NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1445 8.0249 114.2796 59.7221 38.8864 175.2477 2 P 4.2838 0.0000 0.0000 61.6118 31.9736 173.2935 3 E 4.0752 9.6071 121.9988 58.5773 30.8309 175.7659 4 Y 4.6108 7.6852 114.7657 55.8100 41.0277 175.5765 5 V 3.9210 8.0792 123.1494 60.9171 35.2836 173.7529 6 D 4.7634 8.0526 126.1901 52.2163 43.3013 175.4764 7 W 4.3970 9.2311 127.4344 59.1953 29.6917 179.3097 8 R 4.0841 8.8438 120.1128 59.3154 29.2523 178.8650 9 Q 4.0202 8.0087 116.6557 58.4292 28.7755 177.8758 10 K 4.3911 7.8216 116.4770 56.0398 32.3715 177.2211 11 G 3.8638 8.1902 107.2753 46.3757 0.0000 174.1781 12 A 4.6758 8.7163 120.6006 51.2717 19.4558 177.1847 13 V 4.3873 7.5625 116.4872 61.6064 34.1418 175.4956 14 T 4.3839 8.4478 117.1294 59.7310 70.0923 172.3499 15 P 4.3937 0.0000 0.0000 62.8411 31.9048 176.4699 16 V 3.8631 8.2025 119.9939 63.0483 32.4165 175.1818 17 K 4.7255 8.5683 124.9146 54.5892 36.2047 174.0943 18 N 5.3539 8.3946 119.6481 51.9663 40.7650 174.3350 19 Q 3.4388 8.9483 125.1219 56.4015 29.9812 177.4488 20 G 3.9303 8.0694 107.5011 46.3547 0.0000 174.7748 21 S 4.6162 8.4555 111.3326 57.5285 62.9449 175.2634 22 C 4.9197 7.7124 117.5209 55.9647 42.8306 174.6724 23 G 3.9215 9.2319 118.9216 44.2006 0.0000 173.3652 24 S 4.3807 7.6304 115.6361 56.4899 63.2873 175.2604 *26 W 4.7334 8.1882 125.2519 56.6946 30.1827 178.1005 27 A 3.5711 7.0580 120.8498 54.1484 17.9104 179.5719 28 F 3.5570 7.6926 115.8004 60.4660 39.0640 177.5760 29 S 4.0325 8.0526 111.9523 61.4339 62.3293 175.7673 30 A 4.1089 7.7821 122.9702 55.3446 18.0654 179.8165 31 V 3.5422 7.8519 116.6685 66.0107 31.5570 178.5688 32 V 3.6947 7.8211 112.5978 64.7298 31.4375 178.6492 33 T 3.9292 7.6257 108.0219 64.6910 68.5452 176.8295 34 I 3.6523 7.8503 122.5823 64.2761 37.2341 177.9267 35 E 4.3408 8.7557 120.0393 59.5789 29.3138 179.8067 36 G 3.4501 8.1485 105.3737 48.7975 0.0000 175.6942 37 I 3.6764 7.7857 121.7861 63.2820 37.8911 178.0744 38 I 3.7480 7.8703 121.0497 63.9740 36.8692 178.1594 39 K 4.3494 7.9294 121.7646 59.0934 31.8538 178.6769 40 I 3.6849 7.4529 118.4672 64.7562 37.1610 178.3571 41 R 4.1787 8.2765 117.5590 58.1608 30.0852 178.0574 42 T 4.4693 8.5227 108.3370 60.9381 70.3426 175.7267 43 G 3.9871 8.5758 109.3575 44.9746 0.0000 172.7402 44 N 4.7367 8.2577 118.2249 51.5857 39.9000 173.7550 45 L 4.6961 8.4181 124.8307 53.6958 42.7827 174.8528 46 N 5.0364 8.4887 122.2709 51.4905 42.6233 173.5707 47 Q 5.2693 8.0335 118.1584 53.9674 31.3992 174.6263 48 Y 5.3760 8.5709 119.3310 56.1231 41.7342 175.0270 49 S 4.4061 8.5515 115.1521 57.5012 62.9859 174.8365 50 E 3.4504 8.3987 128.2277 59.1322 29.0612 178.9135 51 Q 3.9732 7.8077 119.3119 59.0528 29.1808 177.6805 52 E 3.0073 7.5458 120.3215 58.7973 29.5177 178.9164 53 L 3.9133 7.1822 118.7345 57.4289 41.4694 178.7797 54 L 4.0816 7.4294 119.2742 58.6642 42.0010 178.6725 55 D 4.6260 8.1715 117.3133 56.9624 40.9679 177.2477 56 C 4.8631 7.8642 114.0860 56.0011 40.9223 173.4142 57 D 4.5614 8.5224 121.6594 53.4286 40.0485 176.0907 58 R 4.4779 8.2657 124.7689 56.2027 30.3853 177.9803 59 R 3.9283 7.9805 118.9208 58.1343 30.3275 176.9750 60 S 3.4480 6.8072 112.1577 57.1722 64.4090 173.0880 61 Y 4.8212 7.3049 117.3572 58.2701 39.4710 178.6746 62 G 4.0021 8.0474 114.3764 47.3441 0.0000 176.3218 63 C 4.7949 9.1125 122.3094 57.8841 39.8392 173.6534 64 N 4.9423 8.4995 116.9660 52.8678 38.5931 175.1352 65 G 3.9867 8.4391 105.4174 44.5171 