NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 V 4.0664 8.0549 120.3968 62.4968 32.7717 176.8205 13 K 4.1715 8.3205 126.5837 54.7560 30.1128 172.6071 14 V 3.6351 8.8410 124.4532 65.4113 32.1823 174.8793 15 P 4.3431 0.0000 0.0000 65.7156 31.2048 178.4743 16 R 4.0141 8.0384 116.6763 59.4638 30.1269 177.7408 17 N 4.4119 8.4266 116.8265 56.8906 39.0566 176.5413 18 F 4.4025 9.0054 122.3232 61.2444 39.4129 176.9304 19 R 3.9593 8.4176 118.5247 59.6556 29.9501 178.6206 20 L 4.1238 8.3227 118.6281 57.6870 41.0599 179.5081 21 L 4.1689 8.1833 119.3192 57.7214 41.4637 179.4098 22 E 3.8926 8.0357 118.5815 59.4723 29.4402 179.1451 23 E 4.2039 8.4377 118.7227 59.2878 29.1999 179.1648 24 L 4.4136 8.2136 119.8199 58.4412 42.5168 178.4289 25 E 4.3435 7.8119 119.5032 58.4632 29.5529 178.3448 26 E 4.0161 8.5794 119.4402 59.3966 29.3689 179.4630 27 G 2.5388 7.0473 105.1968 45.5751 0.0000 174.7450 28 Q 4.2601 7.6357 118.8964 55.8731 28.8830 176.2218 29 K 4.1472 7.7068 116.8144 58.2442 34.4961 178.2852 30 G 3.7988 8.3633 104.7785 45.8246 0.0000 174.4992 31 V 3.8281 7.5332 118.9064 64.0841 32.9683 172.1468 32 G 4.1870 8.4780 119.4711 44.2689 0.0000 173.1543 33 D 4.3571 9.1095 124.9817 56.9703 41.0714 176.1560 34 G 4.2151 8.4534 105.6367 46.0202 0.0000 174.8259 35 T 4.1434 7.7408 109.2981 64.0549 69.3526 176.2563 36 V 3.8188 7.8824 114.9365 61.8519 32.1143 175.4919 37 S 4.9608 8.9453 120.2767 56.7051 67.3364 173.2378 38 W 5.5923 7.9763 119.8631 56.0019 32.1803 172.9517 39 G 4.5429 8.9031 105.8828 45.7508 0.0000 172.4791 40 L 3.6313 8.2400 120.0707 54.6528 41.5654 177.5601 41 E 4.2075 8.4696 125.3632 58.9633 29.4608 177.6643 42 D 4.2554 7.9588 117.2922 55.4275 41.8007 175.9197 43 D 4.8660 8.1385 121.7360 54.9530 40.8403 174.7560 44 E 3.9727 7.9835 115.9292 59.0876 29.7430 176.8043 45 D 4.2850 8.1423 119.0492 54.9389 40.3602 175.3378 46 M 4.4335 8.5898 125.9641 55.6950 32.1060 178.3602 47 T 4.0253 7.8630 110.7628 62.6067 69.1094 174.5249 48 L 3.4929 6.9652 117.5285 56.1567 39.9901 175.6774 49 T 4.5037 7.9268 116.2692 65.0751 70.5855 175.2055 50 R 5.0998 7.8086 120.6963 54.2261 32.5460 175.6020 51 W 5.1695 9.3985 123.7642 55.0749 33.5586 174.9205 52 T 4.6609 9.5045 119.3661 62.1401 70.4118 173.2806 53 G 4.4247 9.1304 115.1974 44.5988 0.0000 171.0632 54 M 5.2257 9.3773 125.1242 53.7400 35.1603 174.1547 55 I 4.7158 8.9326 127.8317 59.4302 39.8254 174.6956 56 I 4.5632 8.5326 121.8754 59.7812 38.6836 176.0561 57 G 4.6040 9.8248 115.7925 45.1012 0.0000 170.9982 58 P 4.6931 0.0000 0.0000 61.9911 32.6685 174.3571 59 P 4.4438 0.0000 0.0000 63.3038 32.3062 176.0692 60 R 3.9393 9.7249 118.6367 57.2339 28.1556 176.0217 61 T 4.7487 7.3322 107.5407 60.0207 71.9310 173.6907 62 N 4.4708 8.0434 117.0164 54.9087 38.5150 175.7001 63 Y 4.7684 7.7950 115.6772 57.2427 38.9281 174.7884 64 E 4.3007 7.8034 121.6824 57.1402 29.7579 177.7518 65 N 4.5326 8.6835 123.6395 53.9250 39.7017 174.4525 66 R 4.0369 7.6376 116.7527 56.7978 31.4884 175.7511 67 I 4.5962 8.0533 123.3072 60.0140 39.0970 174.4366 68 Y 4.8787 8.8807 126.2711 56.2688 40.1466 175.1174 69 S 5.1491 9.0847 119.8579 57.1113 65.2450 173.2710 70 L 5.0195 9.3775 123.3363 52.7039 45.8950 175.6146 71 K 4.8775 9.0229 121.8661 54.8867 34.5583 175.1848 72 V 4.7541 8.4569 125.8582 61.0233 34.0217 174.1248 73 E 5.6658 9.2044 127.4451 54.0657 32.2977 174.7088 74 C 4.5082 8.6797 123.1851 58.0236 29.6312 174.4914 75 G 3.9380 8.2539 114.6991 44.2725 0.0000 171.2553 76 P 4.4961 