NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 4.1776 7.9133 120.6601 62.8608 33.3617 173.9341 2 Q 5.1620 8.5309 125.0410 53.8123 32.7102 172.6634 3 A 5.3617 8.9354 123.4359 50.9385 23.9959 174.8676 4 V 5.1886 8.8174 116.8625 60.7189 35.3345 172.9106 5 A 5.1680 9.4256 124.5128 49.1535 22.2712 175.0036 6 V 4.5814 8.4010 122.5433 61.2685 33.4469 174.5993 7 L 4.6595 8.8419 129.8962 54.3884 42.7999 176.5036 8 K 4.8910 8.8906 122.5128 55.0523 37.0497 175.6231 9 G 4.4676 7.9467 107.2145 47.1941 0.0000 173.0100 10 D 4.8986 8.9102 117.3936 54.1429 41.0521 176.8919 11 A 4.4991 8.1176 120.3148 51.8053 19.4683 178.6086 12 G 3.9424 8.3106 106.6541 45.7234 0.0000 173.2723 13 V 4.8841 7.2586 119.5260 61.6383 33.0462 174.8605 14 S 4.7451 8.0089 120.3442 57.4870 66.9606 173.8760 15 G 3.9372 7.7472 105.8128 46.7503 0.0000 171.4457 16 V 5.0629 8.1295 118.6712 61.1409 35.3896 174.9082 17 V 4.8673 9.1343 127.3654 61.1275 34.2276 174.2010 18 K 5.1260 9.0602 127.3818 54.7336 35.1456 175.2882 19 F 5.2647 9.2777 121.4918 55.8410 43.3700 173.7777 20 E 5.1508 9.0830 122.7589 54.9198 33.2174 173.6766 21 Q 4.7259 8.9835 127.4846 54.6872 31.6078 174.5091 22 A 4.1655 9.0522 130.1564 54.7647 19.0340 177.1938 23 S 4.6947 7.6010 108.2338 56.3709 66.2379 174.1766 24 E 3.9156 9.0651 122.4901 59.5988 29.1313 178.4765 25 S 4.3602 7.9592 110.3950 59.7443 63.7588 174.0403 26 E 4.3994 7.7818 120.7368 54.8306 30.2466 174.4791 27 P 4.6804 0.0000 0.0000 63.2244 31.9767 175.9102 28 T 4.6839 9.1811 119.7612 62.7086 70.7362 173.9483 29 T 4.7394 9.1307 123.6518 62.5182 70.2222 173.7862 30 V 4.4851 8.4206 127.6995 60.8401 33.7132 174.5244 31 S 5.1647 8.6844 122.5174 56.7682 66.3721 172.5455 32 Y 5.3232 8.1900 119.0410 55.9918 42.0424 173.7896 33 E 5.0716 9.1230 119.7261 55.1873 33.9349 174.5254 34 I 5.0543 9.3159 125.4695 59.4903 41.4612 174.7217 35 A 4.8250 9.2888 128.3911 50.8941 22.3220 177.2500 36 G 4.2055 8.7938 105.4221 46.8116 0.0000 173.6690 37 N 4.7214 7.8243 117.8265 51.7654 39.6723 174.7571 38 S 4.3271 8.2898 115.7323 58.1347 63.4028 172.9681 39 P 4.6026 0.0000 0.0000 63.1417 32.2439 175.2748 40 N 4.2031 9.1387 114.3492 53.3064 36.6168 172.3680 41 A 4.8449 8.2627 118.6759 50.6291 23.6834 175.6709 42 E 5.1108 8.6542 115.6138 54.8849 33.2634 175.6951 43 R 4.9801 8.9868 123.1770 53.8092 34.0618 175.3567 44 G 4.0672 9.0537 111.3755 46.9278 0.0000 172.2912 45 F 5.5390 8.9845 125.4573 57.0403 42.7323 173.0290 46 H 5.2525 8.9239 121.9932 54.7759 34.2217 172.2117 47 I 4.7433 8.6302 121.1063 60.5469 38.8558 175.3296 48 H 5.0748 9.1808 124.6637 54.1587 30.7595 175.6909 49 E 3.6072 8.9091 122.7250 58.8554 29.7911 177.1964 50 F 4.9847 8.3507 117.6670 54.8636 42.0209 176.8106 51 G 4.6336 8.3146 111.0382 43.9907 0.0000 174.1707 52 D 4.7014 7.9580 117.4056 52.6423 42.4519 174.8428 53 A 4.7384 8.4195 129.3424 52.1540 19.3608 177.5768 54 T 4.0565 8.3459 111.7485 65.2342 69.5223 174.4778 55 N 4.9174 8.2391 121.1191 52.4848 39.6516 174.8542 56 G 3.7502 7.6521 115.9945 47.0145 0.0000 173.4148 57 C 4.6789 8.5560 121.1077 56.8176 39.1050 175.5642 58 V 3.6244 7.8762 120.8784 65.8865 30.9574 177.5448 59 S 4.3793 7.9836 110.5227 59.9002 63.1456 175.3416 60 A 4.5959 7.3082 125.7847 54.5767 18.2781 178.4609 61 G 3.9415 8.3557 105.5604 44.3757 0.0000 170.7644 62 P 4.6974 0.0000 0.0000 61.9147 33.8027 175.2012 63 H 4.4718 8.4031 116.6963 55.6406 29.5183 175.6388 64 F 4.2602 9.0708 125.7631 58.0855 40.2710 175.0862 65 N 5.0503 7.8470 125.4591 51.5461 39.0358 172.8944 66 P 3.9746 0.0000 0.0000 65.1075 31.9183 178.0219 67 F 4.7144 7.3549 115.0283 56.6092 39.6031 175.2301 68 K 3.7440 7.5721 119.3241 57.5604 29.6352 174.2994 69 K 4.5454 8.4269 117.1825 54.7651 34.9100 176.7163 70 T 4.3910 7.9018 