0.0000 173.1374 66 G 2.0111 6.3991 104.3517 44.2736 0.0000 171.4316 67 Y 4.4055 6.3856 116.8092 55.0066 40.5935 175.1669 68 P 4.4024 0.0000 0.0000 65.2736 31.5793 178.7684 69 W 3.6521 7.6988 115.2336 59.0969 27.9386 178.3602 70 S 3.7977 6.5086 113.4499 60.8841 61.7915 175.6954 71 A 4.0572 7.9131 123.5287 55.1815 18.1975 179.6650 72 L 3.9208 8.1708 117.8407 57.8397 41.6744 179.4500 73 Q 3.9309 8.0870 119.6680 58.9500 28.9915 178.0237 74 L 4.1167 7.9646 121.4846 58.2568 42.2627 179.2071 75 V 3.8389 7.8007 117.8672 65.6063 31.1709 177.8310 76 A 4.3361 7.5587 121.0492 53.9219 18.2039 179.3481 77 Q 3.8013 7.5432 116.0294 58.4796 29.1358 176.7146 78 Y 4.3543 8.0446 114.6950 61.6941 39.7089 174.6448 79 G 3.7128 7.1851 101.9700 44.6006 0.0000 172.1948 80 I 4.7905 8.0725 118.0184 59.7907 42.0749 175.2887 81 H 5.0553 10.0939 125.2116 54.7595 31.0855 174.3951 82 Y 4.7365 8.2497 117.1872 58.3020 38.4170 177.6537 83 R 3.9417 9.0825 123.0579 59.7821 29.9426 178.4259 84 N 4.3069 8.3232 115.5644 56.9621 38.9323 176.1102 85 T 4.3769 7.8118 108.9992 62.8109 70.6970 174.6566 86 Y 4.8506 7.4110 121.9877 55.3566 39.0126 172.3827 87 P 4.6907 0.0000 0.0000 62.0186 33.2102 176.4628 88 Y 4.5710 8.5451 120.7825 57.7603 38.0936 175.7950 89 E 4.2305 9.5103 125.4762 55.2171 31.7741 177.5836 90 G 3.8161 7.3068 105.4520 44.6192 0.0000 173.2064 91 V 4.4198 6.7980 115.3753 60.6537 34.7178 174.3431 92 Q 4.2285 8.6443 127.6850 55.9809 29.6690 175.0510 93 R 4.8434 8.6398 123.5583 54.3196 33.8103 174.3283 94 Y 4.0463 8.5323 118.9261 58.0817 39.2305 176.4547 95 C 4.4338 7.6539 126.2004 56.6468 39.5485 173.2426 96 R 4.6214 8.8771 124.9471 56.1397 30.5371 177.8476 97 S 4.3545 8.4049 116.2926 62.2439 62.2570 176.5540 98 R 3.8763 8.1138 119.6629 59.6310 29.6735 178.0628 99 E 4.2157 7.7236 114.2901 56.9673 29.6355 177.3443 100 K 4.1693 8.0869 117.7984 55.6184 33.0965 176.5818 101 G 3.8323 7.3757 105.8642 43.5442 0.0000 171.4698 102 P 4.1968 0.0000 0.0000 62.6810 31.7243 176.3201 103 Y 3.9677 8.0759 117.5626 58.1858 38.4208 175.7295 104 A 4.4374 8.5523 123.2630 53.1689 20.1549 177.1361 105 A 4.6128 7.5412 115.2802 50.9924 22.8690 175.0407 106 K 4.8006 8.2628 119.1441 55.4498 35.4986 175.0511 107 T 4.5267 8.3134 115.7047 60.2108 72.1754 173.8051 108 D 4.8128 10.3385 119.1854 53.2926 41.8670 178.2029 109 G 3.8572 6.7901 106.5783 45.4522 0.0000 171.5714 110 V 4.8328 7.5298 118.0662 60.3305 34.5214 174.6400 111 R 4.6468 8.5944 120.9441 54.4622 34.5688 173.7064 112 Q 4.4526 8.3320 121.7789 54.2818 30.9727 175.4833 113 V 4.0836 8.3387 119.6112 60.3270 32.8650 176.0621 114 Q 3.7998 8.7187 124.5801 56.1307 29.1259 175.1364 115 P 4.3295 0.0000 0.0000 62.9554 32.3039 174.6204 116 Y 4.5546 8.0927 113.3159 58.0768 36.0862 171.4001 117 N 4.6887 7.7430 117.1940 51.0639 41.7505 172.9731 118 Q 2.9951 8.3822 129.6829 58.6971 29.2994 177.8600 119 G 3.5623 7.9339 106.0096 47.9810 0.0000 175.2432 120 A 3.9794 8.6802 124.1370 54.3527 18.3493 179.4357 121 L 3.8487 7.5573 118.3446 58.4572 42.2259 179.3586 122 L 3.7564 7.7832 118.8210 57.7272 41.1758 178.9259 123 Y 4.0130 7.8583 118.9309 60.4825 38.9773 177.6706 124 S 4.0889 8.0883 115.8912 61.7668 63.1573 176.4637 125 I 4.3161 8.1830 123.3566 64.0035 36.7257 178.2610 126 A 4.2972 8.2066 120.1850 54.5483 18.1672 178.4221 127 N 4.7762 7.7135 113.9779 53.6641 40.0034 174.7350 128 Q 3.5287 6.8796 114.8201 54.3085 31.5546 171.0483 129 P 4.7336 0.0000 0.0000 