NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.4012 7.8833 121.4719 61.2625 38.6952 174.0471 17 I 4.5009 8.5596 127.0698 60.3333 38.5170 174.9149 18 G 3.7684 8.4977 111.8358 46.4125 0.0000 173.5936 19 G 4.4512 7.7301 107.8691 45.0344 0.0000 173.2652 20 R 4.8799 8.4470 116.6089 54.2108 33.6281 174.5145 21 E 4.4266 8.6547 121.2400 56.2807 30.2391 176.6983 22 S 4.3813 8.6924 123.3089 57.9577 64.2245 174.3314 23 R 3.8743 8.4683 123.0849 55.5139 30.4471 174.2794 24 P 4.0032 0.0000 0.0000 64.5967 31.6168 175.6464 25 H 4.1306 8.6119 118.1588 56.8263 26.0298 175.6586 26 S 4.4619 7.7884 112.7219 59.3238 63.8436 174.8419 27 R 4.2083 7.1925 120.0407 53.3187 30.4608 173.7570 28 P 4.5843 0.0000 0.0000 64.0480 32.0320 178.3263 29 Y 4.7321 6.3275 115.9227 57.4203 38.8746 175.1262 30 M 4.9712 7.5579 121.2509 55.6862 32.8604 175.7093 31 A 5.1334 9.6522 124.5954 50.3499 22.9546 173.9870 32 Y 4.8734 8.7888 122.4801 55.7844 41.3628 174.2400 33 L 4.9044 8.2375 126.8417 53.0176 44.5195 175.2980 34 Q 4.4307 8.8472 123.6450 54.3709 30.4511 174.7281 35 I 4.4737 8.5301 126.7331 60.2170 38.7991 174.1360 36 Q 3.6594 9.0030 131.4543 55.0456 28.9297 173.7391 36A S 4.5271 8.1310 115.4175 56.6809 64.3379 172.5033 36B P 4.4258 0.0000 0.0000 61.9710 31.9403 175.9232 37 A 4.4616 8.2950 122.0326 52.1986 15.7722 176.1140 38 G 3.6134 8.4828 113.9956 45.1794 0.0000 171.6205 39 Q 3.9971 7.8485 123.6265 58.9110 29.3166 176.7115 40 S 4.7889 6.9969 109.0936 57.6584 66.5055 175.8932 41 R 5.0050 8.5446 120.8518 54.9988 32.6250 174.4211 42 C 4.8464 8.5213 116.8124 56.2533 45.7824 172.6712 43 G 4.4410 8.6554 108.3420 45.5594 0.0000 172.1252 44 G 4.6484 8.5153 105.4314 47.1009 0.0000 172.3930 45 F 5.8371 8.2578 113.8390 55.0438 41.7982 173.7785 46 L 4.6398 9.5445 124.8927 55.4622 42.4549 177.5804 47 V 4.3896 8.6765 118.4346 61.4556 33.9316 175.0907 48 R 4.6437 7.4914 118.2675 55.0337 32.9078 175.0730 49 E 4.1226 8.9029 119.9130 58.4979 29.6924 178.3070 50 D 4.9596 8.1697 115.9206 52.5524 40.4020 174.8056 51 F 5.3161 8.1886 118.2673 56.0599 43.4602 173.6521 52 V 4.7606 8.9292 122.9420 60.9960 34.4245 173.7869 53 L 4.8605 8.2666 129.6476 54.2024 43.8686 175.3286 54 T 5.0339 8.3552 118.3119 61.7168 71.2443 171.4692 55 A 4.5430 8.4468 123.1765 50.9106 20.1383 178.6222 56 A 3.7951 8.2781 125.0946 55.1779 18.5321 179.2104 57 H 4.3654 8.3788 110.3754 57.7543 28.5918 175.3707 58 C 4.5608 7.8017 117.2960 56.5144 40.2339 173.6264 59 W 4.2586 7.9066 130.8416 57.7985 30.7148 175.1852 60 G 3.6241 6.6362 111.7380 43.8315 0.0000 173.1749 61 S 3.5618 7.8934 114.1295 60.3567 63.5477 173.7856 *63 N 5.2708 7.8298 119.1302 53.4937 40.2988 173.1762 64 I 4.8340 7.9778 125.4793 59.5524 41.3829 173.4119 65 N 4.9692 9.1256 126.8226 51.9707 40.7153 173.4148 66 V 4.6355 8.7114 127.2805 61.7402 33.7783 174.3857 67 T 5.0089 8.9834 125.0967 62.0016 70.6604 173.5948 68 L 4.8429 8.9996 126.8760 53.7301 44.9996 177.6578 69 G 3.9306 9.1660 107.1730 46.5610 0.0000 173.4879 70 A 4.8480 7.8169 121.3322 51.2609 20.3204 175.6299 71 H 4.7355 9.5937 116.8902 56.9980 32.3295 173.3758 72 N 4.9915 9.1670 124.7274 51.9832 38.4265 175.4872 73 I 3.7393 8.1751 119.2886 61.9671 37.6809 176.5716 74 Q 4.4155 8.4902 119.9210 55.7612 28.9386 175.3860 75 R 4.5952 7.4146 116.3664 54.1362 33.3206 176.2015 76 R 4.1870 8.4255 120.1255 55.8112 29.4479 175.7560 77 E 4.6272 8.4395 122.9341 54.5202 31.1943 177.4380 78 N 4.5653 8.5984 119.0788 54.9267 37.8438 176.0580 79 T 4.1242 7.7244 108.8385 63.1500 69.6554 174.3678 80 Q 4.5004 7.6466 121.7493 55.9412 29.6834 175.6032 81 Q 4.5015 9.1249 122.1474 54.4067 32.1616 173.9454 82 H 5.3999 8.7772 121.2397 54.1565 30.8158 174.1346 83 I 4.7874 8.7975 124.1022 59.5979 41.4815 174.9982 84 T 4.6384 8.4472 115.9063 61.0477 70.7234 173.4606 85 A 4.3336 8.3888 126.2559 52.0194 18.5028 177.7097 86 R 4.0611 9.1231 124.6649 58.8197 30.9592 177.0765 87 R 4.7970 7.8491 115.8295 54.2083 34.8074 174.4085 88 A 5.0157 8.8449 123.8877 50.5614 21.0707 176.0992 89 I 4.3679 9.1044 124.6495 60.7597 37.9478 175.9618 90 R 4.4113 8.4922 126.2073 55.6370 31.1547 176.3664 91 H 3.3579 8.4292 122.4830 55.6930 30.2797 174.6649 92 P 