NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 55 N 4.7366 8.2833 118.1263 53.5755 40.4816 174.8675 56 S 4.3832 8.3152 116.6192 58.1567 63.6298 172.7591 57 D 4.3546 8.4012 121.6384 53.8994 42.2317 176.4369 58 L 4.1206 8.7587 128.6458 57.7944 42.1475 177.6351 59 G 4.5905 8.1071 105.0731 45.2573 0.0000 173.1824 60 T 4.7719 8.4485 119.2852 63.3879 69.4501 173.7929 61 W 5.3224 9.9450 126.1174 54.9225 33.9262 174.2457 62 Q 5.6565 8.8925 121.0898 53.5923 31.6827 174.5481 63 M 5.6609 8.4645 123.2458 53.3121 33.2801 175.2319 64 D 4.7428 8.3681 123.7551 53.4321 43.4731 175.1645 65 C 5.1534 8.5409 119.7551 58.3921 34.9082 173.1136 66 T 4.8199 8.9963 115.1337 60.9856 72.1375 171.9037 67 H 5.2997 8.2881 116.1547 54.5367 32.5190 173.0750 68 L 4.4130 8.7898 124.7750 55.0897 44.9280 175.2696 69 E 3.9057 10.0115 125.6371 57.4476 27.0493 175.8770 70 G 3.9290 8.5173 105.7544 45.4743 0.0000 174.4314 71 K 4.3514 7.9121 120.0806 55.3133 33.7905 175.0753 72 I 4.6336 7.9804 119.3335 59.8086 40.2988 175.1881 73 V 4.4937 8.2584 128.3742 61.0945 32.7773 174.6206 74 I 4.2902 8.2250 129.3843 60.7018 39.2981 174.7461 75 V 4.7140 8.6816 126.9839 61.3311 35.7636 173.9034 76 A 5.7545 9.1442 127.0471 50.1858 22.7780 175.0878 77 V 4.3932 8.4463 122.2436 61.3363 34.7713 174.4193 78 H 4.0836 8.0276 127.7574 54.5280 28.0483 176.0475 79 V 3.3011 7.5116 123.1088 65.1360 32.1982 176.4015 80 A 4.3467 7.4922 121.3695 53.0878 20.2379 176.4818 81 S 4.7462 8.1176 109.6416 57.8227 62.2796 176.1042 82 G 3.8541 8.7336 102.8863 46.1054 0.0000 172.4025 83 F 3.8374 8.0504 123.8082 58.2297 39.3064 174.0236 84 I 4.3756 7.6650 126.6618 60.7786 38.3147 175.4621 85 E 5.0124 9.1952 124.6944 54.9140 33.3171 174.5332 86 A 5.2131 8.6301 124.2956 51.5990 22.6157 174.2518 87 E 4.7348 8.4859 116.1165 56.0326 33.7012 174.4335 88 V 4.8392 8.7370 120.2744 60.9480 32.7496 174.7235 89 I 4.5433 8.2152 122.1510 58.4513 38.9875 174.8094 90 P 4.3496 0.0000 0.0000 64.7645 31.2270 175.8678 91 Q 4.4854 7.6880 115.7590 55.2702 32.8597 174.2129 92 E 4.3018 8.4961 123.0634 55.1499 28.5984 175.6361 93 T 4.7637 7.6336 114.1289 58.3791 73.3341 174.4931 94 G 4.1257 8.5520 110.0152 47.4765 0.0000 175.7088 95 R 4.1303 8.0822 120.0215 59.4561 30.0999 178.9496 96 Q 4.0478 7.9616 116.7854 59.3881 28.8739 178.7914 97 T 4.0250 8.4392 116.7571 65.9724 68.3694 176.9181 98 A 4.0568 8.9352 124.2887 55.0877 18.4912 179.4127 99 L 4.1044 8.4624 118.9846 57.7944 41.8965 179.0219 100 F 4.0211 8.3000 120.7761 60.9663 39.4792 177.0678 101 L 4.0797 8.2084 120.0088 58.0749 41.6986 178.7659 102 L 4.0588 8.4175 120.5970 58.1684 41.9243 178.8745 103 K 3.7147 7.3459 117.7289 59.1821 32.3775 178.0255 104 L 3.9523 7.8420 120.6283 57.6005 42.0867 178.4279 105 A 4.1689 8.6654 121.9965 54.9310 18.0637 179.7510 106 G 3.6462 8.1158 102.9305 44.6227 0.0000 173.6154 107 R 4.2406 7.5259 119.2885 55.4557 35.5655 174.7886 108 W 4.9191 7.1139 116.8187 54.0003 31.5532 174.8040 109 P 4.6217 0.0000 0.0000 62.4362 29.8574 176.6509 110 I 4.2184 7.3076 117.9832 62.2484 39.0511 174.9005 111 T 4.8138 8.3494 112.6566 61.5092 72.4841 172.6738 112 H 5.1090 8.9646 120.1579 53.8494 32.4114 172.2383 113 L 5.1354 8.4713 125.3512 53.7257 44.0085 174.2828 114 H 4.8768 9.3147 128.1072 55.3835 31.6469 174.1591 115 T 4.6435 7.9934 121.2879 61.7812 73.1228 172.5069 116 D 5.0086 7.6330 121.3039 53.1879 42.5976 175.9918 117 N 4.6040 8.3816 118.9441 52.7569 35.2673 174.3917 118 G 4.3475 8.4730 114.5555 43.6875 0.0000 171.0510 119 A 3.9467 8.8269 123.2633 55.0371 18.0393 178.1194 120 N 4.2772 7.5130 115.5151 56.1178 39.3600 175.6804 121 F 4.6678 7.5080 116.8763 57.9651 39.2065 