62.7690 32.1387 176.2755 130 V 4.6489 8.5590 122.0291 61.1786 35.5140 174.0296 131 S 5.1627 9.1223 121.4110 57.6654 63.7470 173.3771 132 V 5.1547 8.7570 119.0639 59.9252 36.5197 174.6563 133 V 5.4005 7.9378 112.3397 59.1876 35.4817 174.6144 134 L 4.7387 7.8444 120.5095 54.9694 43.6494 173.4267 135 Q 4.5398 9.0891 122.1970 55.8350 28.8204 175.3886 136 A 3.6686 9.4883 129.0252 51.6992 20.1913 177.1102 137 A 4.1997 7.5678 118.1898 54.0700 18.9612 179.2572 138 G 3.9055 7.9822 103.1341 44.5591 0.0000 174.7917 139 K 4.1806 8.7800 122.6393 59.3421 31.9163 179.6110 140 D 4.5760 8.2143 118.1801 57.3507 41.0847 178.0115 141 F 3.8202 8.5429 120.7118 61.4196 39.2900 176.9675 142 Q 4.6349 8.4670 116.5189 58.6817 28.5894 177.9057 143 L 4.6227 7.8800 117.0845 53.6174 42.5721 176.0874 144 Y 4.1416 7.5625 122.3537 57.7962 39.0491 176.2412 145 R 4.0339 8.7852 123.0094 54.7440 32.1036 174.9823 146 G 3.7109 6.7729 106.7886 44.3750 0.0000 172.7965 147 G 3.9439 9.0083 107.0690 44.6782 0.0000 173.1861 148 I 4.2436 7.9243 119.5646 60.4683 37.7185 175.7469 149 F 4.5050 9.6629 129.4125 57.4503 39.7514 175.9586 150 V 4.1218 7.9403 125.5545 60.9938 32.3329 176.0032 151 G 3.5110 5.5778 106.6937 43.4746 0.0000 171.4509 152 P 4.4227 0.0000 0.0000 62.9696 32.0170 174.4149 153 C 5.0396 8.1712 111.6197 55.2435 45.1847 174.6322 154 G 4.0042 8.6437 114.1107 45.8190 0.0000 174.9086 155 N 5.0588 8.4597 120.4364 53.1446 40.2565 175.7174 156 K 4.3247 7.8676 119.1343 54.5528 30.6985 176.1570 157 V 3.9629 7.5955 113.5663 61.9053 32.2614 176.4432 158 D 4.8379 9.0244 121.1928 53.5455 42.1953 174.4914 159 H 4.9928 8.1482 118.8111 54.6978 33.5906 171.3276 160 A 5.1749 8.4286 126.4665 50.5663 21.2205 175.9938 161 V 4.4982 8.7933 114.1997 59.9026 37.2630 173.6354 162 A 5.2098 8.5050 121.4551 50.4121 22.1844 175.1838 163 A 4.9928 9.3425 124.9497 50.9676 20.4207 177.8522 164 V 4.5098 9.4642 115.4021 60.4208 33.9870 175.6812 165 G 4.5457 7.8453 108.1460 47.3038 0.0000 171.0489 166 Y 5.0003 7.7967 116.8883 56.7219 41.6753 173.6006 167 G 3.3317 7.5817 105.6179 44.4419 0.0000 171.4694 168 P 4.2015 0.0000 0.0000 65.1499 31.4692 177.0172 169 N 5.2496 8.0354 112.2177 52.3244 39.1464 173.2144 170 Y 5.4908 7.5116 117.0026 56.3946 42.3576 173.4734 171 I 4.9193 9.1089 120.6340 59.4764 40.7411 174.5406 172 L 5.1047 9.4173 129.4084 54.1900 43.5278 175.0179 173 I 5.1195 9.1218 127.7936 59.4783 40.2137 174.5060 174 K 4.1666 9.3490 128.9025 55.2503 33.3299 175.7025 175 N 4.9051 8.2656 126.7600 51.7922 41.0740 174.0844 176 S 4.7194 7.5838 113.0760 57.5386 63.1351 174.8503 177 W 4.8414 7.8568 115.3047 57.3709 29.7057 177.7720 178 G 4.0162 8.0829 110.0435 44.6863 0.0000 175.3624 179 T 4.0039 8.3237 107.4709 64.3431 68.9655 176.2485 180 G 3.9495 8.1492 108.3505 45.7638 0.0000 172.7466 181 W 4.8240 7.7566 129.8559 56.1406 34.2403 175.7492 182 G 3.0282 7.1291 112.0307 46.2964 0.0000 175.5169 183 E 4.2274 8.6391 114.8226 55.8109 28.0346 175.7701 184 N 4.7714 8.6855 120.4037 53.5338 36.6443 175.6229 185 G 4.1586 8.9326 106.7503 44.9455 0.0000 173.3117 186 Y 5.2402 7.9180 116.7324 56.3121 41.3387 174.5159 187 I 4.9551 8.9984 120.6131 59.4826 42.1619 174.1182 188 R 5.1297 8.4980 127.4187 54.9923 31.7948 175.1234 189 I 4.9529 8.8232 126.0025 59.0708 39.4827 175.4723 190 K 4.6155 9.1778 128.8266 57.3478 32.7137 175.5948 191 R 4.7260 8.1961 121.8046 54.3064 33.1127 174.5174 192 G 3.8687 8.3470 103.6116 47.4249 0.0000 