110.0674 61.1155 70.5019 173.5320 71 H 4.1029 8.7865 123.3199 56.6652 31.0180 174.6801 72 G 4.3524 8.0117 110.3268 44.7436 0.0000 171.8749 73 A 4.4480 8.9520 122.3992 50.6694 19.3870 177.0870 74 P 4.1993 0.0000 0.0000 65.8119 31.4053 177.9233 75 T 4.2452 7.6810 104.9741 62.0804 69.3349 174.4508 76 D 4.6173 7.7791 123.0089 54.0759 41.6420 176.5228 77 E 3.9335 8.7366 122.3696 58.9092 29.7304 177.3100 78 V 3.9986 7.5059 119.2887 61.8949 30.9539 174.5244 79 R 4.8561 7.7159 121.4112 56.2405 32.0643 174.1498 80 H 4.6090 8.9373 115.9469 54.9765 29.5587 177.0212 81 V 3.5646 8.4138 122.7229 66.4503 31.3484 177.2243 82 G 3.9329 8.2034 104.6274 47.1775 0.0000 173.1300 83 D 4.8688 8.0694 121.3715 54.6083 40.8634 175.8206 84 M 4.3353 8.4909 122.6263 53.7707 32.9074 178.5782 85 G 3.6450 8.2013 107.9897 47.0821 0.0000 173.2060 86 N 5.5009 8.6288 120.6925 51.4745 41.4602 174.2241 87 V 4.3514 8.4562 115.4140 59.4991 34.2476 175.2290 88 K 4.8508 8.6279 124.3115 56.1245 33.2152 175.8200 89 T 4.8471 8.8716 115.1003 60.1859 71.7848 174.6237 90 D 5.0287 8.7313 123.8093 52.2168 41.8326 176.5283 91 E 4.1798 8.6194 115.1759 58.5018 29.6340 176.9886 92 N 4.6428 8.3979 115.3538 52.7529 39.2676 175.3571 93 G 4.0290 8.0184 106.0056 46.5115 0.0000 172.6656 94 V 4.7300 8.2612 119.9486 61.1141 33.5987 174.4826 95 A 5.2624 8.9782 129.4063 49.1977 21.4236 175.0779 96 K 4.6307 8.4860 123.1810 54.4338 35.7113 175.7878 97 G 3.8082 6.9382 111.7539 47.3262 0.0000 171.2258 98 S 5.2441 8.4229 112.1512 57.8850 65.5877 173.8005 99 F 5.0133 8.5968 115.7238 56.2179 41.5506 172.6628 100 K 5.1627 8.8187 118.4730 54.9559 34.4413 175.5552 101 D 4.9545 9.2375 122.6488 53.1595 44.6515 175.9065 102 S 4.7146 9.0631 119.8247 58.8374 63.8366 174.8100 103 L 4.4564 8.1232 119.6380 56.2147 42.4935 177.2908 104 I 4.1460 8.1105 119.7408 60.9319 37.7152 175.5146 105 K 4.7977 8.3300 122.3826 53.9426 35.9751 176.5953 106 L 4.6609 8.4995 119.3070 54.5370 42.4897 176.5759 107 I 4.4976 7.4053 118.7656 60.5858 41.0304 175.5426 108 G 3.9583 8.6603 109.8051 43.8531 0.0000 172.2095 109 P 4.3325 0.0000 0.0000 65.1413 31.1571 177.1676 110 T 4.6153 7.7619 107.3228 61.0829 69.0247 174.3091 111 S 4.2945 7.7847 116.4858 59.7316 62.7871 174.6027 112 V 3.6817 8.3909 118.8492 60.9748 31.8188 176.2538 113 V 3.6287 7.2287 121.6724 64.1750 31.8779 176.2336 114 G 3.9236 9.4676 116.0928 45.1396 0.0000 172.9219 115 R 5.0132 7.5237 119.8965 55.0494 33.5106 175.2641 116 S 5.1411 8.2440 114.4034 57.7474 67.8731 173.2562 117 V 4.7632 8.7032 121.9796 61.2075 34.0657 174.5868 118 V 4.8042 8.8465 127.1631 61.0526 34.5004 173.6248 119 I 5.0420 8.4480 127.8934 59.8272 39.9057 174.4967 120 H 5.3026 9.2587 126.7583 54.8457 30.1176 175.1996 121 A 4.3293 8.9330 121.3204 53.0537 19.3305 177.0324 122 G 4.2430 8.0236 101.7989 43.8563 0.0000 172.0921 123 Q 4.8292 8.3749 119.5890 54.5633 29.8612 173.9358 124 D 4.8458 9.2914 125.4935 53.5544 41.9848 175.8064 125 D 4.5647 9.3587 125.6121 53.1935 39.7643 176.7981 126 L 3.5424 9.7043 119.5238 56.1050 39.6269 175.9095 127 G 4.2836 8.4714 103.9550 46.6290 0.0000 174.8855 128 K 4.3770 8.0398 116.8431 55.8002 32.2640 176.8425 129 G 3.9657 8.1892 109.9578 44.2325 0.0000 173.8999 130 D 4.7583 8.5013 116.3403 54.2464 41.1523 175.3147 131 T 4.7731 7.4155 107.6973 58.9525 71.7222 174.8258 132 E 4.0056 8.5964 121.3572 59.4377 29.3469 179.2125 133 E 3.9142 8.1186 119.1058 59.1040 29.7238 178.5481 134 S 4.0726 7.8187 112.9514 61.2014 62.4052 175.4224 135 L 4.3686 7.7394 119.3430 55.4515 41.1984 177.9168 136 K 4.2926 7.6735 117.2233 57.6117 33.9245 176.8634 137 T 4.0404 7.8083 106.2338 60.1320 70.2498 175.3494 138 G 3.8464 8.1613 110.1820 45.4122 0.0000 173.4017 139 N 4.2267 7.9409 114.7004 54.0055 