175.8645 122 A 5.0794 8.1932 121.4518 51.3599 19.8569 177.9957 123 S 4.6423 8.0560 115.3324 59.0006 66.1105 174.0391 124 Q 4.1494 8.1811 120.9033 59.0568 28.6344 177.5180 125 E 3.9719 8.2248 119.4526 59.1413 29.4727 178.6042 126 V 3.9847 7.7254 116.0452 63.8072 31.8818 177.6434 127 K 4.0600 7.6313 118.3071 60.2899 32.2163 178.1148 128 M 4.2589 8.2939 118.9751 58.9297 32.0155 178.7015 129 V 3.6191 7.6093 117.0148 65.9902 31.6751 177.4474 130 A 4.0726 8.0567 119.9040 55.3434 18.2243 179.2615 131 W 4.1070 8.4627 125.9681 60.5855 30.7249 177.7974 132 W 3.1829 8.6497 127.0373 59.6239 30.0494 176.6481 133 A 4.1373 8.2121 117.7777 50.5495 20.3541 175.8415 134 G 3.3919 8.2319 104.7604 46.5364 0.0000 175.3680 135 I 4.6797 7.9904 119.0406 58.1160 38.8780 176.7452 136 E 4.2270 8.6379 129.7147 56.2068 30.4137 175.6534 137 H 4.9496 8.7990 123.0855 55.5034 30.5924 175.5047 138 T 4.5864 8.1032 110.3711 60.5160 70.9406 173.2345 139 F 4.3477 9.4206 125.6576 56.6137 39.6832 176.5557 140 G 4.0938 8.7660 108.3663 46.3338 0.0000 176.7519 *152 E 4.2449 9.0908 129.9476 56.7843 29.0480 174.0470 153 A 4.3217 7.3768 135.0000 52.7927 21.8738 175.4220 154 M 4.6301 7.9455 116.7337 54.3965 33.2485 176.7151 155 N 4.8842 7.9186 112.9924 53.1189 44.7739 174.8846 156 H 4.5763 8.3117 117.2640 59.3670 30.4183 175.9694 157 H 5.0611 8.4810 116.8169 56.1152 28.2769 177.0936 158 L 3.9648 7.5991 124.2163 58.0757 41.9310 178.7797 159 K 4.1269 7.7584 117.2453 59.9909 32.2212 178.3859 160 N 4.2732 8.1163 116.6631 55.6368 38.5474 176.4741 161 Q 3.9091 8.4776 122.2786 59.4803 29.2025 179.7493 162 I 3.8405 7.3918 119.4821 64.4524 36.9627 177.7766 163 D 4.2107 8.1496 119.0332 56.7796 40.9280 177.5947 164 R 4.5741 7.2957 116.9272 55.7715 31.4483 176.2121 165 I 4.4508 7.8878 120.1756 62.9864 45.1938 178.0496 166 R 3.7659 8.5266 120.7125 58.9334 30.7711 176.6337 167 E 4.1818 8.3353 118.6426 58.5784 30.0775 177.9967 168 Q 3.9528 7.9812 117.1750 58.9398 29.0176 177.4443 169 A 4.5296 7.4488 117.2301 50.8073 22.0797 175.3606 170 N 4.3555 8.5717 120.5601 56.8260 39.6366 176.0596 171 S 4.3199 7.7235 114.3331 58.2674 65.0434 175.6406 172 V 3.6055 8.3412 124.3091 66.5949 31.4038 177.5408 173 E 3.9566 8.3443 117.6101 60.1687 29.1881 179.0780 174 T 3.9231 7.8537 114.9601 66.9705 68.7212 176.4353 175 I 3.7413 8.0972 120.8914 63.8530 37.7794 178.0760 176 V 3.7181 8.1137 118.9516 65.4407 31.7289 177.9317 177 L 4.1695 7.8173 118.5950 58.0190 41.4479 178.7650 178 M 4.0217 8.2744 118.0355 58.7509 31.9468 178.0640 179 A 3.9854 7.9699 120.7821 55.2539 18.5412 179.7705 180 V 3.5246 7.7082 115.8779 65.5506 31.3940 177.8202 181 H 4.1576 8.0566 118.6712 59.3876 29.6115 176.7034 182 C 4.1329 8.0512 114.5405 61.7051 29.4671 174.8006 183 M 4.0736 7.9646 119.8916 58.4319 32.1339 177.6577 184 N 4.3331 8.1606 115.7352 54.5356 39.7332 173.9685 185 H 5.4689 7.4966 116.4239 52.9432 28.6075 173.2041 186 K 4.4897 9.4520 117.8611 54.8925 35.0096 176.3051 187 R 4.0766 8.6039 121.7294 56.4526 30.1492 176.0970 188 R 4.3670 8.1517 120.5450 54.1690 32.2499 176.8501 189 G 3.8813 9.0534 117.6828 46.2683 0.0000 175.6207 190 G 3.9103 8.6840 115.5424 46.4488 0.0000 172.8693 191 I 3.2763 8.9174 120.6704 59.8117 36.5510 174.2967 192 G 4.6166 6.8463 118.0624 45.6497 0.0000 174.6803 193 D 4.9284 7.5520 116.1949 52.2790 38.8217 176.1882 194 M 4.4018 7.9278 119.7004 56.0478 33.1339 176.7130 195 T 4.3517 8.6530 117.8529 60.9976 69.7066 173.2428 196 P 4.1518 0.0000 0.0000 65.4385 31.0269 178.3891 197 A 4.4803 8.0819 119.4321 55.7177 18.0191 179.5376 198 E 4.0819 8.2839 115.2534 59.6615 29.5640 179.1646 199 R 3.8944 7.9536 119.2461 58.8502 30.0428 