4.2641 0.0000 0.0000 65.1189 31.3518 177.2316 93 Q 4.5498 7.8819 114.7211 55.4015 28.7720 174.7367 94 Y 4.2229 7.8779 120.6494 57.9560 39.3008 174.7466 95 N 4.5063 8.2950 125.3265 51.3513 39.9858 174.7043 96 Q 3.6737 7.7144 126.9557 57.8380 29.6256 177.4235 97 R 3.9707 8.1755 118.2016 59.0046 30.1448 177.1656 98 T 4.1400 7.8089 104.2479 60.9300 69.5627 174.2012 99 I 3.2097 7.2791 122.0452 62.4944 35.2363 173.3117 100 Q 4.4460 7.7508 119.4199 55.8580 30.5295 174.2352 101 N 4.3263 8.6152 117.4708 54.5942 36.0539 175.7345 102 D 4.6780 7.8981 117.5290 53.0304 39.9094 174.4850 103 I 4.7183 7.1639 121.1776 59.4156 42.2160 172.5426 104 M 5.4000 9.1009 126.7141 54.4447 36.3739 173.0085 105 L 5.1786 9.2350 125.0772 53.0653 44.6763 175.2744 106 L 5.1050 9.1620 123.9843 53.0671 44.1346 175.2981 107 Q 3.6742 8.7275 126.7354 54.7418 29.8406 175.1317 108 L 4.4587 8.5921 127.6077 54.4263 42.4667 178.4916 109 S 4.3337 8.6921 117.5272 60.8073 63.4577 174.5596 110 R 4.6506 7.2676 112.0021 54.0767 32.3239 174.9404 111 R 4.3097 8.2510 118.3130 56.2559 30.7975 177.0707 112 V 4.0156 8.4527 116.0752 61.3289 32.6921 176.5148 113 R 4.3220 9.2400 120.8622 54.7983 29.7748 176.4174 114 R 4.1837 8.5263 125.5444 56.3459 31.0215 175.2306 115 N 4.7996 8.7482 121.3140 52.0421 40.2048 174.9732 116 R 3.9631 8.6628 113.9636 59.2804 29.3233 177.2447 117 N 4.5313 8.6363 114.8677 53.7660 39.3368 174.6344 118 V 4.7379 7.7363 117.4739 61.4394 32.8073 173.2132 119 N 5.3072 8.4904 123.0199 50.9240 40.7307 172.5320 120 P 4.8751 0.0000 0.0000 62.9805 32.2443 176.0420 121 V 4.4035 8.3813 121.8000 59.9549 33.3026 175.7355 122 A 4.2545 8.4485 124.0819 52.1167 19.0014 176.9436 123 L 4.6677 8.2767 120.2259 52.0233 44.2369 174.7781 124 P 4.5055 0.0000 0.0000 62.2129 32.5402 176.1292 125 R 4.1931 8.1792 116.9169 55.1670 30.8563 176.4247 126 A 4.1224 8.2888 123.2170 53.7919 18.7945 177.8588 127 Q 3.5741 8.4137 120.6788 56.1694 28.6153 173.2338 128 E 4.0103 8.0048 117.9049 56.6860 29.9774 176.8082 129 G 4.0814 8.3547 115.8962 44.3836 0.0000 171.8155 130 L 4.5107 7.9375 119.8190 53.3806 45.1360 176.0736 131 R 4.1432 8.4951 125.2602 55.0991 30.8412 174.3998 132 P 4.4326 0.0000 0.0000 64.1207 31.8543 176.6017 133 G 4.0096 9.3509 111.8743 45.3721 0.0000 174.2510 134 T 3.9519 7.6297 117.2492 63.8509 69.4936 173.4430 135 L 4.7887 8.4130 126.1275 54.4540 42.7531 176.7009 136 C 5.2101 9.2379 120.2569 55.4629 43.5562 172.7708 137 T 5.2877 9.0238 116.6545 61.7986 71.4970 173.9318 138 V 5.2200 8.9665 124.0387 58.9434 34.6700 174.3794 139 A 5.0961 8.6558 123.0790 50.2020 22.8793 174.9608 140 G 3.8242 7.8752 106.1609 46.1842 0.0000 173.5281 141 W 4.7500 9.0401 116.9230 56.3169 29.2411 177.0835 142 G 4.0332 8.5692 109.4257 44.6581 0.0000 174.2531 143 R 4.2885 8.6605 118.8791 56.5836 30.3255 177.7642 144 V 4.8904 8.4684 112.7259 61.1621 32.2358 175.6222 145 S 4.5675 7.3751 113.1125 57.8410 65.0676 175.8542 146 M 4.3827 8.7094 119.5177 57.9974 31.8476 177.9565 147 R 4.2545 7.4114 115.2070 57.5995 30.8501 176.0036 148 R 4.6403 8.2061 113.0507 54.3515 33.0477 174.5948 *151 G 4.2492 8.1436 105.3761 46.0302 0.0000 171.7942 152 T 4.7113 8.1938 112.5998 60.9729 70.6160 174.3825 153 D 4.6795 8.7582 125.7703 55.2077 41.8259 176.1695 154 T 5.9001 7.2163 107.6939 58.2321 71.8608 173.9783 155 L 3.1304 8.1008 124.5855 55.2546 43.2254 175.9252 156 R 5.1996 8.2227 123.6407 54.5709 34.8044 173.7992 157 E 5.2681 9.0547 117.6085 55.7012 33.6304 174.2299 158 V 4.7796 8.6000 118.3887 60.7850 35.2480 172.7798 159 Q 5.0408 8.5731 121.3028 54.7702 29.9755 175.0621 160 L 4.8522 8.8782 123.6082 52.8376 46.0516 175.2458 161 R 4.8509 8.2265 121.7337 54.5696 32.2470 175.5047 162 V 3.8932 8.4781 126.8917 63.3256 32.4868 175.2377 163 Q 4.8397 8.6186 126.9479 54.0464 31.3441 175.8046 164 R 4.1307 8.6672 120.0529 56.1062 31.0055 177.8752 165 D 4.4845 9.0506 122.0353 57.6991 40.7856 179.0307 166 R 3.8793 8.1488 118.5759 59.8949 30.0768 178.1127 167 Q 3.9380 7.8470 117.0766 59.3174 28.6512 178.2539 168 C 4.3043 7.7615 116.9021 59.5869 39.9719 175.6687 169 L 3.9896 8.2037 120.6869 57.5943 41.3159 178.9894 170 R 4.2831 7.6536 113.2593 57.0527 30.0189 177.1641 