36.9120 176.0019 140 A 4.1649 7.0243 119.3407 52.2792 19.2969 180.0157 141 G 4.0539 7.3071 104.0139 44.3017 0.0000 171.6070 142 P 4.3706 0.0000 0.0000 63.4176 32.8451 175.8651 143 R 4.9783 8.2460 120.5360 53.4163 29.5067 173.7331 144 P 4.5058 0.0000 0.0000 65.3100 32.8574 176.3978 145 A 5.2561 7.7743 120.1011 50.9800 23.1700 172.6351 146 C 5.1881 9.0430 112.9220 55.2117 45.5650 172.9481 147 G 4.8103 8.4788 104.9789 45.6684 0.0000 172.7895 148 V 4.3113 8.3591 123.1443 62.4985 33.3444 174.9612 149 I 4.1501 8.9637 129.4726 60.9839 37.9430 175.2655 150 G 4.4213 9.0089 114.8522 43.9173 0.0000 171.7231 151 L 4.5168 8.3349 123.2430 55.3165 42.9456 176.1038 152 T 4.7072 8.5417 119.6882 61.3569 70.6529 173.3029 153 N 4.5444 8.5434 117.5269 53.5545 37.2775 173.9204 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 V 7.91 4.18 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 0.95 0.00 0.00 0.94 0.00 0.00 2 Q 8.53 5.16 0.00 2.10 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.60 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 3 A 8.94 5.36 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 4 V 8.82 5.19 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 0.79 0.00 0.00 1.07 0.00 0.00 5 A 9.43 5.17 1.42 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 0.00 0.00 6 V 8.40 4.58 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 1.01 0.00 0.00 0.96 0.00 0.00 7 L 8.84 4.66 0.00 1.76 1.63 1.07 0.54 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 8 K 8.89 4.89 0.00 1.67 1.64 0.00 1.72 0.00 0.00 1.66 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.39 7.81 9 G 7.95 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 0.00 0.00 0.00 0.00 10 D 8.91 4.90 0.00 2.66 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 11 A 8.12 4.50 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 12 G 8.31 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 13 V 7.26 4.88 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 0.96 0.00 0.00 0.99 0.00 0.00 14 S 8.01 4.75 0.00 4.04 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 15 G 7.75 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 16 V 8.13 5.06 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 0.96 0.00 0.00 0.95 0.00 0.00 17 V 9.13 4.87 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 0.77 0.00 0.00 1.24 0.00 0.00 18 K 9.06 5.13 0.00 1.59 1.64 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.37 7.81 19 F 9.28 5.26 0.00 2.93 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 20 E 9.08 5.15 0.00 2.03 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 0.00 2.21 2.44 0.00 21 Q 8.98 4.73 0.00 2.09 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.38 2.50 0.00 22 A 9.05 4.17 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 23 S 7.60 4.69 0.00 3.97 3.92 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 24 E 9.07 3.92 0.00 1.96 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 0.00 2.33 2.50 0.00 25 S 7.96 4.36 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 26 E 7.78 4.40 0.00 2.19 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 2.34 2.43 0.00 27 P 0.00 4.68 0.00 1.97 2.04 0.00 3.69 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 2.06 2.15 0.00 28 T 9.18 4.68 4.41 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 29 T 9.13 4.74 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 1.13 0.00 0.00 30 V 8.42 4.49 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 0.00 0.00 0.73 0.00 0.00 0.80 0.00 0.00 31 S 8.68 5.16 0.00 3.71 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 32 Y 8.19 5.32 0.00 2.92 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 33 E 9.12 5.07 0.00 1.90 