177.9759 200 L 3.8574 7.7733 119.8483 58.5296 42.0552 179.2782 201 I 3.7614 7.4446 117.9283 64.2195 36.8842 177.9082 202 N 4.4244 7.8765 117.5766 56.3106 38.4908 176.9842 203 M 4.1580 7.7889 119.6070 58.2511 32.6107 178.1776 204 I 3.8261 7.9874 120.1513 64.9391 37.3186 178.3585 205 T 3.8945 7.9929 116.1974 67.2550 68.0977 176.4641 206 T 3.8604 7.3770 112.6386 64.8936 67.6257 175.4029 207 E 4.0270 8.1163 121.2688 59.5596 29.6223 178.7077 208 Q 3.9487 8.0624 117.2323 59.0917 28.7005 178.5352 209 E 4.0584 8.2557 117.1381 58.2389 29.5912 178.8851 210 I 3.7107 7.5108 120.5513 61.4927 37.4210 176.3091 211 Q 2.9808 7.4259 121.8815 55.2257 30.0729 173.1790 212 F 4.9325 7.7792 115.8962 55.7691 39.0395 175.4091 213 Q 4.1602 7.9264 124.2818 56.3000 28.8488 175.5452 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 55 N 8.28 4.74 0.00 2.82 2.67 0.00 0.00 7.03 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 56 S 8.32 4.38 0.00 3.90 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 57 D 8.40 4.35 0.00 2.59 2.39 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 58 L 8.76 4.12 0.00 1.64 1.75 1.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 59 G 8.11 4.59 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 60 T 8.45 4.77 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 61 W 9.95 5.32 0.00 3.22 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 Q 8.89 5.66 0.00 1.93 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.75 0.00 0.00 0.00 0.00 0.00 2.25 2.06 0.00 63 M 8.46 5.66 0.00 1.93 1.87 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 64 D 8.37 4.74 0.00 2.69 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 65 C 8.54 5.15 0.00 3.41 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 66 T 9.00 4.82 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 1.24 0.00 0.00 67 H 8.29 5.30 0.00 3.17 3.21 0.00 5.85 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.79 4.41 0.00 1.70 1.47 0.93 1.01 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 69 E 10.01 3.91 0.00 2.14 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 2.23 2.29 0.00 70 G 8.52 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 71 K 7.91 4.35 0.00 1.99 1.76 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.94 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.42 1.55 7.81 72 I 7.98 4.63 1.96 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.23 0.84 0.00 0.00 73 V 8.26 4.49 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 0.83 0.00 0.00 0.94 0.00 0.00 74 I 8.23 4.29 1.71 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 0.61 0.57 0.46 0.00 0.00 75 V 8.68 4.71 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 1.05 0.00 0.00 0.96 0.00 0.00 76 A 9.14 5.75 1.74 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 0.00 0.00 77 V 8.45 4.39 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 0.81 0.00 0.00 0.86 0.00 0.00 78 H 8.03 4.08 0.00 1.73 2.65 0.00 5.67 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 V 7.51 3.30 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.88 0.00 0.00 80 A 7.49 4.35 1.15 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 0.00 0.00 81 S 8.12 4.75 0.00 3.86 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 82 G 8.73 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 83 F 8.05 3.84 0.00 2.88 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 I 7.66 4.38 1.72 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 1.38 0.42 0.89 0.00 0.00 85 E 9.20 5.01 0.00 2.59 2.33 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 2.80 3.15 0.00 86 A 8.63 5.21 1.28 