0.0000 0.0000 64.3950 31.5615 177.4347 77 K 4.3133 7.9288 116.8971 56.8438 32.9899 176.0638 78 Y 4.4295 7.8988 121.4775 57.1161 39.4202 173.7360 79 P 3.6872 0.0000 0.0000 62.3802 31.7550 177.3554 80 E 3.9697 8.3170 120.4019 58.9964 29.6241 176.9683 81 A 4.8277 7.7664 119.9934 49.3219 21.3298 174.6194 82 P 2.9700 0.0000 0.0000 61.2641 31.8691 175.0648 83 P 4.4729 0.0000 0.0000 62.2676 33.5428 174.8605 84 S 4.6331 8.8299 116.1261 57.0915 64.5848 173.9365 85 V 4.9077 8.2346 124.3094 60.9458 34.5072 174.2478 86 R 5.0611 8.5691 122.9616 54.6620 33.0807 174.2132 87 F 4.6394 9.3701 120.7059 57.4663 39.9780 175.8566 88 V 4.2340 9.3035 123.0154 65.7290 32.6670 176.1656 89 T 4.7002 8.1528 115.6876 62.8075 69.3724 174.7468 90 K 3.1441 8.6754 126.2569 56.3709 32.4791 176.6173 91 I 4.7640 8.7110 124.6394 59.6753 41.0533 175.0322 92 N 4.7584 9.5604 126.4368 51.6490 37.4740 173.3162 93 M 4.7688 7.5843 120.6575 52.6526 35.5341 174.0390 94 N 4.4510 9.3825 124.3502 56.6516 39.1573 174.4404 95 G 4.0184 8.7874 113.4813 45.3799 0.0000 172.4481 96 I 4.6888 7.3411 120.8776 59.1049 39.3090 175.0578 97 N 4.4725 8.6343 124.2178 53.3555 39.2893 175.4816 98 N 4.7547 8.7189 121.8171 54.6218 38.0916 175.6976 99 S 4.6473 8.5178 115.1165 60.4782 64.1676 175.7102 100 S 4.1048 8.1885 113.8582 59.2899 63.5297 175.3938 101 G 2.9705 7.7476 107.6353 43.2031 0.0000 172.2492 102 M 4.4188 7.2673 118.9162 55.2225 33.5464 175.1915 103 V 4.4199 8.3372 125.2441 62.0153 33.1946 174.9334 104 D 4.5727 9.3634 128.2330 53.2610 41.5176 176.7003 105 A 4.0194 8.8165 130.3785 55.2615 18.6583 179.2550 106 R 3.9575 7.4945 114.8910 58.8977 30.1753 177.2319 107 S 4.5964 7.9528 111.6966 58.2971 63.4186 174.1418 108 I 4.4399 7.5827 123.0226 58.4258 39.4028 173.8735 109 P 4.2613 0.0000 0.0000 66.1546 31.2173 178.9915 110 V 3.6687 7.7417 109.4940 63.3732 31.2211 178.0032 111 L 4.4964 7.7141 117.2903 56.5777 42.2971 178.3010 112 A 4.1837 8.6458 120.2587 54.3748 19.7300 178.7048 113 K 4.5515 7.6511 115.3379 55.0466 31.5204 176.8863 114 W 4.9236 7.8914 128.1061 56.9620 32.0692 174.8766 115 Q 4.4653 7.2704 123.1737 53.4852 31.4181 176.1775 116 N 5.1018 8.5910 116.9095 54.3998 37.4577 175.9559 117 S 4.0948 7.2240 112.4282 59.4677 63.6709 173.6674 118 Y 4.4666 6.6952 119.7950 57.7152 39.0290 174.0472 119 S 5.2498 7.6543 115.6350 57.8521 66.6544 175.4052 120 I 3.5651 9.0256 122.7050 64.1215 36.6193 178.5157 121 K 2.6619 7.9755 120.6128 59.2318 31.8349 179.0044 122 V 3.4303 6.9944 118.4396 65.7119 31.3203 178.1108 123 V 3.4639 7.4654 117.6319 66.0335 31.3862 177.9714 124 L 3.8139 7.6973 118.6927 57.9582 41.4120 179.6664 125 Q 3.9686 7.7999 117.7017 58.6568 28.5839 178.3756 126 E 3.8412 8.4066 120.8384 59.2217 29.7025 178.8286 127 L 3.9544 8.0821 119.3431 57.8630 41.4616 179.5347 128 R 3.8331 7.7366 117.5711 59.3106 30.3369 178.2381 129 R 4.0125 7.9215 118.6502 59.4069 30.0874 178.5655 130 L 4.0578 8.0950 118.7281 57.8280 41.3182 179.3452 131 M 3.9758 7.7033 118.1378 57.8194 31.8350 177.5419 132 M 4.4494 7.3678 115.9290 54.4415 32.9162 176.3993 133 S 4.3546 7.3396 115.3070 57.4192 63.3343 174.7001 134 K 3.8292 8.7353 126.7246 59.4528 31.8884 177.2183 135 E 4.4842 8.0777 113.6306 56.4080 30.0238 176.3031 136 N 4.9418 7.8040 115.9649 54.7916 41.7220 176.3014 137 M 4.4799 9.0310 115.5788 57.2200 31.4777 176.9012 138 K 5.1455 7.8204 118.9758 55.9752 33.2163 175.5403 139 L 4.5880 7.2732 118.4718 51.9894 43.4305 175.0997 140 P 4.1683 0.0000 0.0000 63.1558 