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 2.14 2.19 0.00 34 I 9.32 5.05 1.86 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 1.20 0.88 0.97 0.00 0.00 35 A 9.29 4.82 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 36 G 8.79 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 0.00 0.00 0.00 0.00 37 N 7.82 4.72 0.00 2.91 2.75 0.00 0.00 7.01 7.52 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 38 S 8.29 4.33 0.00 3.86 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 39 P 0.00 4.60 0.00 2.18 2.11 0.00 3.92 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 1.98 1.98 0.00 40 N 9.14 4.20 0.00 2.87 2.87 0.00 0.00 6.53 7.12 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 41 A 8.26 4.84 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 42 E 8.65 5.11 0.00 1.88 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 2.27 2.30 0.00 43 R 8.99 4.98 0.00 1.62 1.94 0.00 3.49 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.68 0.00 44 G 9.05 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 F 8.98 5.54 0.00 2.81 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 46 H 8.92 5.25 0.00 3.08 3.16 0.00 5.85 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.63 4.74 1.94 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.79 0.89 0.00 0.00 48 H 9.18 5.07 0.00 3.04 3.45 0.00 5.65 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 49 E 8.91 3.61 0.00 1.64 1.12 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 1.47 1.95 0.00 50 F 8.35 4.98 0.00 3.16 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 51 G 8.31 4.63 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 0.00 0.00 0.00 52 D 7.96 4.70 0.00 2.62 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 53 A 8.42 4.74 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 54 T 8.35 4.06 4.22 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 1.24 0.00 0.00 55 N 8.24 4.92 0.00 2.73 2.68 0.00 0.00 7.01 7.69 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 56 G 7.65 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 57 C 8.56 4.68 0.00 2.98 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 58 V 7.88 3.62 2.25 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 1.07 0.00 0.00 0.95 0.00 0.00 59 S 7.98 4.38 0.00 4.17 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 60 A 7.31 4.60 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 61 G 8.36 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 62 P 0.00 4.70 0.00 2.05 2.20 0.00 3.68 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.98 0.00 63 H 8.40 4.47 0.00 2.83 3.19 0.00 5.72 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 64 F 9.07 4.26 0.00 2.92 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 65 N 7.85 5.05 0.00 2.51 2.39 0.00 0.00 6.93 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 66 P 0.00 3.97 0.00 1.44 1.65 0.00 2.74 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.77 0.00 67 F 7.35 4.71 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 68 K 7.57 3.74 0.00 1.94 1.86 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.38 7.81 69 K 8.43 4.55 0.00 1.89 1.74 0.00 1.72 0.00 0.00 1.78 0.00 0.00 3.06 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.55 7.81 70 T 7.90 4.39 4.22 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 1.21 0.00 0.00 71 H 8.79 4.10 0.00 3.35 3.27 0.00 5.78 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 72 G 8.01 4.35 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 0.00 73 A 8.95 4.45 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 74 P 0.00 4.20 0.00 1.95 2.03 0.00 3.61 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 1.86 2.13 0.00 75 T 7.68 4.25 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 