NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.1789 7.8827 121.4448 61.1998 38.6151 173.8047 17 V 4.2650 8.9473 126.2819 61.8660 32.7475 174.0592 18 G 4.0593 9.0262 115.7789 46.9899 0.0000 172.4738 19 G 4.4390 7.8307 112.2992 43.2638 0.0000 172.0129 20 Y 4.8697 7.5173 120.9749 55.6977 41.5281 174.2350 21 T 4.1671 8.6054 117.1764 64.1280 68.8928 175.5942 22 C 3.9462 8.5250 125.6870 60.3251 35.1715 175.6487 23 G 4.0096 7.7677 106.5564 44.7618 0.0000 172.7861 24 A 4.2489 8.3745 126.6916 53.7731 18.5168 176.9355 25 N 4.4700 8.9675 119.2571 54.4549 35.5956 175.5926 26 T 4.1555 7.5449 114.2757 64.7552 69.2099 175.5357 27 V 4.0222 7.1033 121.8169 59.0787 31.3177 173.4230 28 P 4.4863 0.0000 0.0000 63.9172 31.4942 178.0151 29 Y 5.3645 6.5142 114.6328 56.0480 38.7048 174.4779 30 Q 4.6563 7.3070 123.1091 56.1476 29.9204 175.2117 31 V 4.7887 8.9456 125.7947 61.1762 35.3119 173.7368 32 S 5.1573 8.7131 121.1518 56.5543 64.7790 172.5347 33 L 4.7171 8.2057 126.9642 53.3285 43.6539 175.0888 34 N 5.3091 8.9077 121.4990 49.9214 42.1501 175.0280 *37 S 4.3209 8.5069 122.1745 58.2375 64.1637 174.6380 38 G 3.9942 9.5638 109.5713 46.1430 0.0000 173.2292 39 Y 4.4684 6.9622 114.2053 56.0234 39.8207 172.5444 40 H 4.2745 9.1336 122.2717 57.2070 29.8014 174.4400 41 F 5.1262 7.8852 120.4050 56.9034 39.4188 174.2539 42 C 4.7601 6.9707 115.4462 56.2314 44.7638 173.2178 43 G 4.4388 8.4646 109.2930 45.3850 0.0000 172.1746 44 G 4.4051 8.2010 105.0490 46.4087 0.0000 172.5702 45 S 5.5608 8.7543 115.9102 56.4219 66.3381 173.5785 46 L 4.8283 9.2370 127.5518 54.6401 42.4279 177.0329 47 I 4.3772 8.7348 119.4310 61.0955 39.5524 174.5347 48 N 4.9090 7.6031 116.8018 52.1769 39.3752 174.4698 49 S 4.2264 8.8678 111.0772 60.9259 63.5576 175.1277 50 Q 4.5575 8.1788 118.1496 55.2763 30.2033 174.5990 51 W 5.5724 8.0707 118.2224 54.7383 33.3445 174.5096 52 V 5.1313 9.4496 123.0444 61.0621 34.6497 174.3915 53 V 5.0052 8.7699 126.2744 60.3852 34.3031 174.7741 54 S 5.1101 8.8625 116.9605 57.2944 66.3292 172.4474 55 A 4.6895 8.5024 121.5249 51.2837 19.5039 178.6523 56 A 3.8074 8.1901 123.6200 55.1569 18.4753 179.2459 57 H 4.6613 8.0755 108.5950 56.6593 28.6536 175.2265 58 C 4.7938 7.5018 116.9485 56.7568 40.4977 173.1599 59 Y 4.3241 7.7148 121.5944 58.3075 38.6456 175.5146 60 K 4.0130 7.5240 125.5989 55.0727 35.2395 174.6581 61 S 4.2665 7.9559 117.6492 57.4402 64.3354 173.5841 62 G 3.8430 8.2155 110.7025 46.5709 0.0000 173.7557 63 I 4.2657 7.1372 118.6788 60.2886 39.6775 176.3595 64 Q 4.8191 8.7737 127.9816 54.3556 31.3478 174.1185 65 V 4.5587 8.6869 126.6953 61.5493 33.8112 174.5460 66 R 5.1865 8.8819 126.5654 54.5865 32.8213 174.6764 67 L 4.8159 9.3598 124.4516 52.4973 45.1565 177.4663 *69 G 4.0271 8.3931 108.9458 45.3402 0.0000 172.8950 70 E 4.3103 8.2172 118.9910 55.8746 29.5786 175.0495 71 D 4.8900 8.1373 118.4486 55.2372 44.1801 174.8700 72 N 5.1810 9.0790 123.1497 52.5369 38.7377 176.2213 73 I 4.0040 8.2074 119.6155 62.0183 37.7728 176.4384 74 N 4.8010 8.2624 117.5331 53.2647 39.2578 175.1646 75 V 4.3959 7.4411 110.9937 59.2475 35.2238 175.7961 76 V 4.0858 8.3777 123.4288 62.5575 30.5685 175.4104 77 E 4.4051 9.2830 126.9574 55.5093 30.1850 176.5108 78 G 3.7459 7.6019 107.2878 45.6297 0.0000 174.6195 79 N 4.7754 7.9512 115.6050 52.9124 39.0632 174.7373 80 E 5.0661 7.7551 117.9781 56.0403 30.5863 176.1363 81 Q 4.5292 8.6104 120.9307 54.0710 32.3589 174.3429 82 F 5.6525 8.7338 122.0951 56.0507 41.0410 175.0288 83 I 4.6732 8.7612 124.8556 59.1714 40.9420 175.5259 84 S 4.5392 8.7467 122.7698 58.3842 63.9984 173.5525 85 A 4.5439 8.4707 126.4767 52.2301 18.2081 177.6848 86 S 4.4477 8.8554 116.6639 59.8353 64.6743 174.5571 87 K 4.6389 7.5548 119.6396 55.2314 35.3914 174.5679 88 S 5.3472 8.7811 121.5203 56.8952 66.7441 173.8088 89 I 4.6008 9.1421 123.7048 59.6753 40.2917 174.8651 90 V 4.2653 8.4756 127.2968 62.0857 32.8500 175.2204 91 H 4.0162 8.5949 126.4778 55.5106 30.1828 174.2492 92 P 4.2503 0.0000 0.0000 65.6734 30.8688 