31.4497 175.7129 141 Q 4.5042 8.2874 122.8360 53.4366 30.1977 174.0976 142 P 4.4650 0.0000 0.0000 61.3787 32.2812 174.1800 143 P 4.0956 0.0000 0.0000 62.9069 31.5423 175.7148 144 E 3.8901 8.6245 124.3756 57.2783 29.9528 176.5048 145 G 4.0617 8.8924 113.3634 45.5083 0.0000 173.7139 146 Q 4.2199 7.8850 120.3749 55.4630 29.5151 175.2348 147 T 4.9552 7.9575 111.3391 59.7558 71.5540 173.9958 148 Y 4.1919 8.6190 120.6907 60.2866 38.0283 175.8507 149 N 5.0361 7.8470 114.3917 51.3783 42.1349 174.0691 150 N 4.5457 8.7142 115.3852 54.1282 38.7939 174.5871 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 12 V 8.05 4.07 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 1.03 0.00 0.00 0.95 0.00 0.00 13 K 8.32 4.17 0.00 1.96 1.83 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.57 1.55 7.81 14 V 8.84 3.64 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 1.05 0.00 0.00 1.01 0.00 0.00 15 P 0.00 4.34 0.00 2.25 2.15 0.00 3.64 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 16 R 8.04 4.01 0.00 2.18 2.20 0.00 3.33 0.00 0.00 3.39 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.04 0.00 17 N 8.43 4.41 0.00 3.12 2.94 0.00 0.00 7.02 7.30 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 18 F 9.01 4.40 0.00 3.15 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 19 R 8.42 3.96 0.00 2.12 2.25 0.00 3.20 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.83 0.00 20 L 8.32 4.12 0.00 2.14 2.23 1.25 0.40 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 21 L 8.18 4.17 0.00 1.91 1.77 1.13 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 22 E 8.04 3.89 0.00 2.07 1.88 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 1.86 1.74 0.00 23 E 8.44 4.20 0.00 1.96 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 2.36 2.48 0.00 24 L 8.21 4.41 0.00 2.14 2.10 0.81 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 25 E 7.81 4.34 0.00 2.11 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 2.27 2.18 0.00 26 E 8.58 4.02 0.00 2.43 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 2.58 2.64 0.00 27 G 7.05 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 Q 7.64 4.26 0.00 2.16 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.49 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 29 K 7.71 4.15 0.00 1.63 1.77 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.29 1.50 7.81 30 G 8.36 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 31 V 7.53 3.83 2.34 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 0.93 0.00 0.00 0.95 0.00 0.00 32 G 8.48 4.19 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 D 9.11 4.36 0.00 2.62 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 34 G 8.45 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 0.00 0.00 0.00 0.00 35 T 7.74 4.14 4.30 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 1.27 0.00 0.00 36 V 7.88 3.82 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 0.84 0.00 0.00 1.16 0.00 0.00 37 S 8.95 4.96 0.00 3.78 3.71 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 38 W 7.98 5.59 0.00 3.64 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 39 G 8.90 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 L 8.24 3.63 0.00 1.20 1.39 0.66 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 41 E 8.47 4.21 0.00 1.86 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 2.29 2.09 0.00 42 D 7.96 4.26 0.00 2.58 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 43 D 8.14 4.87 0.00 2.76 