NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2553 7.8827 121.4383 61.2007 38.7240 173.7821 17 V 4.3501 8.5658 125.9633 61.8487 32.5106 174.3271 18 G 3.7685 8.4425 115.1141 47.0907 0.0000 173.1871 19 G 4.3864 7.9422 110.6557 44.3325 0.0000 172.2604 20 Y 4.9408 7.9050 118.3640 55.6357 42.3675 174.7219 21 T 4.3664 8.5292 116.9245 63.6797 68.5319 175.4257 22 C 4.1839 8.5912 125.4413 60.8033 35.2130 175.0081 23 G 4.1068 8.4964 106.3391 44.2414 0.0000 172.8717 24 A 4.3418 8.5749 125.9020 53.5102 18.6520 176.8697 25 N 4.2560 8.8610 119.7159 54.4805 36.2663 175.5061 26 T 4.1493 7.6936 108.1923 62.9066 69.7845 175.1855 27 V 4.0142 7.0685 122.8237 60.0781 31.0882 173.6694 28 P 4.4934 0.0000 0.0000 63.8342 32.0150 178.3508 29 Y 4.7523 6.8886 115.8341 56.9414 38.8327 174.8076 30 Q 4.3596 7.5211 123.6294 56.3399 29.4655 175.4346 31 V 4.7591 8.9994 126.2841 61.1952 35.0295 173.8235 32 S 4.9084 8.9304 121.0954 56.4972 64.8540 172.5209 33 L 4.6607 8.6661 127.6975 53.4218 43.2328 175.0352 34 N 5.9636 9.1508 122.8831 50.0367 42.0957 174.9118 *37 S 4.1740 8.4013 120.1204 58.3713 64.1220 174.5070 38 G 3.9739 9.4397 109.2599 46.2703 0.0000 173.0137 39 Y 4.5208 6.5747 114.8529 56.1491 39.9528 172.7168 40 H 4.6275 8.9687 121.9469 56.4230 30.2532 174.7787 41 F 5.0694 8.0705 120.1212 56.6895 39.5063 173.9832 42 C 4.6658 6.6720 115.1442 56.0675 44.6389 173.5685 43 G 4.3110 8.8568 109.9679 45.8296 0.0000 172.4295 44 G 4.5860 8.3451 105.6037 46.1513 0.0000 172.4782 45 S 5.4575 8.9344 116.1721 56.2996 66.2957 173.6461 46 L 4.7208 9.2846 128.0991 55.0116 42.4761 177.1070 47 I 4.5154 8.3640 119.4265 60.6070 38.7402 174.3560 48 N 4.5364 7.5652 117.7306 52.3103 39.3183 175.1656 49 S 4.2488 8.5055 112.2701 60.6658 63.0492 175.0811 50 Q 4.5616 9.1496 118.6963 55.0879 31.0008 175.0176 51 W 5.2819 8.3966 119.7918 54.6700 33.0655 174.4911 52 V 5.1517 9.0808 123.6538 61.0952 34.2408 174.4450 53 V 4.9426 8.7517 126.8569 60.7474 34.1226 175.0989 54 S 4.8761 8.9638 116.2150 57.7583 66.1036 172.1820 55 A 4.7119 8.7950 120.5292 50.4504 19.6927 178.7004 56 A 3.8253 8.2795 124.7782 55.2210 18.4967 179.2732 57 H 4.4717 8.3470 110.0784 57.7251 28.5868 175.3704 58 C 4.7361 7.9626 117.2400 57.0744 40.3639 173.2328 59 Y 4.2819 7.8601 122.0826 57.8418 38.8590 175.1881 60 K 3.7002 6.7641 124.4179 55.2435 34.9503 175.0590 61 S 4.2507 7.9741 120.3130 59.0347 63.9037 173.6105 62 G 3.6389 8.3940 107.7915 46.6853 0.0000 173.9487 63 I 4.1629 7.4713 119.5920 60.3668 39.1045 175.5268 64 Q 4.8566 9.1441 128.3284 54.1685 31.7064 174.2812 65 V 4.3084 8.6610 127.0197 62.2182 33.3439 174.7243 66 R 5.0906 9.0932 127.2901 54.7728 32.2709 175.0911 67 L 4.7131 9.0631 124.8540 52.7177 44.7058 177.7207 *69 G 4.3623 8.2461 107.4233 45.4150 0.0000 172.5717 70 E 4.4680 8.1033 119.2299 55.2339 29.9721 174.4329 71 D 4.9982 7.9884 118.6289 55.1324 44.5913 174.4633 72 N 5.0974 8.8776 123.5845 52.7574 38.8895 176.1698 73 I 3.9725 8.1727 119.3698 