177.1261 93 S 4.7267 7.7755 112.0945 57.8507 63.0512 173.2470 94 Y 4.3601 7.9752 122.7468 57.8756 38.9473 174.5465 95 N 4.5385 8.3583 125.5914 51.5194 40.0014 174.8311 96 S 3.7735 7.7821 120.1538 59.5458 63.7389 175.3294 97 N 4.3171 8.2490 119.6119 56.4459 38.4206 176.4581 98 T 3.8704 7.8467 104.4454 61.1423 69.5122 174.5359 99 L 3.7876 7.9123 120.9308 55.4711 40.2482 173.9668 100 N 4.3500 7.7302 117.1067 54.9934 39.4629 174.6134 101 N 4.7254 8.7103 121.0544 54.0486 35.8826 175.6445 102 D 4.5895 7.8671 117.6992 52.8951 39.9028 174.8970 103 I 4.7943 7.1084 121.0515 59.4554 42.3750 172.6832 104 M 5.3474 9.0739 126.0446 54.3257 36.2819 173.1914 105 L 5.3743 9.5344 125.0364 53.1867 45.0482 175.5015 106 I 5.0211 9.3125 123.4665 59.5304 40.6634 174.3154 107 K 3.9457 8.5291 128.8769 54.7249 33.7734 175.2958 108 L 4.5829 8.3398 127.1430 53.5674 42.2559 177.1746 109 K 4.0939 8.8951 124.7453 59.0762 32.6629 177.1524 110 S 4.6252 7.7138 113.1285 56.1815 66.9503 173.2570 111 A 4.4154 8.3791 124.3647 51.7167 18.7753 177.5502 112 A 4.1828 9.0195 123.7273 52.2915 19.4728 177.0652 113 S 4.7336 8.8823 116.2949 56.8875 64.4766 174.0434 114 L 4.7655 8.4784 124.8901 53.3556 43.5523 175.9539 115 N 4.8060 8.7701 119.1073 52.2528 39.4138 174.7293 116 S 4.0428 8.9044 111.1452 61.3583 62.9054 175.0751 117 R 4.4071 7.9607 117.5386 55.4888 31.8648 175.1840 118 V 4.6040 7.4867 117.6782 60.8499 33.3288 173.8478 119 A 5.0730 8.6424 128.0505 50.3626 22.9588 175.3139 120 S 4.9902 8.7434 115.1841 58.4282 64.0837 173.5399 121 I 4.4808 8.2007 122.1514 59.1772 40.0312 175.5115 122 S 4.4482 8.4725 124.2159 58.0887 63.5684 174.3208 123 L 4.1761 8.4091 123.1789 53.4322 42.1958 175.2889 124 P 4.2031 0.0000 0.0000 63.9838 30.9429 176.4119 125 T 4.0112 8.3911 111.5144 63.1792 69.7051 174.4442 *127 S 4.3039 7.5739 114.4636 57.8453 63.2577 173.6324 128 C 4.4048 8.4357 121.7754 56.5479 40.6686 173.7863 129 A 4.2020 8.1666 126.3085 51.9528 18.9544 177.3540 130 S 4.3846 8.1412 114.9325 56.7452 65.1848 173.0679 *132 A 4.1990 8.1481 122.8707 53.1258 19.1113 177.1851 133 G 3.8749 9.1651 108.0613 46.0246 0.0000 174.0492 134 T 3.8482 7.4049 116.6995 64.2375 69.4389 173.4318 135 Q 4.2619 8.7061 125.9967 56.0441 29.6558 176.1852 136 C 5.2624 9.1863 120.5828 54.9378 45.9835 172.4468 137 L 5.1999 8.8706 122.5140 53.4382 44.3971 175.0054 138 I 5.1055 9.0351 127.1756 58.6111 39.8027 174.8490 139 S 5.0918 9.5462 120.9696 55.9342 66.3718 173.7604 140 G 3.8447 7.0835 106.3285 46.7911 0.0000 172.4267 141 W 4.5919 9.6478 118.7589 57.1654 30.5691 176.7083 142 G 3.9346 7.6775 105.7460 44.3551 0.0000 173.4768 143 N 3.3013 7.9158 119.4450 53.5703 39.1143 174.3031 144 T 4.9755 8.0946 114.3011 60.5914 69.3729 174.5046 145 K 4.6842 7.7791 120.8736 54.8094 35.2386 176.2833 146 S 4.3989 8.6267 116.1991 59.7843 63.7953 174.6298 147 S 4.5734 7.6581 116.0225 57.3962 65.7312 175.2237 148 G 3.8691 8.7984 113.5657 44.9379 0.0000 171.9901 149 T 4.4974 8.1988 114.6536 61.8512 71.5109 173.8111 150 S 4.5365 9.0032 122.0040 57.7920 65.6004 172.2213 151 Y 5.0280 8.9224 125.5724 55.7598 39.6106 173.8742 152 P 4.8653 0.0000 0.0000 62.1300 33.1782 175.1751 153 D 4.7799 8.8161 119.1718 55.1045 42.1582 176.9360 154 V 5.0498 7.4776 110.9033 58.5673 33.9232 175.8267 155 L 3.1915 8.2494 124.2158 55.3040 42.9904 175.9825 156 K 4.8902 8.6174 125.3846 54.8004 35.3755 174.5661 157 C 5.2808 8.3168 120.1939 55.1012 44.6074 172.7661 158 L 5.0542 8.6274 122.4000 53.5553 45.5704 174.9846 159 K 4.9861 9.0431 125.4104 55.5749 33.0198 175.8915 160 A 4.7221 8.6495 126.1595 49.4616 23.2977 173.4623 161 P 4.9304 0.0000 0.0000 61.9203 33.4934 175.3813 162 I 4.3956 8.1055 122.4618 61.2087 38.1555 175.7106 163 L 4.7200 8.7218 127.9299 53.5730 42.9839 177.1961 164 S 4.2818 8.5318 115.1292 58.2040 63.9351 174.7343 165 D 4.3916 8.8699 121.1523 57.9156 40.7656 178.8323 166 S 4.1523 8.1230 114.9853 61.6967 63.0479 176.2276 167 S 4.3483 7.5726 116.6460 59.5481 62.1352 175.1757 168 C 4.4023 