3620 54.5822 41.7790 173.9716 122 S 4.5940 7.9790 112.5424 59.6718 61.6640 171.4464 123 H 4.2452 8.4595 116.7494 54.8763 29.4197 175.1840 124 K 4.3451 7.6974 118.9081 57.0283 34.5306 176.4023 125 A 4.1021 7.7393 124.5150 53.0412 18.9906 175.7152 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 S 8.32 4.42 0.00 3.99 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 2 G 8.62 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 3 R 8.80 4.03 0.00 1.76 1.96 0.00 3.34 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.69 0.00 4 G 7.72 4.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 K 8.32 4.49 0.00 1.83 1.75 0.00 1.57 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.31 1.53 7.81 6 Q 8.41 4.42 0.00 2.01 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.05 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 7 G 7.62 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 8 G 9.29 4.55 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 9 K 7.23 4.31 0.00 1.79 1.44 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.55 7.81 10 A 7.95 5.00 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 11 R 7.96 4.60 0.00 1.91 2.02 0.00 2.99 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.41 0.00 12 A 7.79 4.63 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 13 K 7.93 4.29 0.00 1.71 1.76 0.00 1.68 0.00 0.00 1.71 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.39 1.49 7.81 14 A 8.28 4.17 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 15 K 8.17 4.43 0.00 1.69 1.71 0.00 1.81 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.35 7.81 16 S 8.73 4.22 0.00 4.05 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 17 R 8.54 3.96 0.00 1.91 2.05 0.00 3.16 0.00 0.00 3.37 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.74 0.00 18 S 7.99 4.13 0.00 3.89 4.17 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 19 S 8.68 4.08 0.00 3.85 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 20 R 8.06 3.92 0.00 2.06 2.09 0.00 3.31 0.00 0.00 3.24 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 21 A 7.93 4.52 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 22 G 8.00 3.83 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 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.18 4.89 0.00 1.62 1.77 0.98 0.78 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 24 Q 9.63 4.33 0.00 2.31 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.42 2.54 0.00 25 F 8.63 4.00 0.00 2.98 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 26 P 0.00 4.58 0.00 2.26 2.18 0.00 3.61 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 27 V 8.90 3.75 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 1.04 0.00 0.00 1.02 0.00 0.00 28 G 8.09 3.66 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 0.00 0.00 0.00 29 R 7.91 3.93 0.00 1.90 2.09 0.00 3.19 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 30 V 7.92 3.61 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 1.08 0.00 0.00 1.07 0.00 0.00 31 H 8.43 4.21 0.00 3.43 3.41 0.00 5.64 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.03 3.91 0.00 2.16 2.07 0.00 3.15 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 33 L 8.73 4.13 0.00 1.89 1.79 0.96 0.88 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 34 L 8.28 4.28 0.00 2.00 1.83 0.91 1.04 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 35 R 8.07 3.85 0.00 1.82 2.01 0.00 3.11 0.00 0.00 3.26 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.90 0.00 36 K 8.33 4.33 0.00 2.00 2.26 0.00 1.31 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.44 7.81 37 G 7.74 3.40 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 0.00 38 N 7.24 4.10 0.00 2.76 2.73 0.00 0.00 6.85 7.34 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 39 Y 7.38 4.50 0.00 3.06 2.94 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 40 A 7.52 4.62 1.29 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 0.00 0.00 41 E 8.97 4.15 0.00 1.98 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 2.33 2.29 0.00 42 R 7.74 4.65 0.00 1.76 1.81 0.00 3.15 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 43 V 8.24 4.28 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 0.83 0.00 0.00 1.02 0.00 0.00 44 G 8.50 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 A 8.71 3.98 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 46 G 8.09 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 47 A 7.75 3.98 1.36 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 0.00 0.00 48 P 0.00 4.23 0.00 2.45 2.34 0.00 3.63 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.63 0.00 49 V 7.73 3.56 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 1.03 0.00 0.00 0.99 0.00 0.00 50 Y 8.35 3.90 0.00 3.18 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 51 L 8.37 4.06 0.00 1.90 1.69 0.93 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.68 4.10 1.48 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 0.00 0.00 53 A 7.89 3.84 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 54 V 7.74 3.58 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 1.20 0.00 0.00 1.14 0.00 0.00 55 L 8.04 3.88 0.00 1.63 1.69 1.05 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 56 E 7.65 2.54 0.00 1.36 1.84 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 2.18 2.18 0.00 57 Y 7.97 4.02 0.00 3.04 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 58 L 8.06 3.50 0.00 1.62 1.59 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 59 T 7.92 3.84 4.31 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 1.23 0.00 0.00 60 A 7.85 3.89 1.35 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 0.00 0.00 61 E 7.95 3.68 0.00 1.56 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 2.10 2.26 0.00 62 I 7.86 3.68 1.82 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 1.47 0.58 0.89 0.00 0.00 63 L 8.46 3.99 0.00 1.67 1.71 0.95 0.81 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 64 E 8.30 3.87 0.00 