NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 P 4.6231 0.0000 0.0000 62.5327 33.0180 175.1222 3 F 4.4263 9.0576 125.0578 57.1852 40.7758 172.7662 4 I 4.5864 7.6960 127.1805 59.9178 39.0030 173.7336 5 Y 4.6460 9.2072 129.5441 55.8336 40.5988 174.1872 6 R 4.6169 7.7879 126.7782 54.7354 32.4176 174.9344 7 R 4.0901 7.7055 123.6724 54.8893 33.8860 173.2203 8 R 4.9236 7.9516 124.9982 54.2166 32.4605 175.6147 9 V 4.0468 8.7761 126.8149 63.1979 32.7389 175.2514 10 Q 4.8838 9.2290 127.0762 54.3201 30.5190 176.6058 11 F 3.8018 9.0666 123.1755 61.4282 39.4759 176.8914 12 Y 4.4144 7.9839 116.6349 59.1707 38.1472 176.4562 13 E 4.2044 7.7444 120.2860 57.8514 29.8965 176.8725 14 T 4.6532 7.3205 109.5998 60.6964 70.2284 172.6805 15 D 4.8666 8.3058 120.1603 51.3075 42.3390 176.0375 16 A 4.2354 8.5166 120.6450 54.8188 18.3049 178.4796 17 Q 3.9953 8.3328 116.2566 57.0980 29.2029 176.8687 18 G 3.9487 8.6554 105.8765 45.9501 0.0000 172.7852 19 I 4.9761 7.2107 111.7058 58.1119 41.6493 174.6398 20 V 4.0725 8.5051 123.9526 63.2894 31.8611 175.3714 21 H 4.2329 8.9278 128.8286 56.4983 30.4006 175.8131 22 H 3.9212 8.6295 121.3928 58.9089 27.7867 177.8964 23 S 4.4499 7.8188 116.1886 61.3144 62.8373 175.9394 24 N 4.2939 8.4103 119.8023 55.6173 38.1107 176.7743 25 Y 3.1497 7.7045 118.4383 60.7893 37.8080 178.6472 26 F 3.9301 7.2496 117.0198 60.2313 38.8790 178.0604 27 R 3.9243 7.5312 117.5211 59.3725 29.9856 178.2204 28 Y 4.5104 7.3617 116.5184 61.4010 37.8091 178.9526 29 F 4.4364 7.8000 118.6554 60.4167 38.9119 177.2973 30 E 3.9722 8.3118 119.0453 59.4039 29.4110 178.6240 31 E 3.8724 8.4006 118.3783 59.3911 29.4210 179.2805 32 A 3.4488 7.8291 120.5743 55.0963 18.4213 179.9051 33 R 3.7150 8.2563 116.8302 59.1904 30.0219 179.6060 34 G 3.5624 8.1056 105.5268 47.8632 0.0000 175.6977 35 E 4.0162 8.2685 121.3640 58.8539 29.0700 179.1226 36 F 2.6448 8.0085 120.9156 60.8937 39.4921 177.2585 37 L 3.6197 7.8899 118.5722 57.5714 41.3534 179.3902 38 R 3.9119 8.1207 119.0859 59.5000 29.7991 178.6840 39 S 4.1670 8.0095 113.0474 60.9862 62.9127 175.6829 40 K 4.2458 7.1792 119.1241 55.5596 31.9892 177.1283 41 G 3.9118 8.2734 107.3318 46.1783 0.0000 174.9462 42 F 5.0043 7.8880 119.5239 55.4590 39.7269 172.3145 43 P 4.5046 0.0000 0.0000 62.3998 32.4857 177.6374 44 Y 4.2745 8.7782 120.4652 61.0361 38.5743 178.5348 45 S 3.9584 8.2415 114.7150 61.5093 62.5775 176.7209 46 K 4.0126 7.8556 121.1182 59.5214 32.1452 178.7468 47 M 4.3058 8.1834 118.5017 58.6524 31.7783 178.8789 48 R 4.1793 7.7591 119.4706 58.7222 30.0248 178.4254 49 D 4.5474 7.8582 116.4340 55.9734 40.5330 177.3096 50 M 4.6468 7.8964 119.6495 54.4676 32.4197 176.5987 51 G 4.4262 7.9843 105.8219 46.4088 0.0000 173.9885 52 L 5.0294 7.2103 118.7051 52.8884 44.4684 175.2410 53 E 4.8937 8.9685 121.7746 54.5704 33.2998 174.3023 54 V 4.6790 8.9807 126.8613 61.7361 32.8204 174.9530 55 V 4.4393 8.8979 128.5781 60.9241 33.8009 174.1705 56 L 4.3993 8.5415 130.1900 55.2140 42.2474 175.9996 57 L 4.4741 9.3868 128.1243 56.8093 42.6731 176.4732 58 N 4.9969 7.7544 113.3009 52.1536 40.5047 172.9168 59 A 5.3723 8.3041 119.9844 51.0878 22.6450 174.9876 60 Y 4.9890 9.2670 120.7173 56.3460 42.8260 173.5193 61 C 4.7486 7.9245 124.6640 57.5236 35.1779 172.2067 62 E 4.3125 8.5818 126.8804 54.4217 31.7507 173.8535 63 Y 4.5758 8.5360 124.4435 56.6765 39.1367 175.0430 64 K 4.4249 9.1085 124.4045 57.4272 33.7041 177.4734 65 K 4.6309 7.6844 116.2787 53.5743 35.9982 174.2169 66 P 4.4649 0.0000 0.0000 62.7978 32.4744 175.2253 67 L 4.4754 7.8449 120.0728 53.1328 44.3101 175.7763 68 F 5.3810 9.1419 120.5714 55.1659 42.9190 174.3469 69 Y 4.3231 8.7145 120.6817 59.8535 38.6382 176.2099 70 D 4.3294 8.3600 124.8712 53.9689 41.0751 173.6654 71 D 4.5528 8.0069 