171 I 3.8952 6.9048 118.5767 61.7517 38.3835 175.8952 172 F 4.9690 8.2653 119.9408 55.2372 40.9721 176.0422 173 G 3.9087 9.3219 115.4289 48.9452 0.0000 174.3887 174 S 4.7461 8.0360 113.7357 58.1073 63.1759 173.4802 175 Y 4.4368 7.8561 122.6323 57.5250 39.0224 174.6215 176 D 4.5980 8.8720 126.9270 51.3226 42.3478 173.9495 177 P 4.0539 0.0000 0.0000 65.7605 31.1072 178.0645 178 R 4.0541 7.9352 116.7935 58.0903 30.2143 177.1182 179 R 4.6300 8.1537 114.7818 55.8116 32.3263 175.3142 180 Q 5.3180 7.8203 116.2546 54.1564 33.4997 174.2696 181 I 4.8221 8.9199 120.2942 59.8469 41.3718 173.9630 182 C 5.0479 8.9564 126.1767 55.5364 45.2822 172.2850 183 V 4.5353 9.2182 126.1786 62.2074 34.7511 175.0641 184A G 4.0736 9.3255 115.8231 45.8895 0.0000 172.6357 184 D 4.4797 8.6712 124.4982 53.5050 41.8070 176.9500 185 R 3.9855 8.7303 123.6689 59.3437 29.4653 178.2359 186 R 4.0142 8.6551 117.1703 57.9741 30.2516 176.4143 187 E 4.6723 7.8152 116.7500 54.7190 31.5512 177.0071 188A R 4.3717 8.1112 122.6377 54.7725 28.8244 175.1351 188 K 5.1284 7.2707 116.1024 54.7240 36.1941 176.5173 189 A 4.5452 8.5001 123.8691 51.1779 23.2028 175.3417 190 A 4.6087 9.5718 122.1100 52.1534 19.7873 177.4896 191 F 5.0156 9.4214 120.5062 57.0012 42.4932 173.2316 192 K 3.7847 6.8555 118.8176 58.4585 31.9453 177.4611 193 G 4.1431 9.0394 112.2344 45.6615 0.0000 173.8298 194 D 4.6936 8.3310 118.2569 54.9237 41.6853 176.7057 195 S 4.4575 7.8910 116.1529 60.3929 63.4067 175.2436 196 G 4.3400 8.7064 112.3064 46.4865 0.0000 173.9642 197 G 4.3373 7.9836 107.0681 45.7054 0.0000 171.3386 198 P 4.9532 0.0000 0.0000 61.6615 33.8326 174.6575 199 L 4.8439 8.5044 123.5854 53.6035 44.1017 175.0144 200 L 4.9638 9.1248 128.1818 53.6405 43.4820 175.2230 201 C 5.0482 8.8746 121.8755 55.1299 43.1784 174.3883 202 N 4.2580 9.6106 123.1048 54.5973 35.7623 174.5752 203 N 4.2754 8.3931 109.4590 53.7074 36.6579 174.4988 204 V 4.1308 7.3478 117.4888 60.9102 33.8568 174.4383 *209 A 4.4393 8.2973 127.1681 52.5928 18.3966 175.4744 210 H 4.4389 9.2106 119.3319 58.1711 30.4959 175.4250 211 G 5.2401 8.0102 103.6244 45.4722 0.0000 171.3942 212 I 5.3714 8.3461 119.4741 58.9414 41.0076 175.4055 213 V 2.4608 8.7385 127.6421 63.4277 31.7390 174.1759 214 S 4.8046 8.2732 120.9118 58.8107 64.3556 173.3691 215 Y 4.6892 7.6118 114.8531 56.7578 41.8926 172.7568 216 G 3.7506 7.9696 105.0674 45.7873 0.0000 173.2246 217 K 4.4589 8.4581 118.7701 55.9841 32.8717 178.1541 218 S 4.3515 8.8038 116.6707 61.2137 62.5439 175.7777 219 S 4.2076 8.1316 114.1253 59.4995 63.0033 175.2617 220 G 3.5930 8.2962 108.4042 44.7240 0.0000 173.3589 221 V 3.5371 7.5012 120.9355 61.7810 31.8247 173.5359 *224 P 4.4669 0.0000 0.0000 61.8464 32.2719 174.1213 225 P 5.0069 0.0000 0.0000 62.6049 32.2897 175.1844 226 E 4.8107 9.2905 119.3049 54.7476 34.0534 174.1463 227 V 4.8630 8.1970 119.6632 61.1267 33.7186 174.2934 228 F 5.1987 9.0769 125.7317 55.7587 42.6842 174.8063 229 T 4.3501 9.0666 119.7041 63.5476 69.9496 174.4368 230 R 4.6809 9.1227 127.2443 54.9492 29.3602 176.6293 231 V 3.8796 8.7366 126.9071 65.9988 31.7148 178.5484 232 S 4.2719 8.2102 113.2640 60.7987 62.9279 175.8530 233 S 4.1692 7.9828 116.2148 60.0200 62.9408 174.7690 234 F 4.9064 8.3013 118.3529 57.1505 39.5903 177.1184 235 L 4.0820 8.2480 123.4610 57.7709 41.3570 177.5609 236 P 4.3234 0.0000 0.0000 65.3202 31.2734 178.5149 237 W 4.1940 8.3167 126.7736 60.3188 30.7308 177.8924 238 I 3.1697 8.3992 120.2237 64.4549 36.6117 178.5733 239 R 3.7994 8.3186 119.0562 59.4493 29.8743 179.3530 240 T 3.7450 7.8205 115.3583 66.9837 68.2669 176.8234 241 T 3.6411 7.1835 116.1506 66.8535 68.3922 176.2970 242 M 3.4709 7.2783 119.4597 57.5583 31.9613 178.6913 243 R 3.9795 7.5613 118.5771 59.3211 30.5154 176.3254 244 S 4.2960 8.2692 116.7659 58.4783 63.2203 173.6761 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 16 I 7.88 4.40 1.89 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.98 0.93 0.00 0.00 17 I 8.56 4.50 1.79 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.77 0.86 0.00 0.00 18 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 19 G 7.73 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.45 