8.2861 121.6337 59.8848 43.2682 175.7942 169 K 3.9707 8.5690 119.6674 59.1180 31.4752 179.2370 170 S 4.2445 8.4143 114.9701 61.5130 62.5756 176.5458 171 A 3.9836 7.4916 122.2278 53.1473 19.5663 177.0873 172 Y 4.6958 7.4024 116.1030 54.5816 37.8904 171.3696 173 P 4.4984 0.0000 0.0000 64.0043 31.7043 177.3127 174 G 4.0112 9.0481 110.5720 46.2847 0.0000 173.6051 175 Q 4.5338 8.1637 117.9323 55.2827 30.9651 175.7770 176 I 4.4025 7.9204 119.0607 60.0003 38.2485 175.5561 177 T 4.5245 8.2460 116.1064 59.6231 70.7970 175.3741 178 S 4.2059 8.6350 115.4074 60.9902 62.7807 174.7970 179 N 4.9599 8.3482 117.8196 53.1170 38.5443 173.7407 180 M 5.5965 7.9164 117.1937 53.5457 35.8966 174.5635 181 F 5.1883 8.8396 115.3934 55.5647 42.2545 172.7197 182 C 5.6198 8.9559 115.5454 55.5853 43.0067 172.9359 183 A 5.1410 9.1079 122.4033 48.9107 21.9720 173.3856 184A G 3.8475 6.9231 111.3619 44.6943 0.0000 175.2027 184 Y 4.8910 7.9500 121.8346 55.8537 41.4529 174.9804 185 L 4.3073 8.5956 122.0873 57.1525 42.3521 179.1347 186 E 3.8286 8.2459 115.5997 57.8204 29.4005 177.2625 187 G 3.8154 8.0972 104.3099 45.2344 0.0000 172.9901 188A G 3.9940 8.8592 104.4113 45.8088 0.0000 173.5755 188 K 5.3784 7.6263 117.2449 53.6693 35.5720 175.1827 189 D 4.6428 8.1628 121.7962 53.8588 44.4424 174.5152 190 S 5.0677 10.0654 117.3239 55.9354 66.2525 171.9619 191 C 5.3235 9.6255 121.7673 59.4903 32.8714 174.7602 192 Q 3.9865 8.9479 125.9765 57.2623 27.5919 175.5257 193 G 4.2863 7.6730 102.0743 44.0347 0.0000 171.1312 194 D 5.7676 8.2708 134.3087 53.6686 42.0230 175.9365 195 S 4.3269 7.9516 120.3628 60.3182 63.6256 176.0775 196 G 3.8723 9.4607 112.6239 45.0898 0.0000 173.8977 197 G 4.2400 7.7079 107.4279 44.8577 0.0000 171.4385 198 P 5.1457 0.0000 0.0000 62.4344 33.5151 175.6406 199 V 4.6108 8.5823 120.8284 61.4086 34.3977 174.1567 200 V 4.8300 8.7416 128.9536 61.2999 33.4308 173.6457 201 C 5.0686 8.8247 124.8844 55.7181 43.5681 174.6207 202 S 3.4265 9.6882 120.1823 59.6864 59.9207 173.0573 203 G 3.9855 8.5875 105.2972 45.3631 0.0000 172.9624 204 K 4.3139 7.5086 118.1368 54.3492 35.9686 175.4072 *209 L 4.2650 8.3566 123.6046 55.4221 42.1880 175.7844 210 Q 4.5244 8.4464 125.1089 56.5210 31.0779 175.3003 211 G 5.1998 8.3193 105.2729 46.3209 0.0000 171.6451 212 I 5.2836 8.1798 118.8629 59.2096 41.6650 175.2305 213 V 3.7378 8.9483 127.4139 63.9217 31.7960 174.6895 214 S 4.8002 8.4883 122.1762 59.0682 63.5767 174.6665 215 W 5.0196 6.9672 114.6211 56.5458 31.4198 171.7820 216 G 4.6067 8.7872 116.3755 46.1583 0.0000 172.8103 217 S 4.2934 8.2008 120.2448 58.6169 63.3909 173.6102 *219 G 4.2469 8.1177 114.7996 45.7098 0.0000 170.9486 220 C 4.7091 8.1867 115.6655 59.3271 32.0753 173.8740 221A A 3.7116 8.7126 125.5620 53.0920 16.6950 177.0507 221 Q 4.4013 7.4404 116.4478 56.2069 29.6926 176.3416 222 K 4.1496 8.5151 121.5498 58.0697 32.7252 176.5186 223 N 4.2273 10.9700 123.8284 54.0909 36.4238 176.4141 224 K 4.3652 7.6726 115.9393 54.1140 33.9757 174.9696 225 P 4.5237 0.0000 0.0000 61.8115 32.7471 177.3381 226 G 3.4618 8.5185 106.4226 46.2974 0.0000 172.4899 227 V 4.4587 7.6729 122.6548 60.7458 34.4221 174.0530 228 Y 4.9475 8.0423 123.1300 56.0491 42.4318 174.8826 229 T 4.3439 8.7211 120.5311 63.7913 69.9284 173.9770 230 K 4.6842 9.4050 128.3332 55.5476 31.8224 177.2723 231 V 4.0348 8.7764 127.0777 65.5272 31.3847 174.7667 232 C 4.1022 8.5216 113.2750 58.9977 41.1606 175.3129 233 N 4.1919 7.9591 116.2528 54.6122 38.3605 175.1590 234 Y 4.8837 7.9775 117.5939 57.5560 39.2304 177.6883 235 V 3.7403 7.9266 121.7737 66.0317 31.5594 178.1471 236 S 4.1484 8.0783 114.6108 61.3868 62.8351 176.2621 237 W 4.1985 8.3245 130.5729 60.3906 30.3347 177.9122 238 I 3.1416 8.3189 120.0325 64.2990 36.1136 178.6709 239 K 3.8254 8.0413 119.2124 59.1904 31.8278 179.3551 240 Q 3.8776 7.9443 120.1039 59.4080 28.7705 178.2900 241 T 3.6695 7.3032 115.7598 66.0240 68.6836 176.3434 242 I 2.7400 6.8638 121.3771 63.0599 37.0775 178.0568 243 A 4.0870 7.2091 120.1183 54.6120 