118.6461 55.3238 41.9626 175.3961 72 V 4.6402 8.3117 122.6280 61.7513 33.1263 174.6499 73 F 5.2091 8.6901 121.6863 55.6469 42.2131 172.7231 74 E 5.1206 9.4361 117.6643 54.5168 33.6597 175.3661 75 V 5.0157 9.2776 123.5118 61.7385 34.1461 174.3031 76 H 5.2300 9.6143 127.0592 54.9289 29.7853 173.9949 77 L 4.9065 9.1312 127.2337 53.4774 43.9743 174.7643 78 N 5.2019 8.7290 124.1050 51.4862 42.5509 172.8507 79 L 4.3118 8.6537 128.3660 55.4312 42.1754 175.8852 80 E 4.4835 9.4054 126.3565 57.8515 31.1851 176.5256 81 E 4.7518 7.6953 116.9484 54.8275 34.4557 174.5508 82 L 5.0106 8.4121 125.1508 54.0910 45.3543 174.7947 83 S 4.8897 8.9336 122.0291 56.2892 66.1962 174.2521 84 R 3.6449 8.6528 118.6691 59.0075 29.5161 178.2851 85 F 4.8185 7.8163 113.0608 57.3260 41.3524 174.7822 86 T 5.0712 7.9103 109.5028 59.8176 72.4307 172.9267 87 F 5.3642 8.3412 115.8977 55.7140 42.0404 173.3797 88 T 4.9614 8.7340 116.2363 61.9591 71.8875 173.0213 89 F 5.3577 8.9830 125.1206 55.8055 41.7838 175.0682 90 S 5.1941 8.7296 116.5291 56.9832 66.3270 172.4866 91 Y 5.2043 8.9192 117.7365 56.5362 42.4393 174.2286 92 I 4.7610 8.7996 123.6811 59.4453 40.9585 174.4677 93 V 4.7537 8.6682 127.4298 61.5409 33.2260 174.3428 94 F 5.3241 9.4357 127.1851 55.5583 42.0527 174.5139 95 K 4.8327 8.9810 124.0644 54.4510 34.7790 175.4841 96 E 3.5562 9.1356 127.3590 58.3299 28.5002 174.9800 97 D 4.9210 8.9142 125.0477 54.9757 41.2097 175.1553 98 I 4.4451 7.8838 120.7487 59.2070 38.8786 175.0403 99 A 4.0726 8.6840 128.6443 52.1857 18.5739 176.8589 100 V 4.1958 8.6776 123.3923 64.1702 33.5678 175.2911 101 A 4.8493 7.3297 119.2808 50.9220 22.5084 175.2652 102 K 5.0620 8.5781 118.1136 54.8967 36.7621 175.5012 103 A 5.1766 9.0282 124.5186 51.3735 23.5470 174.3568 104 N 5.7783 9.1949 115.1652 52.3404 41.1977 173.8687 105 T 5.3596 9.4121 110.0939 60.0817 72.7671 172.4347 106 K 5.0103 8.8301 124.4566 55.0882 35.5630 174.5065 107 H 5.1624 8.8121 122.9507 54.2447 33.7498 171.7979 108 C 5.2976 8.7843 114.3084 55.9933 33.8918 172.2033 109 M 5.4573 8.6632 116.5807 53.7866 35.4988 175.5085 110 V 5.1051 8.8340 114.8091 59.7918 36.4739 174.6520 111 K 4.8678 9.2140 123.5500 55.9068 35.9709 175.8229 112 N 3.9601 9.6351 123.9420 54.4970 35.8769 174.9370 113 G 3.9783 8.5724 103.0177 45.9282 0.0000 174.2048 114 K 4.6776 7.6515 118.3554 53.8587 35.2826 175.6857 115 I 4.3753 8.2879 122.7701 61.5234 37.5266 175.9625 116 V 4.8494 8.3083 119.0320 59.0065 34.3277 176.0220 117 S 4.0158 8.8023 117.7970 58.4120 63.6406 174.0237 118 I 3.9046 8.3273 124.1256 60.7622 37.3071 174.5834 119 P 4.3739 0.0000 0.0000 62.6441 32.1946 177.4631 120 K 3.9936 8.8113 120.9512 59.7046 31.6759 179.4704 121 E 4.2271 8.2128 117.4182 59.3381 29.5672 179.3684 122 V 3.5188 7.7188 118.6684 65.7128 31.8033 177.5773 123 L 3.9054 8.2400 119.1702 58.1343 41.2341 179.3225 124 E 3.9773 8.0738 117.2103 59.5235 29.4954 179.3629 125 V 3.9371 7.1785 110.7721 63.2500 31.9652 178.3508 126 L 4.3486 7.6311 118.6603 57.3703 41.5685 177.1049 127 K 4.1385 7.9948 121.4727 57.1661 32.4021 176.4183 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 2 P 0.00 4.62 0.00 1.87 1.90 0.00 3.70 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 1.84 1.60 0.00 3 F 9.06 4.43 0.00 3.34 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 4 I 7.70 4.59 1.58 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.48 0.76 0.00 0.00 5 Y 9.21 4.65 0.00 3.24 3.09 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 6 R 7.79 4.62 0.00 1.59 1.47 0.00 3.16 0.00 0.00 2.97 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.37 0.00 7 R 7.71 4.09 0.00 0.98 0.66 0.00 3.00 0.00 0.00 2.90 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.01 0.00 8 R 7.95 4.92 0.00 1.70 1.67 0.00 3.23 