1.20 0.00 0.00 76 D 7.78 4.62 0.00 2.83 2.72 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 0.00 0.00 0.00 0.00 77 E 8.74 3.93 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 2.30 2.28 0.00 78 V 7.51 4.00 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 0.81 0.00 0.00 0.91 0.00 0.00 79 R 7.72 4.86 0.00 1.99 1.89 0.00 2.88 0.00 0.00 3.43 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.60 0.00 80 H 8.94 4.61 0.00 3.52 3.39 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.41 3.56 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 0.85 0.00 0.00 0.68 0.00 0.00 82 G 8.20 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 0.00 0.00 0.00 0.00 83 D 8.07 4.87 0.00 2.68 2.72 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 0.00 0.00 0.00 0.00 84 M 8.49 4.34 0.00 2.03 2.06 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.64 0.00 85 G 8.20 3.65 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 0.00 0.00 0.00 86 N 8.63 5.50 0.00 2.57 2.69 0.00 0.00 6.61 7.68 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 87 V 8.46 4.35 1.75 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 -0.54 0.00 0.00 0.62 0.00 0.00 88 K 8.63 4.85 0.00 1.74 1.73 0.00 1.65 0.00 0.00 1.88 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.51 1.44 7.81 89 T 8.87 4.85 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 1.20 0.00 0.00 90 D 8.73 5.03 0.00 2.87 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 91 E 8.62 4.18 0.00 2.09 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 2.27 2.23 0.00 92 N 8.40 4.64 0.00 2.85 2.87 0.00 0.00 7.00 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 93 G 8.02 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 94 V 8.26 4.73 2.39 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 0.87 0.00 0.00 0.93 0.00 0.00 95 A 8.98 5.26 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 96 K 8.49 4.63 0.00 1.64 1.54 0.00 1.82 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.13 1.27 7.81 97 G 6.94 3.81 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 0.00 0.00 0.00 98 S 8.42 5.24 0.00 3.78 3.64 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 99 F 8.60 5.01 0.00 3.19 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 0.00 100 K 8.82 5.16 0.00 1.73 1.82 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.69 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.45 7.81 101 D 9.24 4.95 0.00 3.11 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 0.00 102 S 9.06 4.71 0.00 3.94 3.92 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 0.00 103 L 8.12 4.46 0.00 1.86 1.80 0.98 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 104 I 8.11 4.15 2.04 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.69 1.06 0.00 0.00 105 K 8.33 4.80 0.00 1.80 1.77 0.00 1.98 0.00 0.00 1.94 0.00 0.00 2.96 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.60 1.68 7.81 106 L 8.50 4.66 0.00 1.60 1.63 1.01 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 107 I 7.41 4.50 1.89 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 1.35 0.60 0.98 0.00 0.00 108 G 8.66 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 0.00 109 P 0.00 4.33 0.00 2.24 2.24 0.00 3.93 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 2.06 2.01 0.00 110 T 7.76 4.62 4.32 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 1.22 0.00 0.00 111 S 7.78 4.29 0.00 3.92 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 0.00 112 V 8.39 3.68 1.75 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 0.62 0.00 0.00 0.53 0.00 0.00 113 V 7.23 3.63 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 0.67 0.00 0.00 0.83 0.00 0.00 114 G 9.47 3.92 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 0.00 0.00 0.00 115 R 7.52 5.01 0.00 1.56 1.80 0.00 2.21 0.00 0.00 2.