18.2619 178.8620 244 S 4.5114 7.6263 111.2416 58.9872 63.1269 174.1572 245 N 4.7013 7.8166 124.4858 53.5058 39.3162 174.0755 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 4.18 1.79 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 1.25 1.15 0.92 0.00 0.00 17 V 8.95 4.27 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 1.09 0.00 0.00 0.98 0.00 0.00 18 G 9.03 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 19 G 7.83 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 20 Y 7.52 4.87 0.00 3.07 3.04 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 21 T 8.61 4.17 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 1.22 0.00 0.00 22 C 8.53 3.95 0.00 2.73 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 23 G 7.77 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 24 A 8.37 4.25 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 N 8.97 4.47 0.00 2.92 3.01 0.00 0.00 7.21 7.54 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 26 T 7.54 4.16 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 27 V 7.10 4.02 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 0.41 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.49 0.00 2.26 2.28 0.00 3.73 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.96 0.00 29 Y 6.51 5.36 0.00 3.23 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 Q 7.31 4.66 0.00 1.81 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.66 0.00 0.00 0.00 0.00 0.00 2.03 2.45 0.00 31 V 8.95 4.79 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 0.92 0.00 0.00 1.00 0.00 0.00 32 S 8.71 5.16 0.00 3.09 3.31 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 33 L 8.21 4.72 0.00 0.55 1.11 0.77 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 34 N 8.91 5.31 0.00 2.45 2.47 0.00 0.00 6.79 7.15 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 *37 S 8.51 4.32 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 38 G 9.56 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 0.00 0.00 0.00 39 Y 6.96 4.47 0.00 2.97 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 40 H 9.13 4.27 0.00 2.87 3.24 0.00 5.86 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.89 5.13 0.00 3.06 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 42 C 6.97 4.76 0.00 2.20 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 43 G 8.46 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 8.20 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 0.00 0.00 0.00 0.00 45 S 8.75 5.56 0.00 3.82 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.24 4.83 0.00 1.85 1.67 1.07 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 47 I 8.73 4.38 1.89 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.92 0.98 0.00 0.00 48 N 7.60 4.91 0.00 2.95 3.01 0.00 0.00 6.04 8.07 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 49 S 8.87 4.23 0.00 4.20 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 50 Q 8.18 4.56 0.00 2.19 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.01 6.88 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 51 W 8.07 5.57 0.00 3.11 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 52 V 9.45 5.13 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 0.97 0.00 0.00 0.98 0.00 0.00 53 V 8.77 5.01 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 1.01 0.00 0.00 54 S 8.86 5.11 0.00 3.89 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 55 A 8.50 4.69 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 56 A 8.19 3.81 0.11 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 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.08 4.66 0.00 3.41 3.60 0.00 5.55 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 C 7.50 4.79 0.00 3.18 3.38 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 59 Y 7.71 4.32 0.00 2.90 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 60 K 7.52 4.01 0.00 1.30 1.21 0.00 0.61 0.00 0.00 1.01 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.92 0.91 7.81 61 S 7.96 4.27 