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 0.00 0.00 87 E 8.49 4.73 0.00 2.11 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.47 0.00 88 V 8.74 4.84 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.95 0.00 0.00 89 I 8.22 4.54 1.89 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.69 0.96 0.00 0.00 90 P 0.00 4.35 0.00 2.20 2.25 0.00 3.82 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 2.00 2.02 0.00 91 Q 7.69 4.49 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.14 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 92 E 8.50 4.30 0.00 1.88 1.84 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 2.14 2.20 0.00 93 T 7.63 4.76 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 1.18 0.00 0.00 94 G 8.55 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 95 R 8.08 4.13 0.00 1.90 2.01 0.00 3.17 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.81 0.00 96 Q 7.96 4.05 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.59 0.00 97 T 8.44 4.02 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 1.22 0.00 0.00 98 A 8.94 4.06 1.41 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 99 L 8.46 4.10 0.00 2.05 1.73 0.87 0.89 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 0.00 100 F 8.30 4.02 0.00 3.30 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 0.00 101 L 8.21 4.08 0.00 2.20 1.87 1.04 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 102 L 8.42 4.06 0.00 1.90 1.57 0.74 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 103 K 7.35 3.71 0.00 1.79 1.51 0.00 1.69 0.00 0.00 1.56 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.35 7.81 104 L 7.84 3.95 0.00 1.52 1.75 -0.14 1.36 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 0.00 105 A 8.67 4.17 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 G 8.12 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 0.00 0.00 0.00 107 R 7.53 4.24 0.00 1.34 1.63 0.00 2.72 0.00 0.00 2.73 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.50 0.00 108 W 7.11 4.92 0.00 2.96 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.62 0.00 2.24 2.18 0.00 4.15 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 2.12 2.07 0.00 110 I 7.31 4.22 1.44 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.00 0.84 0.00 0.00 111 T 8.35 4.81 4.37 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 1.25 0.00 0.00 112 H 8.96 5.11 0.00 3.11 3.27 0.00 5.59 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.47 5.14 0.00 1.86 1.57 1.10 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 114 H 9.31 4.88 0.00 3.23 3.12 0.00 5.58 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 T 7.99 4.64 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 0.79 0.00 0.00 116 D 7.63 5.01 0.00 2.48 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.38 4.60 0.00 2.97 3.14 0.00 0.00 6.65 6.88 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 0.00 118 G 8.47 4.35 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 0.00 119 A 8.83 3.95 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 0.00 120 N 7.51 4.28 0.00 2.57 1.82 0.00 0.00 7.06 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 0.00 121 F 7.51 4.67 0.00 3.02 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 0.00 122 A 8.19 5.08 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 S 8.06 4.64 0.00 4.31 4.04 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 0.00 124 Q 8.18 4.15 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 125 E 8.22 3.97 0.00 2.11 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 2.40 2.44 0.00 126 V 7.73 3.98 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 1.01 0.00 0.00 127 