4.88 0.00 1.83 1.96 0.00 2.76 0.00 0.00 3.08 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.55 0.00 21 E 8.65 4.43 0.00 2.00 1.89 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 2.34 2.48 0.00 22 S 8.69 4.38 0.00 3.70 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 R 8.47 3.87 0.00 1.81 1.77 0.00 3.18 0.00 0.00 3.32 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.62 0.00 24 P 0.00 4.00 0.00 1.97 1.69 0.00 3.77 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.66 0.00 25 H 8.61 4.13 0.00 3.32 3.41 0.00 5.69 0.00 0.00 0.00 0.00 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 S 7.79 4.46 0.00 3.99 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 27 R 7.19 4.21 0.00 1.51 1.22 0.00 3.06 0.00 0.00 3.46 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.47 0.00 28 P 0.00 4.58 0.00 2.32 2.43 0.00 3.63 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 2.19 1.95 0.00 29 Y 6.33 4.73 0.00 3.44 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 M 7.56 4.97 0.00 2.20 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 2.46 2.50 0.00 31 A 9.65 5.13 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 32 Y 8.79 4.87 0.00 1.90 2.45 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.24 4.90 0.00 1.37 1.37 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.85 4.43 0.00 1.87 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.18 0.00 35 I 8.53 4.47 1.88 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.77 0.73 0.00 0.00 36 Q 9.00 3.66 0.00 2.24 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 7.08 0.00 0.00 0.00 0.00 0.00 2.09 2.10 0.00 36A S 8.13 4.53 0.00 3.81 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 36B P 0.00 4.43 0.00 2.19 2.18 0.00 3.68 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 37 A 8.30 4.46 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 38 G 8.48 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Q 7.85 4.00 0.00 2.21 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.53 0.00 40 S 7.00 4.79 0.00 3.68 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 41 R 8.54 5.00 0.00 1.42 1.69 0.00 3.24 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 42 C 8.52 4.85 0.00 2.78 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 43 G 8.66 4.44 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 0.00 0.00 0.00 44 G 8.52 4.65 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 45 F 8.26 5.84 0.00 3.28 3.28 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 46 L 9.54 4.64 0.00 1.90 1.78 1.07 0.98 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 47 V 8.68 4.39 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 0.79 0.00 0.00 0.98 0.00 0.00 48 R 7.49 4.64 0.00 1.88 2.05 0.00 3.23 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.70 0.00 49 E 8.90 4.12 0.00 2.14 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 2.42 2.40 0.00 50 D 8.17 4.96 0.00 2.51 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 51 F 8.19 5.32 0.00 2.93 2.80 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 52 V 8.93 4.76 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 0.85 0.00 0.00 0.96 0.00 0.00 53 L 8.27 4.86 0.00 1.38 0.26 1.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 54 T 8.36 5.03 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 1.17 0.00 0.00 55 A 8.45 4.54 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 56 A 8.28 3.80 0.53 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 0.00 0.00 57 H 8.38 4.37 0.00 3.33 3.62 0.00 5.55 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.80 4.56 0.00 3.05 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 59 W 7.91 4.26 0.00 3.29 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 60 G 6.64 3.62 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 0.00 0.00 0.00 61 S 7.89 3.56 0.00 3.91 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 *63 N 7.83 5.27 0.00 2.74 2.65 0.00 0.00 7.37 7.73 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 64 I 7.98 4.83 1.73 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.27 0.79 0.00 0.00 65 N 9.13 4.97 0.00 2.74 2.61 0.00 0.00 6.24 