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.70 0.00 9 V 8.78 4.05 2.30 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 0.99 0.00 0.00 1.01 0.00 0.00 10 Q 9.23 4.88 0.00 1.43 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.88 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 11 F 9.07 3.80 0.00 2.64 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 12 Y 7.98 4.41 0.00 3.12 3.16 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 13 E 7.74 4.20 0.00 2.11 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 2.20 1.50 0.00 14 T 7.32 4.65 4.08 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 1.12 0.00 0.00 15 D 8.31 4.87 0.00 2.89 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 16 A 8.52 4.24 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 17 Q 8.33 4.00 0.00 2.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.09 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00 18 G 8.66 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 19 I 7.21 4.98 1.85 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.76 1.03 0.00 0.00 20 V 8.51 4.07 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 0.59 0.00 0.00 0.94 0.00 0.00 21 H 8.93 4.23 0.00 3.23 3.26 0.00 5.65 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 H 8.63 3.92 0.00 2.64 2.67 0.00 5.52 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 23 S 7.82 4.45 0.00 4.13 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 24 N 8.41 4.29 0.00 2.64 2.25 0.00 0.00 6.88 7.08 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 25 Y 7.70 3.15 0.00 2.48 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 26 F 7.25 3.93 0.00 3.23 3.14 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 0.00 0.00 0.00 27 R 7.53 3.92 0.00 1.78 1.95 0.00 3.08 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 28 Y 7.36 4.51 0.00 2.78 3.07 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 29 F 7.80 4.44 0.00 2.94 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 0.00 0.00 0.00 30 E 8.31 3.97 0.00 2.12 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 0.00 2.33 2.37 0.00 31 E 8.40 3.87 0.00 2.18 1.77 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 2.41 2.69 0.00 32 A 7.83 3.45 1.55 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 33 R 8.26 3.72 0.00 1.98 1.90 0.00 3.25 0.00 0.00 3.47 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 1.92 0.00 34 G 8.11 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 35 E 8.27 4.02 0.00 2.25 2.40 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 2.46 2.84 0.00 36 F 8.01 2.64 0.00 2.29 2.83 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 37 L 7.89 3.62 0.00 1.68 1.87 0.92 0.63 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 38 R 8.12 3.91 0.00 1.99 2.08 0.00 3.15 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 1.66 1.67 0.00 39 S 8.01 4.17 0.00 4.17 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 40 K 7.18 4.25 0.00 1.65 1.73 0.00 1.66 0.00 0.00 1.52 0.00 0.00 3.04 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.85 1.05 7.81 41 G 8.27 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 42 F 7.89 5.00 0.00 2.88 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 43 P 0.00 4.50 0.00 2.33 2.22 0.00 3.88 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.00 0.00 44 Y 8.78 4.27 0.00 3.02 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 45 S 8.24 3.96 0.00 4.07 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 46 K 7.86 4.01 0.00 2.21 2.04 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.55 1.64 7.81 47 M 8.18 4.31 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.15 0.00 48 R 7.76 4.18 0.00 1.80 1.82 0.00 2.77 0.00 0.00 3.05 