61.8905 37.5673 176.3696 74 N 4.7723 8.7325 118.0495 53.0506 39.4924 174.7770 75 V 4.3389 7.5017 117.8207 60.6195 34.2024 174.9417 76 V 4.1148 8.4615 126.7646 62.7027 31.3215 175.1245 77 E 4.4526 10.1453 127.4152 55.7769 30.8044 176.0753 78 G 3.5671 7.4917 107.2279 45.2941 0.0000 174.2130 79 N 4.9689 8.1792 116.8015 53.0169 40.2210 174.1833 80 E 4.8482 8.0450 118.2429 56.0077 31.1197 175.8928 81 Q 4.4616 9.0502 120.3561 54.1835 32.7789 174.3326 82 F 5.4952 8.9261 122.3083 55.9610 41.4050 174.8984 83 I 4.6017 8.6957 125.0359 59.1802 40.4933 175.8191 84 S 4.6572 8.7686 122.9688 58.4416 64.1632 173.4918 85 A 4.5438 8.4036 125.1882 52.1225 18.2689 177.8994 86 S 4.5414 8.9714 117.4339 60.0519 64.4941 174.5259 87 K 4.6808 7.5812 117.1563 55.8160 35.4938 174.9056 88 S 5.3596 8.7404 116.7811 57.0229 66.5735 174.0522 89 I 4.6063 8.9320 123.0839 59.7111 40.4222 174.7056 90 V 4.2696 8.4717 127.5284 62.0579 32.7001 175.1917 91 H 3.6127 8.5201 126.8166 55.9333 29.9500 174.3937 92 P 4.2606 0.0000 0.0000 65.4827 31.2505 177.0570 93 S 4.6841 7.7933 112.8238 58.0993 63.1515 173.0989 94 Y 4.3479 8.1642 123.4862 57.5542 39.0672 174.0786 95 N 4.5548 8.4178 126.2974 51.3535 39.9733 175.4380 96 S 3.9920 7.6706 120.3417 60.1958 63.6069 175.3900 97 N 4.3476 8.0891 118.4224 55.6132 38.4438 175.8100 98 T 4.0312 8.0702 105.7860 60.5217 69.7411 174.7851 99 L 3.7469 7.5964 120.6655 55.5141 40.0403 173.8925 100 N 4.3927 7.7044 117.7459 54.7358 39.6657 174.5980 101 N 4.9719 8.7042 121.1321 54.0190 35.8885 175.8657 102 D 4.6012 7.5840 119.1096 52.9424 40.4191 174.8169 103 I 5.0189 7.0804 121.1581 59.2808 42.3919 173.2204 104 M 5.4300 9.2216 124.0031 54.2298 35.0177 173.2646 105 L 5.4470 9.1539 120.2792 53.2559 45.0741 175.4816 106 I 4.9600 9.0964 123.4335 59.4837 40.5817 174.4039 107 K 3.8214 8.4445 128.5598 54.6946 33.7673 175.3372 108 L 4.7670 7.9946 127.2293 53.6420 42.1500 177.4367 109 K 4.2104 8.8347 122.8197 59.1218 33.0351 177.2779 110 S 4.6552 7.7597 112.8685 55.6938 66.0919 173.2740 111 A 4.4196 8.3656 123.2466 51.7781 18.8161 177.4402 112 A 4.2343 8.7713 123.6422 52.0810 19.5227 177.9526 113 S 4.4539 9.2937 117.6484 57.5785 63.0195 174.5786 114 L 4.5141 8.4567 125.4298 54.5005 41.5737 176.9281 115 N 4.5461 8.6635 117.1006 53.0377 40.6582 174.9573 116 S 4.4459 8.9209 111.6805 61.5740 63.0688 175.2530 117 R 4.1820 8.8900 119.6840 56.5867 30.7176 175.8935 118 V 4.5330 7.6402 117.3732 60.8763 33.2876 173.7424 119 A 5.1493 8.6167 128.5510 50.2210 22.8540 175.0831 120 S 4.8016 8.7472 114.3422 57.8833 64.7365 173.1807 121 I 4.3586 8.1833 121.8163 59.4706 39.3910 175.5085 122 S 4.4234 8.3492 124.0619 58.2378 64.0186 174.0089 123 L 4.1955 8.3867 123.5413 53.6205 42.3082 175.3147 124 P 4.4910 0.0000 0.0000 63.1334 32.4222 176.5106 125 T 4.0510 8.2473 115.9495 65.4505 69.2385 175.2020 *127 S 4.9149 7.5479 114.6507 58.2601 63.9928 174.0480 128 C 4.4065 8.3688 118.8376 56.6240 40.6581 173.9073 129 A 4.2590 