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 66 V 8.71 4.64 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 1.00 0.00 0.00 0.88 0.00 0.00 67 T 8.98 5.01 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 1.17 0.00 0.00 68 L 9.00 4.84 0.00 1.52 1.58 1.00 0.60 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 69 G 9.17 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 70 A 7.82 4.85 1.18 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 0.00 0.00 71 H 9.59 4.74 0.00 2.98 3.39 0.00 5.77 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 N 9.17 4.99 0.00 2.78 2.86 0.00 0.00 7.13 6.98 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 73 I 8.18 3.74 0.85 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.07 -0.45 0.00 0.00 74 Q 8.49 4.42 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.93 6.64 0.00 0.00 0.00 0.00 0.00 2.24 2.58 0.00 75 R 7.41 4.60 0.00 1.73 1.78 0.00 3.16 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.70 0.00 76 R 8.43 4.19 0.00 1.80 1.92 0.00 3.18 0.00 0.00 3.22 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 77 E 8.44 4.63 0.00 2.04 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 2.36 2.48 0.00 78 N 8.60 4.57 0.00 2.82 2.94 0.00 0.00 6.09 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 79 T 7.72 4.12 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 1.12 0.00 0.00 80 Q 7.65 4.50 0.00 2.08 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.87 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 81 Q 9.12 4.50 0.00 1.89 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.63 6.76 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 82 H 8.78 5.40 0.00 3.01 3.18 0.00 5.64 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 8.80 4.79 1.84 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.83 0.90 0.00 0.00 84 T 8.45 4.64 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 1.17 0.00 0.00 85 A 8.39 4.33 1.18 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 0.00 0.00 86 R 9.12 4.06 0.00 1.71 2.01 0.00 3.16 0.00 0.00 3.15 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 87 R 7.85 4.80 0.00 1.76 1.80 0.00 3.42 0.00 0.00 3.38 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 88 A 8.84 5.02 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 89 I 9.10 4.37 2.02 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.79 1.13 0.00 0.00 90 R 8.49 4.41 0.00 1.61 1.75 0.00 2.93 0.00 0.00 2.61 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.60 0.00 91 H 8.43 3.36 0.00 2.48 2.82 0.00 5.60 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.26 0.00 1.96 2.08 0.00 2.70 0.00 0.00 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.17 0.00 93 Q 7.88 4.55 0.00 2.07 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.86 0.00 0.00 0.00 0.00 0.00 2.28 2.29 0.00 94 Y 7.88 4.22 0.00 2.90 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.29 4.51 0.00 2.55 2.45 0.00 0.00 6.42 6.64 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 96 Q 7.71 3.67 0.00 1.84 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.86 0.00 0.00 0.00 0.00 0.00 2.26 2.28 0.00 97 R 8.18 3.97 0.00 1.70 1.99 0.00 3.26 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.50 0.00 98 T 7.81 4.14 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 1.16 0.00 0.00 99 I 7.28 3.21 1.34 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 0.99 0.09 0.93 0.00 0.00 100 Q 7.75 4.45 0.00 2.10 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.34 6.53 0.00 0.00 0.00 0.00 0.00 2.37 2.45 0.00 101 N 8.62 4.33 0.00 2.90 2.62 0.00 0.00 6.92 8.29 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 0.00 102 D 7.90 4.68 0.00 2.99 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 0.00 103 I 7.16 4.72 1.36 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 1.33 1.07 -0.09 0.00 0.00 104 M 9.10 5.40 0.00 2.08 1.79 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.61 0.00 105 L 9.24 5.18 0.00 1.55 1.62 0.14 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 106 L 9.16 5.11 0.00 1.52 1.55 0.88 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 107 Q 8.73 3.67 0.00 1.73 