0.00 3.70 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 62 G 8.22 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 I 7.14 4.27 1.86 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 1.41 0.92 0.90 0.00 0.00 64 Q 8.77 4.82 0.00 2.02 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.82 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 65 V 8.69 4.56 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 0.98 0.00 0.00 0.89 0.00 0.00 66 R 8.88 5.19 0.00 1.65 1.87 0.00 2.71 0.00 0.00 2.65 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.26 0.00 67 L 9.36 4.82 0.00 1.57 1.61 0.96 0.77 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 *69 G 8.39 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 70 E 8.22 4.31 0.00 2.31 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 0.00 2.54 2.21 0.00 71 D 8.14 4.89 0.00 2.78 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 72 N 9.08 5.18 0.00 2.84 2.81 0.00 0.00 7.15 7.39 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 73 I 8.21 4.00 1.49 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 1.29 0.97 -0.16 0.00 0.00 74 N 8.26 4.80 0.00 2.92 2.90 0.00 0.00 6.72 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 75 V 7.44 4.40 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 0.70 0.00 0.00 0.96 0.00 0.00 76 V 8.38 4.09 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 0.75 0.00 0.00 1.00 0.00 0.00 77 E 9.28 4.41 0.00 2.02 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 2.29 2.49 0.00 78 G 7.60 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 79 N 7.95 4.78 0.00 2.71 2.83 0.00 0.00 6.97 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 80 E 7.76 5.07 0.00 1.37 1.47 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 2.58 2.43 0.00 81 Q 8.61 4.53 0.00 1.98 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.85 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 82 F 8.73 5.65 0.00 2.83 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 83 I 8.76 4.67 1.88 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 1.24 0.85 0.95 0.00 0.00 84 S 8.75 4.54 0.00 3.74 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 85 A 8.47 4.54 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 S 8.86 4.45 0.00 3.77 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 87 K 7.55 4.64 0.00 1.77 1.52 0.00 1.71 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.48 1.51 7.81 88 S 8.78 5.35 0.00 3.96 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 89 I 9.14 4.60 2.02 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.98 1.10 0.00 0.00 90 V 8.48 4.27 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 0.70 0.00 0.00 0.82 0.00 0.00 91 H 8.59 4.02 0.00 2.91 2.91 0.00 5.67 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 92 P 0.00 4.25 0.00 2.16 2.20 0.00 2.44 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.92 0.00 93 S 7.78 4.73 0.00 4.04 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 94 Y 7.98 4.36 0.00 2.99 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 95 N 8.36 4.54 0.00 2.62 2.49 0.00 0.00 6.63 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 96 S 7.78 3.77 0.00 3.91 3.53 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 97 N 8.25 4.32 0.00 2.79 2.78 0.00 0.00 6.93 7.21 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 98 T 7.85 3.87 4.10 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 1.10 0.00 0.00 99 L 7.91 3.79 0.00 1.49 1.83 0.52 1.