8.0514 125.2528 52.0090 19.1214 176.9761 130 S 4.5180 8.0338 114.4660 56.5732 65.6832 173.5724 *132 A 4.3197 8.2476 124.0418 53.5686 19.2632 176.6418 133 G 4.0436 9.0310 110.8613 45.5416 0.0000 174.4979 134 T 3.9724 7.6886 117.3429 63.6084 69.3961 173.6605 135 Q 4.5837 8.6097 127.7283 55.9945 30.1046 175.3053 136 C 5.2635 9.2814 122.7072 55.0891 44.1726 172.3044 137 L 5.1492 8.8643 122.5650 53.5997 43.8700 175.0096 138 I 5.5926 9.0885 127.4684 58.8676 40.0189 174.8874 139 S 4.8697 8.3807 119.3118 56.7141 66.5849 172.9399 140 G 3.7526 7.7183 107.7725 46.0106 0.0000 173.0229 141 W 4.9613 8.8287 117.3167 56.4607 29.4872 177.4366 142 G 3.9870 8.3224 109.3343 44.1151 0.0000 173.6424 143 N 3.6760 7.9559 118.2524 54.0222 39.0202 174.7094 144 T 5.1033 8.1632 112.9846 60.3789 69.3069 174.1429 145 K 4.6474 7.7956 120.9020 54.8359 35.1606 176.4714 146 S 4.2851 8.6982 117.2592 60.0052 63.6333 174.2410 147 S 4.3725 8.1035 115.9758 59.4658 64.8742 172.5530 148 G 3.8138 9.2473 110.7425 44.4755 0.0000 171.7612 149 T 4.9143 8.0333 113.9461 61.9561 72.4075 174.2993 150 S 4.5681 9.6560 121.4064 57.5331 66.0381 172.0102 151 Y 4.8681 8.8195 125.6620 55.6065 39.1037 174.2968 152 P 4.6269 0.0000 0.0000 62.6333 32.7748 175.9070 153 D 4.6260 8.7079 118.5766 56.1911 41.5042 177.1750 154 V 5.1482 7.4501 110.3626 58.7476 34.0635 175.8294 155 L 3.3063 8.2197 124.4111 54.9503 42.9973 176.0843 156 K 4.8649 8.0719 124.6454 55.0114 35.1498 174.5938 157 C 5.1780 8.4763 118.8867 55.2078 43.4612 172.9952 158 L 5.0744 8.5877 122.3704 53.6811 45.4915 174.8047 159 K 5.1095 9.0489 125.3046 55.4231 33.5790 175.8779 160 A 4.9095 9.2599 125.7437 49.6030 23.1642 173.6599 161 P 4.9599 0.0000 0.0000 62.2297 33.5464 175.5195 162 I 4.2788 8.4434 123.0107 61.5418 38.0451 175.5983 163 L 4.9032 8.5413 126.8633 53.0179 43.5680 176.9345 164 S 4.3051 8.4443 115.1762 58.1302 63.9030 174.8626 165 D 4.3990 8.7645 121.2863 57.6255 40.8504 178.8370 166 S 4.1530 8.0343 114.6749 61.4154 63.0784 176.4347 167 S 4.1320 7.9753 117.9358 60.7865 62.8050 175.7318 168 C 4.2914 8.2185 122.3998 59.7865 42.5524 175.7713 169 K 3.9384 8.3546 120.1495 59.5314 31.3398 179.6496 170 S 4.1760 8.2575 115.0078 61.4202 62.7945 176.2024 171 A 4.0316 8.1034 122.9533 53.7857 19.5383 177.3533 172 Y 4.7818 8.0147 114.5754 55.0426 38.2793 172.6966 173 P 4.4186 0.0000 0.0000 63.4541 32.2106 177.8032 174 G 3.9978 9.0533 108.9672 46.0858 0.0000 173.6984 175 Q 4.5363 8.0091 117.3333 55.3312 30.9525 175.6324 176 I 4.3113 7.9093 119.1207 60.2015 37.2035 175.5735 177 T 4.4876 8.2406 116.7940 60.0514 70.7394 175.1989 178 S 4.4428 8.5611 114.1525 59.9497 63.2148 173.9864 179 N 5.1492 8.1916 118.3452 53.3757 39.6826 173.8751 180 M 5.4887 8.0255 116.7120 53.7919 36.2225 174.5433 181 F 5.1204 8.8241 116.2017 55.5949 42.2026 172.9152 182 C 5.3915 8.9127 116.3500 56.0772 41.1379 172.5368 183 A 4.9961 9.0881 121.7542 50.6470 22.2986 175.0595 184 G 3.8276 6.9725 108.7260 44.7016 