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.33 0.00 116 S 8.24 5.14 0.00 3.75 3.68 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 0.00 117 V 8.70 4.76 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 0.91 0.00 0.00 1.15 0.00 0.00 118 V 8.85 4.80 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 0.65 0.00 0.00 0.70 0.00 0.00 119 I 8.45 5.04 2.01 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 1.22 1.18 1.02 0.00 0.00 120 H 9.26 5.30 0.00 3.20 3.45 0.00 5.70 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 8.93 4.33 1.28 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 0.00 0.00 0.00 122 G 8.02 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 0.00 0.00 0.00 0.00 123 Q 8.37 4.83 0.00 2.18 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.31 6.99 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 124 D 9.29 4.85 0.00 2.69 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 0.00 125 D 9.36 4.56 0.00 2.90 2.89 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 0.00 126 L 9.70 3.54 0.00 1.85 1.76 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.47 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 0.00 0.00 0.00 0.00 128 K 8.04 4.38 0.00 1.92 1.82 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.35 7.81 129 G 8.19 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 0.00 0.00 0.00 130 D 8.50 4.76 0.00 2.65 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 0.00 131 T 7.42 4.77 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 1.21 0.00 0.00 132 E 8.60 4.01 0.00 2.07 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 2.40 2.42 0.00 133 E 8.12 3.91 0.00 2.06 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 2.41 2.45 0.00 134 S 7.82 4.07 0.00 3.94 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 0.00 135 L 7.74 4.37 0.00 1.86 1.67 0.92 1.01 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 0.00 136 K 7.67 4.29 0.00 1.77 1.77 0.00 1.66 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.33 1.68 7.81 137 T 7.81 4.04 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 1.16 0.00 0.00 138 G 8.16 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 0.00 139 N 7.94 4.23 0.00 2.94 2.88 0.00 0.00 6.91 7.11 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 0.00 140 A 7.02 4.16 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 0.00 141 G 7.31 4.05 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 0.00 0.00 0.00 142 P 0.00 4.37 0.00 2.11 2.03 0.00 3.58 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 2.14 2.16 0.00 143 R 8.25 4.98 0.00 1.62 1.76 0.00 3.22 0.00 0.00 3.25 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.60 0.00 144 P 0.00 4.51 0.00 2.12 2.32 0.00 3.90 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 2.20 1.99 0.00 145 A 7.77 5.26 1.28 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 0.00 0.00 0.00 146 C 9.04 5.19 0.00 3.06 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 0.00 147 G 8.48 4.81 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 0.00 0.00 0.00 148 V 8.36 4.31 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 1.01 0.00 0.00 0.98 0.00 0.00 149 I 8.96 4.15 1.82 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.41 0.53 0.00 0.00 150 G 9.01 4.42 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 0.00 0.00 0.00 151 L 8.33 4.52 0.00 1.65 1.56 0.92 0.87 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 0.00 152 T 8.54 4.71 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 1.28 0.00 0.00 153 N 8.54 4.54 0.00 2.82 2.70 0.00 0.00 5.73 7.56 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