2.11 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 2.28 2.38 0.00 65 L 7.79 3.98 0.00 1.74 1.68 0.94 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.44 4.08 1.35 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 0.00 0.00 67 G 8.49 3.66 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 0.00 0.00 0.00 68 N 8.11 4.33 0.00 2.93 2.86 0.00 0.00 6.94 7.38 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 69 A 7.99 4.19 1.37 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 0.00 0.00 0.00 0.00 0.00 0.00 70 A 8.21 3.39 1.24 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 0.00 0.00 71 R 7.97 3.79 0.00 1.86 2.06 0.00 3.09 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 72 D 8.40 4.44 0.00 2.78 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 73 N 7.46 4.74 0.00 2.85 2.86 0.00 0.00 7.00 8.67 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 74 K 8.07 3.88 0.00 1.91 1.90 0.00 1.65 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.53 7.81 75 K 8.19 4.74 0.00 1.66 1.70 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.49 1.58 7.81 76 T 8.43 4.26 4.24 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 1.21 0.00 0.00 77 R 7.68 4.52 0.00 1.75 1.83 0.00 3.25 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 78 I 8.48 3.95 1.90 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 1.48 0.66 0.95 0.00 0.00 79 I 8.13 4.58 1.82 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.63 0.96 0.00 0.00 80 P 0.00 4.21 0.00 2.27 2.25 0.00 3.58 0.00 0.00 3.68 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 81 R 7.95 3.85 0.00 1.85 1.78 0.00 3.31 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.78 0.00 82 H 8.06 4.28 0.00 3.37 3.49 0.00 5.70 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 L 7.91 4.02 0.00 1.87 1.72 0.93 1.00 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 84 Q 8.26 3.97 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.75 0.00 85 L 8.30 3.89 0.00 1.80 1.74 0.96 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.93 4.03 1.33 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 0.00 0.00 87 I 8.04 3.82 1.87 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 1.51 0.93 0.91 0.00 0.00 88 R 8.54 4.01 0.00 1.74 1.99 0.00 3.33 0.00 0.00 3.34 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.81 0.00 89 N 8.01 4.75 0.00 2.89 2.86 0.00 0.00 6.79 8.17 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 90 D 7.41 4.79 0.00 2.80 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 91 E 9.08 3.96 0.00 2.05 2.01 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 2.41 2.43 0.00 92 E 8.14 3.95 0.00 2.02 2.01 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 2.41 2.41 0.00 93 L 8.56 4.00 0.00 1.65 1.70 0.88 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 94 N 8.50 4.27 0.00 3.04 3.00 0.00 0.00 6.84 6.77 0.00 0.00 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 K 8.13 3.83 0.00 1.78 1.96 0.00 1.86 0.00 0.00 1.64 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.44 7.81 96 L 8.27 4.16 0.00 1.68 1.88 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 97 L 8.16 4.76 0.00 1.70 1.61 0.92 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 98 G 7.61 3.76 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 0.00 0.00 0.00 99 K 7.90 4.60 0.00 1.73 1.79 0.00 1.69 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.38 7.81 100 V 7.53 4.45 2.26 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 0.77 0.00 0.00 0.94 0.00 0.00 101 T 8.31 4.49 4.24 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 1.21 0.00 0.00 102 I 8.18 4.13 1.87 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 1.44 1.15 0.91 0.00 0.00 103 A 8.49 4.16 1.24 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 0.00 0.00 104 Q 8.72 3.58 0.00 2.20 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.90 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 105 G 8.02 3.73 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 0.00 106 G 7.97 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 0.00 107 V 7.97 4.53 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 0.78 0.00 0.00 0.93 0.00 0.00 108 L 8.14 4.34 0.00 1.63 1.59 0.96 1.01 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 0.00 109 P 0.00 4.23 0.00 2.04 2.00 0.00 3.71 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.07 0.00 110 N 8.23 4.31 0.00 2.60 2.65 0.00 0.00 7.01 7.94 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 0.00 111 I 8.27 4.48 1.87 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 1.41 0.79 0.91 0.00 0.00 112 Q 8.67 4.02 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.85 0.00 0.00 0.00 0.00 0.00 2.45 2.31 0.00 113 A 8.90 4.00 1.30 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 0.00 0.00 0.00 0.00 0.00 0.00 114 V 7.75 3.75 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 0.74 0.00 0.00 0.93 0.00 0.00 115 L 7.79 4.17 0.00 1.81 1.73 0.92 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 116 L 7.52 4.17 0.00 1.77 1.61 0.92 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.32 0.00 2.17 2.05 0.00 3.75 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 1.99 1.99 0.00 118 K 8.74 4.26 0.00 1.84 1.78 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.50 1.45 7.81 119 K 8.56 4.30 0.00 1.74 1.78 0.00 1.77 0.00 0.00 1.63 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.55 7.81 120 T 9.50 3.05 4.24 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 1.21 0.00 0.00 121 D 6.24 4.04 0.00 2.90 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 0.00 122 S 7.98 4.59 0.00 3.81 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 0.00 123 H 8.46 4.25 0.00 3.34 3.26 0.00 5.74 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.70 4.35 0.00 1.76 1.81 0.00 1.83 0.00 0.00 1.69 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.35 7.81 125 A 7.74 4.10 1.20 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 0.00 0.00 0.00 0.00 0.00 0.00