K 7.63 4.06 0.00 2.24 2.10 0.00 1.74 0.00 0.00 1.77 0.00 0.00 3.05 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.69 1.60 7.81 128 M 8.29 4.26 0.00 2.25 2.20 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.91 2.63 0.00 129 V 7.61 3.62 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 1.10 0.00 0.00 0.94 0.00 0.00 130 A 8.06 4.07 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 W 8.46 4.11 0.00 3.52 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 0.00 132 W 8.65 3.18 0.00 3.34 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 0.00 133 A 8.21 4.14 1.40 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 0.00 0.00 134 G 8.23 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 0.00 0.00 0.00 135 I 7.99 4.68 1.93 0.00 0.00 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 1.12 1.56 0.97 0.00 0.00 136 E 8.64 4.23 0.00 2.08 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.39 0.00 137 H 8.80 4.95 0.00 2.92 3.28 0.00 5.76 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 8.10 4.59 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 139 F 9.42 4.35 0.00 2.85 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 0.00 140 G 8.77 4.09 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 0.00 0.00 0.00 *152 E 9.09 4.24 0.00 1.98 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 2.22 2.32 0.00 153 A 7.38 4.32 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 0.00 154 M 7.95 4.63 0.00 1.89 1.98 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.61 0.00 155 N 7.92 4.88 0.00 2.64 2.74 0.00 0.00 7.14 7.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 H 8.31 4.58 0.00 3.19 3.45 0.00 5.72 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 0.00 157 H 8.48 5.06 0.00 3.17 3.28 0.00 5.87 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 L 7.60 3.96 0.00 1.67 1.76 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 159 K 7.76 4.13 0.00 1.76 1.84 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.62 7.81 160 N 8.12 4.27 0.00 2.66 2.66 0.00 0.00 6.74 8.20 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 0.00 161 Q 8.48 3.91 0.00 2.17 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 162 I 7.39 3.84 2.03 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 1.52 0.96 0.91 0.00 0.00 163 D 8.15 4.21 0.00 2.79 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 0.00 164 R 7.30 4.57 0.00 1.87 1.93 0.00 3.19 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.69 0.00 165 I 7.89 4.45 2.07 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 1.29 0.35 0.91 0.00 0.00 166 R 8.53 3.77 0.00 1.90 1.92 0.00 3.64 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 167 E 8.34 4.18 0.00 2.08 1.91 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 2.35 2.38 0.00 168 Q 7.98 3.95 0.00 2.11 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.34 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 169 A 7.45 4.53 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 N 8.57 4.36 0.00 2.70 2.82 0.00 0.00 7.07 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 S 7.72 4.32 0.00 3.91 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 0.00 172 V 8.34 3.61 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 1.16 0.00 0.00 0.94 0.00 0.00 173 E 8.34 3.96 0.00 2.07 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.43 0.00 174 T 7.85 3.92 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 1.23 0.00 0.00 175 I 8.10 3.74 2.12 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.23 0.99 0.00 0.00 176 V 8.11 3.72 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 0.92 0.00 0.00 1.01 0.00 0.00 