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.77 0.00 49 D 7.86 4.55 0.00 2.84 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 50 M 7.90 4.65 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.57 0.00 51 G 7.98 4.43 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 0.00 0.00 0.00 52 L 7.21 5.03 0.00 1.64 1.65 0.99 0.75 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 53 E 8.97 4.89 0.00 2.10 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 2.30 2.37 0.00 54 V 8.98 4.68 1.92 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 0.90 0.00 0.00 1.18 0.00 0.00 55 V 8.90 4.44 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 1.05 0.00 0.00 56 L 8.54 4.40 0.00 1.70 1.54 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 57 L 9.39 4.47 0.00 1.49 1.64 0.85 0.90 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 58 N 7.75 5.00 0.00 2.80 2.85 0.00 0.00 5.84 7.09 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 59 A 8.30 5.37 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 60 Y 9.27 4.99 0.00 3.12 2.83 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 61 C 7.92 4.75 0.00 2.53 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 0.00 0.00 0.00 62 E 8.58 4.31 0.00 1.99 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 2.25 0.00 63 Y 8.54 4.58 0.00 2.67 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.11 4.42 0.00 1.65 1.81 0.00 1.58 0.00 0.00 1.79 0.00 0.00 2.92 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.32 7.81 65 K 7.68 4.63 0.00 1.63 1.59 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.09 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.31 1.34 7.81 66 P 0.00 4.46 0.00 1.58 1.93 0.00 3.67 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 1.61 2.01 0.00 67 L 7.84 4.48 0.00 1.48 1.33 -0.21 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 68 F 9.14 5.38 0.00 2.93 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 69 Y 8.71 4.32 0.00 2.73 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 70 D 8.36 4.33 0.00 1.58 2.44 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 0.00 0.00 0.00 0.00 71 D 8.01 4.55 0.00 2.78 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 72 V 8.31 4.64 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 0.67 0.00 0.00 0.85 0.00 0.00 73 F 8.69 5.21 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 74 E 9.44 5.12 0.00 2.14 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 2.13 2.24 0.00 75 V 9.28 5.02 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 1.25 0.00 0.00 1.42 0.00 0.00 76 H 9.61 5.23 0.00 3.53 3.41 0.00 5.85 0.00 0.00 0.00 0.00 6.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 9.13 4.91 0.00 1.73 1.73 0.31 -0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 78 N 8.73 5.20 0.00 2.82 2.54 0.00 0.00 6.54 6.44 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 79 L 8.65 4.31 0.00 1.64 1.54 0.64 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 80 E 9.41 4.48 0.00 1.91 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 2.43 2.38 0.00 81 E 7.70 4.75 0.00 1.79 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 0.00 2.26 2.22 0.00 82 L 8.41 5.01 0.00 1.52 1.47 0.88 0.82 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 83 S 8.93 4.89 0.00 4.01 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 84 R 8.65 3.64 0.00 1.69 1.72 0.00 2.91 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.20 0.00 85 F 7.82 4.82 0.00 3.18 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 86 T 7.91 5.07 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 87 F 8.34 5.36 0.00 2.89 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 88 T 8.73 4.96 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 1.25 0.00 0.00 89 F 