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.73 4.35 0.00 2.78 2.68 0.00 0.00 7.24 6.03 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 0.00 101 N 8.71 4.73 0.00 2.94 2.60 0.00 0.00 7.22 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 0.00 102 D 7.87 4.59 0.00 3.02 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 7.11 4.79 1.52 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 1.40 1.32 0.22 0.00 0.00 104 M 9.07 5.35 0.00 2.18 1.81 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.63 0.00 105 L 9.53 5.37 0.00 1.68 1.86 0.98 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.31 5.02 1.93 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.76 0.88 0.00 0.00 107 K 8.53 3.95 0.00 0.79 1.02 0.00 1.02 0.00 0.00 1.31 0.00 0.00 2.60 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.80 0.21 7.81 108 L 8.34 4.58 0.00 1.46 1.64 0.94 1.06 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 0.00 109 K 8.90 4.09 0.00 1.80 1.80 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.38 7.81 110 S 7.71 4.63 0.00 3.81 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.38 4.42 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 0.00 112 A 9.02 4.18 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 0.00 113 S 8.88 4.73 0.00 3.76 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 0.00 114 L 8.48 4.77 0.00 1.64 1.61 0.95 1.05 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 0.00 115 N 8.77 4.81 0.00 2.84 2.92 0.00 0.00 6.54 8.38 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 0.00 116 S 8.90 4.04 0.00 4.00 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 0.00 117 R 7.96 4.41 0.00 1.87 1.97 0.00 3.06 0.00 0.00 3.31 7.36 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.57 4.30 0.00 3.83 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 0.00 128 C 8.44 4.40 0.00 2.95 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 0.00 129 A 8.17 4.20 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 0.00 130 S 8.14 4.38 0.00 4.00 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 *132 A 8.15 4.20 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 0.00 133 G 9.17 3.87 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 0.00 0.00 0.00 134 T 7.40 3.85 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 1.14 0.00 0.00 135 Q 8.71 4.26 0.00 1.93 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.84 6.80 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 136 C 9.19 5.26 0.00 2.86 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 0.00 137 L 8.87 5.20 0.00 1.75 1.53 0.96 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.04 5.11 1.86 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 0.69 1.15 0.97 0.00 0.00 139 S 9.55 5.09 0.00 3.56 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 0.00 140 G 7.08 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 9.65 4.59 0.00 3.36 3.01 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 0.00 142 G 7.68 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 0.00 143 N 7.92 3.30 0.00 2.16 2.53 0.00 0.00 7.00 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 0.00 144 T 8.09 4.98 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 1.24 0.00 0.00 145 K 7.78 4.68 0.00 1.69 1.88 0.00 1.74 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.30 1.32 7.81 146 S 8.63 4.40 0.00 3.99 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 0.00 147 S 7.66 4.57 0.00 3.84 3.78 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 0.00 148 G 8.80 3.87 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 0.00 0.00 0.00 149 T 8.20 4.50 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 1.48 0.00 0.00 150 S 9.00 4.54 0.00 3.91 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 Y 8.92 5.03 0.00 2.88 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 0.00 152 P 0.00 4.87 0.00 2.13 2.08 0.00 4.06 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.01 0.00 153 D 8.82 4.78 0.00 2.79 3.01 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 0.00 154 V 7.48 5.05 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 0.96 0.00 0.00 0.97 0.00 0.00 155 L 8.25 3.19 0.00 1.69 1.24 0.56 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.62 4.89 0.00 1.73 1.47 0.00 1.65 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.38 7.81 157 C 8.32 5.28 0.00 1.65 2.38 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 0.00 158 L 8.63 5.05 0.00 1.69 1.44 1.14 1.20 