177 L 7.82 4.17 0.00 1.90 1.74 1.04 1.00 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 0.00 178 M 8.27 4.02 0.00 2.08 2.31 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.57 0.00 179 A 7.97 3.99 1.46 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 0.00 180 V 7.71 3.52 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 1.02 0.00 0.00 1.05 0.00 0.00 181 H 8.06 4.16 0.00 3.23 3.49 0.00 5.65 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 C 8.05 4.13 0.00 3.32 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 0.00 183 M 7.96 4.07 0.00 2.01 2.30 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.55 0.00 184 N 8.16 4.33 0.00 2.57 2.27 0.00 0.00 6.82 8.98 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 0.00 185 H 7.50 5.47 0.00 2.96 3.22 0.00 5.87 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 K 9.45 4.49 0.00 1.52 1.71 0.00 1.76 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.39 1.66 7.81 187 R 8.60 4.08 0.00 1.85 2.04 0.00 3.16 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 188 R 8.15 4.37 0.00 1.80 1.80 0.00 3.26 0.00 0.00 3.14 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.56 0.00 189 G 9.05 3.88 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 0.00 0.00 0.00 190 G 8.68 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 0.00 191 I 8.92 3.28 1.87 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 1.34 0.75 0.90 0.00 0.00 192 G 6.85 4.62 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 0.00 193 D 7.55 4.93 0.00 2.80 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 0.00 194 M 7.93 4.40 0.00 2.11 2.02 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 2.58 0.00 195 T 8.65 4.35 4.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 196 P 0.00 4.15 0.00 2.00 1.94 0.00 3.79 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.08 0.00 197 A 8.08 4.48 1.50 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 0.00 0.00 198 E 8.28 4.08 0.00 2.25 2.29 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 2.60 2.40 0.00 199 R 7.95 3.89 0.00 1.99 2.11 0.00 3.09 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.63 0.00 200 L 7.77 3.86 0.00 1.67 1.74 0.45 -0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 201 I 7.44 3.76 1.93 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 1.52 0.67 0.96 0.00 0.00 202 N 7.88 4.42 0.00 2.86 3.00 0.00 0.00 7.10 7.31 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 0.00 203 M 7.79 4.16 0.00 2.06 2.23 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 2.76 2.57 0.00 204 I 7.99 3.83 1.93 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.93 0.98 0.00 0.00 205 T 7.99 3.89 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 206 T 7.38 3.86 4.49 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 0.00 0.00 0.00 1.23 0.00 0.00 207 E 8.12 4.03 0.00 2.15 2.20 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 2.33 2.41 0.00 208 Q 8.06 3.95 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.70 0.00 0.00 0.00 0.00 0.00 2.47 2.48 0.00 209 E 8.26 4.06 0.00 2.04 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 2.33 2.61 0.00 210 I 7.51 3.71 2.12 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.27 0.70 0.00 0.00 211 Q 7.43 2.98 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 7.24 0.00 0.00 0.00 0.00 0.00 2.23 2.39 0.00 212 F 7.78 4.93 0.00 3.03 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 0.00 213 Q 7.93 4.16 0.00 2.01 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.65 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 * Residues marked with a * may have inaccurate shift predictions.