174.4997 193 T 4.3172 8.2977 107.6541 60.6268 69.6338 175.3737 194 G 3.9150 8.2502 110.4623 45.4818 0.0000 173.2150 195 N 4.4706 7.7074 118.9111 53.3392 39.4701 175.9141 196 S 4.3413 8.5566 122.4084 61.7863 63.4504 176.2537 197 Y 4.3950 7.3692 118.4455 59.0336 38.0952 177.4493 198 G 3.3672 7.6760 102.2811 44.8364 0.0000 173.0549 199 V 3.8630 7.8314 113.0693 62.5902 32.2180 177.4499 200 C 4.9487 9.1429 120.6105 57.0995 35.3940 173.4580 201 G 4.1298 7.9662 103.6572 46.4186 0.0000 176.6123 202 L 4.6524 7.3982 122.7827 56.7864 42.4061 176.8830 203 Y 5.0011 8.1744 116.3985 58.4461 38.2989 178.2348 204 T 3.4542 7.6967 117.8958 66.1224 68.9751 175.6882 205 S 4.3010 7.6439 120.0784 57.5329 65.1046 172.4469 206 S 5.7978 8.2090 122.9445 55.9173 66.7788 173.3830 207 F 5.3580 8.7259 121.3868 56.2732 43.8606 172.8835 208 Y 5.2019 8.1473 115.9630 55.4411 41.1523 172.4533 209 P 4.8783 0.0000 0.0000 62.9655 32.8576 175.3251 210 V 4.5606 8.2679 120.4339 61.1025 34.1853 174.4014 211 K 4.8810 8.4435 127.9484 54.7976 34.9951 175.5509 212 N 4.5499 9.2302 124.3590 53.6529 38.4767 174.9398 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 I 8.02 4.14 1.96 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 1.47 1.18 0.91 0.00 0.00 2 P 0.00 4.28 0.00 2.24 1.99 0.00 3.74 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 1.90 2.07 0.00 3 E 9.61 4.08 0.00 2.01 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 1.98 2.22 0.00 4 Y 7.69 4.61 0.00 2.77 2.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 8.08 3.92 0.89 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 0.44 0.00 0.00 0.56 0.00 0.00 6 D 8.05 4.76 0.00 2.62 2.36 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 7 W 9.23 4.40 0.00 3.53 3.20 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 8 R 8.84 4.08 0.00 1.91 2.00 0.00 2.92 0.00 0.00 2.29 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.77 0.00 9 Q 8.01 4.02 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.01 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 10 K 7.82 4.39 0.00 1.78 2.00 0.00 1.25 0.00 0.00 1.38 0.00 0.00 2.53 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.37 7.81 11 G 8.19 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 0.00 0.00 0.00 12 A 8.72 4.68 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 0.00 0.00 0.00 0.00 0.00 0.00 13 V 7.56 4.39 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 1.11 0.00 0.00 1.19 0.00 0.00 14 T 8.45 4.38 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 1.28 0.00 0.00 15 P 0.00 4.39 0.00 2.10 2.10 0.00 3.90 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 2.06 2.15 0.00 16 V 8.20 3.86 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 0.79 0.00 0.00 0.82 0.00 0.00 17 K 8.57 4.73 0.00 1.68 1.77 0.00 1.74 0.00 0.00 1.92 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.56 7.81 18 N 8.39 5.35 0.00 2.69 2.68 0.00 0.00 7.01 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 Q 8.95 3.44 0.00 2.11 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.38 0.00 0.00 0.00 0.00 0.00 2.44 2.28 0.00 20 G 8.07 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 21 S 8.46 4.62 0.00 3.98 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 22 C 7.71 4.92 0.00 3.17 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 23 G 9.23 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 S 7.63 4.38 0.00 3.94 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *26 