2.74 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 44 E 7.98 3.97 0.00 2.12 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 2.27 2.20 0.00 45 D 8.14 4.28 0.00 2.69 2.53 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 0.00 0.00 0.00 0.00 46 M 8.59 4.43 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.50 0.00 47 T 7.86 4.03 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 1.29 0.00 0.00 48 L 6.97 3.49 0.00 2.03 2.23 1.08 0.96 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 49 T 7.93 4.50 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 1.31 0.00 0.00 50 R 7.81 5.10 0.00 1.67 1.93 0.00 3.17 0.00 0.00 3.32 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 51 W 9.40 5.17 0.00 3.32 3.18 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 52 T 9.50 4.66 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 1.27 0.00 0.00 53 G 9.13 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 54 M 9.38 5.23 0.00 2.13 1.98 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.66 0.00 55 I 8.93 4.72 1.99 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 1.28 0.54 0.97 0.00 0.00 56 I 8.53 4.56 1.93 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 1.34 0.61 0.95 0.00 0.00 57 G 9.82 4.60 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 0.00 0.00 0.00 58 P 0.00 4.69 0.00 2.19 2.24 0.00 3.84 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.05 0.00 59 P 0.00 4.44 0.00 1.99 2.06 0.00 3.82 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 2.05 2.15 0.00 60 R 9.72 3.94 0.00 1.96 2.08 0.00 3.28 0.00 0.00 3.29 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.71 0.00 61 T 7.33 4.75 4.38 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 0.00 0.00 0.00 1.37 0.00 0.00 62 N 8.04 4.47 0.00 2.29 2.44 0.00 0.00 6.93 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 63 Y 7.79 4.77 0.00 3.13 3.18 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 64 E 7.80 4.30 0.00 2.13 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 2.34 2.26 0.00 65 N 8.68 4.53 0.00 2.85 2.96 0.00 0.00 7.30 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 66 R 7.64 4.04 0.00 2.12 1.42 0.00 3.30 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 67 I 8.05 4.60 1.81 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 1.35 0.71 0.92 0.00 0.00 68 Y 8.88 4.88 0.00 3.19 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 69 S 9.08 5.15 0.00 3.96 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 70 L 9.38 5.02 0.00 1.53 1.27 0.59 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 71 K 9.02 4.88 0.00 1.63 1.71 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.84 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.53 1.36 7.81 72 V 8.46 4.75 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 0.80 0.00 0.00 0.80 0.00 0.00 73 E 9.20 5.67 0.00 1.82 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 2.21 2.07 0.00 74 C 8.68 4.51 0.00 2.55 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 0.00 0.00 0.00 75 G 8.25 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 76 P 0.00 4.50 0.00 2.09 2.15 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 77 K 7.93 4.31 0.00 1.84 1.86 0.00 1.67 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.44 7.81 78 Y 7.90 4.43 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 79 P 0.00 3.69 0.00 1.92 1.32 0.00 3.71 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.84 0.00 80 E 8.32 3.97 0.00 2.21 