8.98 5.36 0.00 2.79 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 0.00 0.00 0.00 0.00 90 S 8.73 5.19 0.00 3.81 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 91 Y 8.92 5.20 0.00 2.23 2.56 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 92 I 8.80 4.76 1.75 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.83 0.20 0.00 0.00 93 V 8.67 4.75 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 0.81 0.00 0.00 1.25 0.00 0.00 94 F 9.44 5.32 0.00 2.97 3.07 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 95 K 8.98 4.83 0.00 1.81 1.65 0.00 1.88 0.00 0.00 1.62 0.00 0.00 2.80 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.36 1.44 7.81 96 E 9.14 3.56 0.00 2.17 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 2.25 2.35 0.00 97 D 8.91 4.92 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.88 4.45 2.05 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 1.29 1.14 0.94 0.00 0.00 99 A 8.68 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 V 8.68 4.20 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 1.02 0.00 0.00 0.94 0.00 0.00 101 A 7.33 4.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 K 8.58 5.06 0.00 1.65 1.63 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.82 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.23 1.26 7.81 103 A 9.03 5.18 0.85 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 0.00 104 N 9.19 5.78 0.00 3.00 2.95 0.00 0.00 6.90 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 0.00 105 T 9.41 5.36 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 1.49 0.00 0.00 106 K 8.83 5.01 0.00 1.77 1.56 0.00 1.52 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.19 1.27 7.81 107 H 8.81 5.16 0.00 1.43 2.65 0.00 5.81 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 C 8.78 5.30 0.00 3.08 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 0.00 109 M 8.66 5.46 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.75 0.00 110 V 8.83 5.11 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 0.84 0.00 0.00 1.00 0.00 0.00 111 K 9.21 4.87 0.00 1.80 1.64 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.61 7.81 112 N 9.64 3.96 0.00 2.94 2.92 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 0.00 113 G 8.57 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 0.00 114 K 7.65 4.68 0.00 1.96 1.69 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.55 7.81 115 I 8.29 4.38 1.80 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 1.42 0.46 0.81 0.00 0.00 116 V 8.31 4.85 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 0.77 0.00 0.00 1.08 0.00 0.00 117 S 8.80 4.02 0.00 3.62 3.48 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 I 8.33 3.90 1.86 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.72 0.89 0.00 0.00 119 P 0.00 4.37 0.00 2.25 2.04 0.00 3.64 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.17 0.00 120 K 8.81 3.99 0.00 1.85 1.87 0.00 1.55 0.00 0.00 1.86 0.00 0.00 3.07 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.53 1.56 7.81 121 E 8.21 4.23 0.00 2.26 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 0.00 2.53 2.79 0.00 122 V 7.72 3.52 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 0.82 0.00 0.00 0.79 0.00 0.00 123 L 8.24 3.91 0.00 1.82 1.70 0.88 0.79 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 0.00 124 E 8.07 3.98 0.00 2.23 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 2.36 2.37 0.00 125 V 7.18 3.94 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 0.89 0.00 0.00 0.89 0.00 0.00 126 L 7.63 4.35 0.00 1.52 1.57 0.19 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 127 K 7.99 4.14 0.00 1.86 1.80 0.00 1.56 0.00 0.00 1.76 0.00 0.00 3.10 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.76 7.81