W 8.19 4.73 0.00 3.52 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 A 7.06 3.57 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 F 7.69 3.56 0.00 2.98 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 S 8.05 4.03 0.00 4.05 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 0.00 30 A 7.78 4.11 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 31 V 7.85 3.54 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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2.65 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.21 1.46 7.81 107 T 8.31 4.53 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 1.12 0.00 0.00 108 D 10.34 4.81 0.00 2.50 2.69 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 0.00 0.00 0.00 0.00 109 G 6.79 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 0.00 0.00 0.00 110 V 7.53 4.83 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.95 0.00 0.00 111 R 8.59 4.65 0.00 0.68 1.59 0.00 3.30 0.00 0.00 3.08 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.54 0.00 112 Q 8.33 4.45 0.00 1.78 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.97 0.00 0.00 0.00 0.00 0.00 1.71 1.16 0.00 113 V 8.34 4.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.90 0.00 0.00 114 Q 8.72 3.80 0.00 1.96 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 7.06 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 115 P 0.00 4.33 0.00 1.26 1.73 0.00 3.91 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 1.96 1.83 0.00 116 Y 8.09 4.55 0.00 3.14 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 0.00 117 N 7.74 4.69 0.00 2.76 2.70 0.00 0.00 6.70 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 Q 8.38 3.00 0.00 1.87 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.64 0.00 0.00 0.00 0.00 0.00 2.21 2.13 0.00 119 G 7.93 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.68 3.98 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 0.00 121 L 7.56 3.85 0.00 1.63 1.53 0.97 0.69 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 0.00 122 L 7.78 3.76 0.00 1.59 1.02 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 123 Y 7.86 4.01 0.00 2.90 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 0.00 124 S 8.09 4.09 0.00 4.06 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 I 8.18 4.32 2.15 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 2.23 1.29 0.00 0.00 126 A 8.21 4.30 1.37 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 0.00 0.00 127 N 7.71 4.78 0.00 2.72 2.74 0.00 0.00 6.86 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 0.00 128 Q 6.88 3.53 0.00 1.90 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 6.97 0.00 0.00 0.00 0.00 0.00 1.83 1.97 0.00 129 P 0.00 4.73 0.00 1.88 2.03 0.00 3.15 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.67 0.00 130 V 8.56 4.65 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 1.07 0.00 0.00 1.01 0.00 0.00 131 S 9.12 5.16 0.00 4.07 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 V 8.76 5.15 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 1.02 0.00 0.00 133 V 7.94 5.40 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 1.19 0.00 0.00 1.01 0.00 0.00 134 L 7.84 4.74 0.00 1.65 1.68 0.40 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 135 Q 9.09 4.54 0.00 2.