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 2.33 2.27 0.00 81 A 7.77 4.83 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 82 P 0.00 2.97 0.00 1.76 1.56 0.00 3.54 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 1.95 2.05 0.00 83 P 0.00 4.47 0.00 1.79 1.70 0.00 2.70 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.71 0.00 84 S 8.83 4.63 0.00 3.68 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 85 V 8.23 4.91 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 1.04 0.00 0.00 0.80 0.00 0.00 86 R 8.57 5.06 0.00 1.87 1.91 0.00 2.80 0.00 0.00 3.14 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 87 F 9.37 4.64 0.00 3.06 3.47 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 88 V 9.30 4.23 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 1.03 0.00 0.00 1.02 0.00 0.00 89 T 8.15 4.70 4.57 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 1.23 0.00 0.00 90 K 8.68 3.14 0.00 1.48 1.52 0.00 1.50 0.00 0.00 1.45 0.00 0.00 2.75 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.30 0.76 7.81 91 I 8.71 4.76 1.60 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.93 0.26 0.00 0.00 92 N 9.56 4.76 0.00 2.92 2.76 0.00 0.00 7.01 7.96 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 93 M 7.58 4.77 0.00 1.67 1.65 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.35 0.00 94 N 9.38 4.45 0.00 2.67 2.77 0.00 0.00 7.34 7.89 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 95 G 8.79 4.02 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 0.00 96 I 7.34 4.69 1.79 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.50 0.79 0.00 0.00 97 N 8.63 4.47 0.00 2.65 2.62 0.00 0.00 6.68 6.26 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 98 N 8.72 4.75 0.00 2.95 2.97 0.00 0.00 6.11 7.66 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 99 S 8.52 4.65 0.00 3.93 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 0.00 100 S 8.19 4.10 0.00 3.89 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 0.00 101 G 7.75 2.97 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 0.00 102 M 7.27 4.42 0.00 2.10 1.86 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.45 0.00 103 V 8.34 4.42 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 0.80 0.00 0.00 1.19 0.00 0.00 104 D 9.36 4.57 0.00 2.78 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 0.00 105 A 8.82 4.02 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 0.00 106 R 7.49 3.96 0.00 1.63 2.04 0.00 3.25 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.61 0.00 107 S 7.95 4.60 0.00 3.99 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 I 7.58 4.44 1.88 0.00 0.00 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 1.78 1.20 0.90 0.00 0.00 109 P 0.00 4.26 0.00 2.12 2.13 0.00 3.57 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00 110 V 7.74 3.67 1.43 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 0.64 0.00 0.00 0.85 0.00 0.00 111 L 7.71 4.50 0.00 1.91 1.73 0.89 0.75 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 0.00 112 A 8.65 4.18 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.65 4.55 0.00 1.83 1.83 0.00 1.64 0.00 0.00 1.68 0.00 0.00 3.03 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.43 7.81 114 W 7.89 4.92 0.00 3.69 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 0.00 115 Q 7.27 4.47 0.00 0.99 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.56 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 116 N 8.59 5.10 0.00 2.71 