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.77 0.00 0.00 0.00 0.00 0.00 1.97 1.46 0.00 108 L 8.59 4.46 0.00 1.51 1.54 0.89 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 109 S 8.69 4.33 0.00 3.83 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 0.00 110 R 7.27 4.65 0.00 1.91 1.84 0.00 3.05 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.56 0.00 111 R 8.25 4.31 0.00 1.71 1.90 0.00 3.20 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 112 V 8.45 4.02 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 0.74 0.00 0.00 1.01 0.00 0.00 113 R 9.24 4.32 0.00 1.76 1.97 0.00 3.06 0.00 0.00 3.14 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 114 R 8.53 4.18 0.00 1.81 1.90 0.00 3.30 0.00 0.00 3.30 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.66 0.00 115 N 8.75 4.80 0.00 2.96 2.90 0.00 0.00 6.39 7.10 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 0.00 116 R 8.66 3.96 0.00 1.95 2.13 0.00 3.18 0.00 0.00 3.21 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.60 0.00 117 N 8.64 4.53 0.00 2.90 2.87 0.00 0.00 6.22 7.20 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 0.00 118 V 7.74 4.74 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 0.95 0.00 0.00 119 N 8.49 5.31 0.00 2.95 2.90 0.00 0.00 6.83 7.72 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 0.00 120 P 0.00 4.88 0.00 2.03 2.00 0.00 3.73 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.17 0.00 121 V 8.38 4.40 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 0.75 0.00 0.00 0.25 0.00 0.00 122 A 8.45 4.25 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 0.00 123 L 8.28 4.67 0.00 1.64 1.61 0.95 1.21 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 0.00 124 P 0.00 4.51 0.00 2.10 1.74 0.00 3.77 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 1.97 1.85 0.00 125 R 8.18 4.19 0.00 1.87 1.88 0.00 3.30 0.00 0.00 3.34 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.57 0.00 126 A 8.29 4.12 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 0.00 127 Q 8.41 3.57 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.77 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 128 E 8.00 4.01 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.38 0.00 129 G 8.35 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 0.00 0.00 0.00 0.00 130 L 7.94 4.51 0.00 1.50 1.47 0.62 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 131 R 8.50 4.14 0.00 1.93 1.82 0.00 3.20 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 132 P 0.00 4.43 0.00 2.03 1.98 0.00 3.63 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 2.03 2.09 0.00 133 G 9.35 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 T 7.63 3.95 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 1.15 0.00 0.00 135 L 8.41 4.79 0.00 1.50 1.57 0.94 0.84 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 0.00 136 C 9.24 5.21 0.00 2.67 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 0.00 137 T 9.02 5.29 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 1.21 0.00 0.00 138 V 8.97 5.22 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 1.17 0.00 0.00 1.16 0.00 0.00 139 A 8.66 5.10 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 G 7.88 3.82 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 0.00 0.00 0.00 141 W 9.04 4.75 0.00 3.61 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 0.00 142 G 8.57 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 0.00 143 R 8.66 4.29 0.00 1.93 2.37 0.00 3.13 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.63 0.00 144 V 8.47 4.89 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 1.04 0.00 0.00 145 S 7.38 4.57 0.00 3.97 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 0.00 146 M 8.71 4.38 0.00 2.10 2.25 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.70 0.00 147 R 7.41 4.25 0.00 1.86 1.98 0.00 3.23 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.59 0.00 148 R 8.21 4.64 0.00 2.02 1.98 0.00 2.88 0.00 0.00 3.20 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 *151 G 8.14 4.25 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 0.00 152 T 8.19 4.71 4.29 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 