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 0.00 159 K 9.04 4.99 0.00 1.83 1.83 0.00 1.89 0.00 0.00 1.76 0.00 0.00 2.77 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.55 7.81 160 A 8.65 4.72 0.98 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 0.00 161 P 0.00 4.93 0.00 2.08 2.14 0.00 3.37 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.79 0.00 162 I 8.11 4.40 1.73 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.38 0.83 0.00 0.00 163 L 8.72 4.72 0.00 1.56 1.62 0.94 0.84 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 0.00 164 S 8.53 4.28 0.00 4.01 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 0.00 165 D 8.87 4.39 0.00 2.80 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 0.00 166 S 8.12 4.15 0.00 3.92 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 0.00 167 S 7.57 4.35 0.00 4.06 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 0.00 168 C 8.29 4.40 0.00 3.24 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 K 8.57 3.97 0.00 1.76 1.92 0.00 2.02 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.56 1.75 7.81 170 S 8.41 4.24 0.00 4.03 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 0.00 171 A 7.49 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.40 4.70 0.00 3.16 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 0.00 173 P 0.00 4.50 0.00 2.21 2.13 0.00 3.98 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.99 0.00 174 G 9.05 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 0.00 175 Q 8.16 4.53 0.00 2.50 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.19 6.62 0.00 0.00 0.00 0.00 0.00 2.28 2.56 0.00 176 I 7.92 4.40 2.00 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 1.73 0.98 1.01 0.00 0.00 177 T 8.25 4.52 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 1.26 0.00 0.00 178 S 8.64 4.21 0.00 4.00 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 0.00 179 N 8.35 4.96 0.00 2.92 3.10 0.00 0.00 6.58 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 0.00 180 M 7.92 5.60 0.00 1.89 1.99 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.59 0.00 181 F 8.84 5.19 0.00 3.09 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 0.00 182 C 8.96 5.62 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 0.00 183 A 9.11 5.14 1.11 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 0.00 0.00 0.00 0.00 0.00 0.00 184A G 6.92 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 0.00 184 Y 7.95 4.89 0.00 2.94 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 0.00 185 L 8.60 4.31 0.00 1.75 1.72 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.25 3.83 0.00 2.08 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 0.00 2.30 2.32 0.00 187 G 8.10 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 188A G 8.86 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 0.00 0.00 0.00 188 K 7.63 5.38 0.00 1.95 1.95 0.00 1.81 0.00 0.00 2.47 0.00 0.00 2.74 0.00 0.00 2.50 0.00 0.00 0.00 0.00 1.35 1.22 7.81 189 D 8.16 4.64 0.00 2.76 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 S 10.07 5.07 0.00 3.91 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 0.00 191 C 9.63 5.32 0.00 3.02 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 0.00 192 Q 8.95 3.99 0.00 2.23 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.07 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 193 G 7.67 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 0.00 0.00 0.00 0.00 194 D 8.27 5.77 0.00 2.99 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 0.00 195 S 7.95 4.33 0.00 4.07 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 0.00 196 G 9.46 3.87 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 0.00 0.00 0.00 197 G 7.71 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 0.00 198 P 0.00 5.15 0.00 2.30 2.32 0.00 3.70 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 2.24 2.21 0.00 199 V 8.58 4.61 1.87 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 0.80 0.00 0.00 0.72 0.00 0.00 