2.95 0.00 0.00 6.84 7.57 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 0.00 117 S 7.22 4.09 0.00 3.70 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 0.00 118 Y 6.70 4.47 0.00 1.43 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 0.00 0.00 0.00 119 S 7.65 5.25 0.00 4.43 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 0.00 120 I 9.03 3.57 1.35 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.44 0.40 0.00 0.00 121 K 7.98 2.66 0.00 1.64 1.68 0.00 2.07 0.00 0.00 1.96 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.41 7.81 122 V 6.99 3.43 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 0.55 0.00 0.00 0.90 0.00 0.00 123 V 7.47 3.46 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 0.98 0.00 0.00 1.18 0.00 0.00 124 L 7.70 3.81 0.00 1.36 1.53 0.36 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 125 Q 7.80 3.97 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 126 E 8.41 3.84 0.00 2.02 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 0.00 2.20 2.33 0.00 127 L 8.08 3.95 0.00 1.82 1.75 0.86 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 128 R 7.74 3.83 0.00 1.90 2.07 0.00 3.29 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 129 R 7.92 4.01 0.00 2.00 2.04 0.00 3.13 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 130 L 8.10 4.06 0.00 1.86 1.66 0.89 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 131 M 7.70 3.98 0.00 1.23 2.06 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 1.97 0.00 132 M 7.37 4.45 0.00 2.03 2.21 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.59 0.00 133 S 7.34 4.35 0.00 3.94 3.79 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 0.00 0.00 0.00 134 K 8.74 3.83 0.00 1.74 1.85 0.00 1.72 0.00 0.00 1.77 0.00 0.00 3.12 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.52 7.81 135 E 8.08 4.48 0.00 2.12 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 2.25 2.27 0.00 136 N 7.80 4.94 0.00 2.90 2.91 0.00 0.00 7.07 7.64 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 0.00 137 M 9.03 4.48 0.00 2.19 2.41 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.63 0.00 138 K 7.82 5.15 0.00 1.72 1.79 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.32 1.35 7.81 139 L 7.27 4.59 0.00 1.69 1.57 1.04 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 140 P 0.00 4.17 0.00 2.02 2.00 0.00 3.64 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 2.01 2.09 0.00 141 Q 8.29 4.50 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 7.37 0.00 0.00 0.00 0.00 0.00 2.22 1.98 0.00 142 P 0.00 4.47 0.00 2.14 2.05 0.00 3.84 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 2.13 1.97 0.00 143 P 0.00 4.10 0.00 2.17 2.04 0.00 3.74 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 2.09 0.00 144 E 8.62 3.89 0.00 1.89 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 2.21 2.22 0.00 145 G 8.89 4.06 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 0.00 0.00 0.00 146 Q 7.89 4.22 0.00 2.10 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.61 0.00 0.00 0.00 0.00 0.00 2.33 2.36 0.00 147 T 7.96 4.96 4.34 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 0.00 0.00 0.00 1.27 0.00 0.00 148 Y 8.62 4.19 0.00 3.09 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 0.00 149 N 7.85 5.04 0.00 2.74 2.75 0.00 0.00 7.05 8.06 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 0.00 150 N 8.71 4.55 0.00 2.88 2.80 0.00 0.00 6.76 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00