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.47 0.00 136 A 9.49 3.67 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 A 7.57 4.20 1.44 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 0.00 138 G 7.98 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 0.00 139 K 8.78 4.18 0.00 2.01 1.98 0.00 1.79 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.53 1.10 7.81 140 D 8.21 4.58 0.00 3.15 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 0.00 141 F 8.54 3.82 0.00 3.23 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 0.00 142 Q 8.47 4.63 0.00 2.51 2.32 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 2.82 3.07 0.00 143 L 7.88 4.62 0.00 1.81 1.76 0.99 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 144 Y 7.56 4.14 0.00 2.75 2.42 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 0.00 145 R 8.79 4.03 0.00 1.53 1.63 0.00 3.39 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.54 0.00 146 G 6.77 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 0.00 0.00 0.00 147 G 9.01 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 0.00 148 I 7.92 4.24 1.95 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 1.30 0.62 1.05 0.00 0.00 149 F 9.66 4.50 0.00 2.70 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 0.00 150 V 7.94 4.12 2.02 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 0.70 0.00 0.00 0.92 0.00 0.00 151 G 5.58 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 4.42 0.00 2.22 2.08 0.00 3.72 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 2.08 0.00 153 C 8.17 5.04 0.00 3.27 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 0.00 154 G 8.64 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 0.00 0.00 0.00 155 N 8.46 5.06 0.00 2.48 2.66 0.00 0.00 6.72 7.61 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 0.00 156 K 7.87 4.32 0.00 1.73 1.76 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.37 1.42 7.81 157 V 7.60 3.96 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 0.86 0.00 0.00 0.99 0.00 0.00 158 D 9.02 4.84 0.00 2.62 2.69 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 0.00 0.00 0.00 0.00 159 H 8.15 4.99 0.00 3.12 3.04 0.00 5.83 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 0.00 160 A 8.43 5.17 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 0.00 161 V 8.79 4.50 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.00 0.00 0.93 0.00 0.00 162 A 8.50 5.21 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 0.00 163 A 9.34 4.99 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 V 9.46 4.51 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 0.89 0.00 0.00 1.30 0.00 0.00 165 G 7.85 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 Y 7.80 5.00 0.00 2.96 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 0.00 167 G 7.58 3.33 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 0.00 168 P 0.00 4.20 0.00 2.01 2.04 0.00 3.45 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.51 0.00 169 N 8.04 5.25 0.00 2.83 3.04 0.00 0.00 5.75 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 0.00 170 Y 7.51 5.49 0.00 3.13 3.19 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 0.00 171 I 9.11 4.92 2.07 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.94 1.11 0.00 0.00 172 L 9.42 5.10 0.00 2.10 1.84 0.98 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 173 I 9.12 5.12 2.12 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.04 1.04 0.00 0.00 174 K 9.35 4.17 0.00 1.89 1.69 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.75 