1.41 0.00 0.00 153 D 8.76 4.68 0.00 2.76 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 T 7.22 5.90 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 1.22 0.00 0.00 155 L 8.10 3.13 0.00 0.97 1.23 -0.47 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 156 R 8.22 5.20 0.00 1.73 1.82 0.00 3.18 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 157 E 9.05 5.27 0.00 2.02 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 2.14 2.23 0.00 158 V 8.60 4.78 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 0.72 0.00 0.00 0.96 0.00 0.00 159 Q 8.57 5.04 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.76 0.00 0.00 0.00 0.00 0.00 2.28 2.36 0.00 160 L 8.88 4.85 0.00 1.44 1.45 1.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 161 R 8.23 4.85 0.00 1.85 1.75 0.00 3.16 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 162 V 8.48 3.89 2.14 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 0.84 0.00 0.00 0.89 0.00 0.00 163 Q 8.62 4.84 0.00 2.05 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.67 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 164 R 8.67 4.13 0.00 1.89 1.85 0.00 3.14 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 165 D 9.05 4.48 0.00 2.80 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 0.00 166 R 8.15 3.88 0.00 1.89 1.97 0.00 3.19 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 167 Q 7.85 3.94 0.00 2.20 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.56 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 168 C 7.76 4.30 0.00 1.75 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 0.00 0.00 0.00 169 L 8.20 3.99 0.00 1.81 1.83 1.24 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 170 R 7.65 4.28 0.00 1.90 2.03 0.00 3.02 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 171 I 6.90 3.90 1.25 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.60 0.17 0.00 0.00 172 F 8.27 4.97 0.00 3.21 3.17 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 0.00 173 G 9.32 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 0.00 174 S 8.04 4.75 0.00 3.93 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 0.00 175 Y 7.86 4.44 0.00 3.08 3.03 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 0.00 176 D 8.87 4.60 0.00 2.62 2.37 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 0.00 177 P 0.00 4.05 0.00 2.23 2.40 0.00 3.75 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 2.08 0.00 178 R 7.94 4.05 0.00 1.97 1.94 0.00 3.05 0.00 0.00 3.19 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.56 0.00 179 R 8.15 4.63 0.00 1.70 2.06 0.00 3.16 0.00 0.00 3.01 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.44 0.00 180 Q 7.82 5.32 0.00 1.45 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 181 I 8.92 4.82 1.95 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.13 0.91 0.00 0.00 182 C 8.96 5.05 0.00 2.86 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 0.00 183 V 9.22 4.54 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 0.68 0.00 0.00 0.58 0.00 0.00 184A G 9.33 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 0.00 184 D 8.67 4.48 0.00 2.67 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 R 8.73 3.99 0.00 1.94 2.14 0.00 3.07 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.65 0.00 186 R 8.66 4.01 0.00 1.88 2.03 0.00 3.12 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 187 E 7.82 4.67 0.00 1.94 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 2.24 2.23 0.00 188A R 8.11 4.37 0.00 1.84 1.83 0.00 3.04 0.00 0.00 3.31 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 188 K 7.27 5.13 0.00 1.57 1.66 0.00 1.77 0.00 0.00 1.80 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.41 7.81 189 A 8.50 4.55 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 A 9.57 4.61 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 0.00 191 F 9.42 5.02 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 0.00 192 K 6.86 3.78 0.00 1.31 1.49 0.00 1.01 0.00 0.00 1.54 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.19 0.44 7.81 193 G 9.04 4.14 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 0.00 0.00 0.00 194 D 8.33 4.69 0.00 