200 V 8.74 4.83 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 0.93 0.00 0.00 0.61 0.00 0.00 201 C 8.82 5.07 0.00 2.80 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 0.00 202 S 9.69 3.43 0.00 3.90 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 203 G 8.59 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 0.00 0.00 0.00 204 K 7.51 4.31 0.00 1.90 1.59 0.00 1.72 0.00 0.00 1.54 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.36 7.81 *209 L 8.36 4.27 0.00 1.50 1.63 0.94 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 210 Q 8.45 4.52 0.00 1.97 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.37 0.00 0.00 0.00 0.00 0.00 2.50 2.19 0.00 211 G 8.32 5.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 I 8.18 5.28 1.92 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 1.28 0.78 0.99 0.00 0.00 213 V 8.95 3.74 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 1.01 0.00 0.00 1.18 0.00 0.00 214 S 8.49 4.80 0.00 3.99 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 0.00 215 W 6.97 5.02 0.00 3.29 2.95 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 0.00 216 G 8.79 4.61 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 0.00 217 S 8.20 4.29 0.00 4.39 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 *219 G 8.12 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 0.00 220 C 8.19 4.71 0.00 2.94 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 221A A 8.71 3.71 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 0.00 221 Q 7.44 4.40 0.00 2.25 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 222 K 8.52 4.15 0.00 1.71 1.73 0.00 1.93 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.68 7.81 223 N 10.97 4.23 0.00 2.86 2.78 0.00 0.00 6.83 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 224 K 7.67 4.37 0.00 1.82 1.76 0.00 1.23 0.00 0.00 1.48 0.00 0.00 3.00 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.34 1.56 7.81 225 P 0.00 4.52 0.00 2.22 2.08 0.00 3.61 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 1.97 0.00 226 G 8.52 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.67 4.46 0.74 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 0.44 0.00 0.00 -0.49 0.00 0.00 228 Y 8.04 4.95 0.00 1.43 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 0.00 0.00 0.00 229 T 8.72 4.34 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 1.20 0.00 0.00 230 K 9.41 4.68 0.00 2.10 1.90 0.00 1.92 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.52 1.67 7.81 231 V 8.78 4.03 2.22 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 1.26 0.00 0.00 1.05 0.00 0.00 232 C 8.52 4.10 0.00 3.16 3.25 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 0.00 233 N 7.96 4.19 0.00 2.28 2.33 0.00 0.00 6.84 8.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 234 Y 7.98 4.88 0.00 3.19 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 0.00 235 V 7.93 3.74 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 1.14 0.00 0.00 1.08 0.00 0.00 236 S 8.08 4.15 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 0.00 237 W 8.32 4.20 0.00 3.39 3.44 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 0.00 238 I 8.32 3.14 1.89 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.26 0.72 0.00 0.00 239 K 8.04 3.83 0.00 1.83 1.77 0.00 1.63 0.00 0.00 1.55 0.00 0.00 2.87 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.49 7.81 240 Q 7.94 3.88 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 241 T 7.30 3.67 3.34 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 0.71 0.00 0.00 242 I 6.86 2.74 1.39 0.00 0.00 -5.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.24 0.10 0.44 0.00 0.00 243 A 7.21 4.09 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 0.00 244 S 7.63 4.51 0.00 3.85 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 0.00 245 N 7.82 4.70 0.00 3.22 2.94 0.00 0.00 6.75 7.44 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 * Residues marked with a * may have inaccurate shift predictions.