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.13 0.83 7.81 175 N 8.27 4.91 0.00 2.59 2.50 0.00 0.00 7.05 6.91 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 0.00 176 S 7.58 4.72 0.00 3.12 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 W 7.86 4.84 0.00 2.91 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 0.00 178 G 8.08 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 0.00 179 T 8.32 4.00 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 0.00 180 G 8.15 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 181 W 7.76 4.82 0.00 3.46 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 G 7.13 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 0.00 0.00 0.00 183 E 8.64 4.23 0.00 2.11 1.90 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 2.12 2.25 0.00 184 N 8.69 4.77 0.00 2.98 3.04 0.00 0.00 7.57 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 G 8.93 4.16 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 0.00 0.00 0.00 186 Y 7.92 5.24 0.00 3.19 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 0.00 187 I 9.00 4.96 1.49 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.64 1.09 0.00 0.00 188 R 8.50 5.13 0.00 1.74 1.71 0.00 2.21 0.00 0.00 2.64 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.64 0.00 189 I 8.82 4.95 2.05 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.92 1.17 0.00 0.00 190 K 9.18 4.62 0.00 1.75 1.79 0.00 1.70 0.00 0.00 1.80 0.00 0.00 3.16 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.53 7.81 191 R 8.20 4.73 0.00 2.04 2.01 0.00 3.19 0.00 0.00 3.33 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.55 0.00 192 G 8.35 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 0.00 193 T 8.30 4.32 4.27 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 1.30 0.00 0.00 194 G 8.25 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 0.00 195 N 7.71 4.47 0.00 2.82 2.76 0.00 0.00 7.10 7.51 0.00 0.00 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 S 8.56 4.34 0.00 3.61 3.42 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 0.00 197 Y 7.37 4.39 0.00 3.11 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 0.00 198 G 7.68 3.37 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 0.00 0.00 0.00 199 V 7.83 3.86 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.07 0.00 0.00 200 C 9.14 4.95 0.00 3.15 3.26 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 0.00 201 G 7.97 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 202 L 7.40 4.65 0.00 1.67 1.29 1.07 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 203 Y 8.17 5.00 0.00 3.23 2.79 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 0.00 204 T 7.70 3.45 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 205 S 7.64 4.30 0.00 3.92 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 0.00 206 S 8.21 5.80 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 0.00 207 F 8.73 5.36 0.00 3.09 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 208 Y 8.15 5.20 0.00 3.06 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 P 0.00 4.88 0.00 2.10 2.09 0.00 3.92 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 2.03 1.99 0.00 210 V 8.27 4.56 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.98 0.00 0.00 211 K 8.44 4.88 0.00 1.70 1.61 0.00 1.88 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.29 1.51 7.81 212 N 9.23 4.55 0.00 2.85 2.72 0.00 0.00 6.92 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.