2.91 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 S 7.89 4.46 0.00 3.88 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 0.00 196 G 8.71 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 0.00 0.00 0.00 0.00 197 G 7.98 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 0.00 0.00 0.00 0.00 198 P 0.00 4.95 0.00 1.49 0.49 0.00 3.75 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.91 0.00 199 L 8.50 4.84 0.00 1.80 1.67 0.45 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 200 L 9.12 4.96 0.00 1.55 1.50 0.99 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 201 C 8.87 5.05 0.00 2.75 2.86 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 0.00 202 N 9.61 4.26 0.00 2.83 2.85 0.00 0.00 7.20 7.98 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 0.00 203 N 8.39 4.28 0.00 2.85 2.93 0.00 0.00 6.91 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 V 7.35 4.13 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 0.88 0.00 0.00 0.91 0.00 0.00 *209 A 8.30 4.44 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 210 H 9.21 4.44 0.00 3.07 3.35 0.00 5.56 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 0.00 211 G 8.01 5.24 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 0.00 212 I 8.35 5.37 1.97 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.90 1.00 0.00 0.00 213 V 8.74 2.46 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 0.76 0.00 0.00 0.89 0.00 0.00 214 S 8.27 4.80 0.00 3.91 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 215 Y 7.61 4.69 0.00 2.96 2.91 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 0.00 216 G 7.97 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 0.00 217 K 8.46 4.46 0.00 1.97 1.86 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.69 1.69 7.81 218 S 8.80 4.35 0.00 3.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 219 S 8.13 4.21 0.00 4.02 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 0.00 220 G 8.30 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 V 7.50 3.54 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 1.04 0.00 0.00 0.91 0.00 0.00 *224 P 0.00 4.47 0.00 2.36 2.13 0.00 3.46 0.00 0.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 2.07 0.00 225 P 0.00 5.01 0.00 2.05 2.05 0.00 3.63 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 2.01 2.20 0.00 226 E 9.29 4.81 0.00 2.12 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 2.59 2.54 0.00 227 V 8.20 4.86 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 nan 0.00 0.00 0.20 0.00 0.00 228 F 9.08 5.20 0.00 3.01 2.98 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 0.00 229 T 9.07 4.35 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 1.11 0.00 0.00 230 R 9.12 4.68 0.00 1.93 1.99 0.00 3.27 0.00 0.00 3.13 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 231 V 8.74 3.88 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 1.08 0.00 0.00 1.17 0.00 0.00 232 S 8.21 4.27 0.00 4.19 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 S 7.98 4.17 0.00 3.62 3.54 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 0.00 234 F 8.30 4.91 0.00 3.22 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 L 8.25 4.08 0.00 1.70 1.77 0.95 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 236 P 0.00 4.32 0.00 2.23 2.14 0.00 3.62 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 2.13 2.17 0.00 237 W 8.32 4.19 0.00 3.49 3.57 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 0.00 238 I 8.40 3.17 2.06 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.96 0.78 0.00 0.00 239 R 8.32 3.80 0.00 1.80 1.92 0.00 3.11 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.80 0.00 240 T 7.82 3.74 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 1.17 0.00 0.00 241 T 7.18 3.64 3.54 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 0.85 0.00 0.00 242 M 7.28 3.47 0.00 1.55 1.74 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.81 0.00 243 R 7.56 3.98 0.00 1.77 2.12 0.00 3.22 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 244 S 8.27 4.30 0.00 3.95 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 * Residues marked with a * may have inaccurate shift predictions.