0.0000 173.8375 184A Y 4.5638 8.2299 122.0077 56.2058 41.1784 176.0003 185 L 4.2331 8.6538 125.3362 57.0659 41.9714 178.7728 186 E 3.9529 8.2348 116.9929 56.9374 29.7795 177.5546 186D G 3.7820 8.1226 107.5886 44.8462 0.0000 172.7596 187 G 4.0391 9.6717 106.2707 44.9628 0.0000 173.4956 188 K 5.0696 7.4153 117.5717 55.3826 35.5387 175.1099 189 D 4.6863 8.7925 123.5080 53.5863 45.5982 174.9211 190 S 4.9547 8.1355 115.0319 58.3022 65.1446 171.4925 191 C 4.7407 9.1512 118.4630 55.5516 47.0338 172.3576 192 Q 4.3998 8.5687 118.9994 57.9970 28.5412 177.9383 193 G 4.2584 9.2139 110.3389 45.7999 0.0000 174.2337 194 D 4.6030 8.3239 118.8429 56.0441 41.5021 176.6608 195 S 4.4111 8.0915 115.0253 60.3206 63.4369 175.7190 196 G 4.2065 8.8345 111.9232 46.4259 0.0000 173.7723 197 G 4.4890 7.7036 107.4537 44.7676 0.0000 171.1701 198 P 5.0681 0.0000 0.0000 62.3252 33.5004 175.7809 199 V 4.4241 8.4762 120.7561 61.4712 34.3889 174.0201 200 V 4.8559 8.5956 128.5665 61.2297 34.3468 173.6547 201 C 5.0681 8.7977 124.4481 55.5911 43.7693 174.5744 202 S 3.7151 9.8245 120.8144 59.7152 60.1361 173.2358 203 G 3.9151 8.4349 103.8966 45.7211 0.0000 173.8143 204 K 4.7165 7.6354 118.0130 52.9752 34.9813 175.3679 *209 L 4.2151 8.3275 123.4613 55.4009 42.3226 175.7670 210 Q 4.6062 8.8720 125.3815 56.2554 31.2852 175.6927 211 G 5.3218 8.0201 104.6699 45.8052 0.0000 171.4193 212 I 5.1728 8.2153 119.4495 58.9790 41.3726 175.2717 213 V 3.9616 8.7518 127.1089 63.7086 31.8411 174.4228 214 S 4.6951 8.4801 120.6034 58.9230 64.3266 173.4728 215 W 5.0358 7.3598 114.1364 55.4785 31.7242 172.6878 216 G 4.1417 8.3974 108.9418 46.3645 0.0000 172.8793 217 S 4.5631 8.5333 116.8678 56.9856 62.4566 173.3492 *219 G 4.1462 8.0398 117.7259 45.7310 0.0000 171.0364 220 C 4.8115 8.0529 114.8582 56.3764 43.8662 173.9736 221 A 3.9314 9.0944 125.3378 53.2419 16.7830 177.2117 221A Q 4.5704 7.2995 117.8529 55.9496 29.8972 175.6713 222 K 4.2743 8.3555 121.7568 57.9985 32.4608 176.6006 223 N 4.4249 9.0593 122.6776 53.7384 36.6447 175.2517 224 K 4.2463 7.5917 117.8789 53.5936 32.2553 174.0220 225 P 4.6064 0.0000 0.0000 61.6575 32.9175 177.2224 226 G 3.5958 8.1714 105.9617 46.2077 0.0000 172.7898 227 V 4.3886 7.8435 122.6649 60.6689 34.2530 174.0281 228 Y 4.9811 8.0588 123.8798 56.0315 42.1200 175.0516 229 T 4.3391 8.6595 119.8352 63.7328 70.2584 174.0703 230 K 5.1424 9.1978 128.2406 55.1413 31.5663 177.0808 231 V 4.0211 9.0625 128.1458 65.6115 32.1473 175.9495 232 C 4.4066 8.4073 114.1092 58.2485 41.4813 175.1589 233 N 4.1358 7.9771 116.3792 55.0679 38.3183 175.1219 234 Y 4.7913 8.0965 115.4255 57.6281 39.0744 177.6757 235 V 3.6877 7.7844 120.7074 66.1022 31.4840 178.1430 236 S 4.1201 8.1046 113.5992 61.1904 62.7960 176.1248 237 W 4.1437 8.2902 131.5106 60.1795 30.4872 177.8319 238 I 3.0123 8.2669 120.0559 64.1601 36.4852 178.6216 239 K 3.7824 8.1155 119.3643 59.4812 31.6476 179.5271 240 Q 3.8730 7.9588 117.4175 59.1588 28.9653 178.6874 241 T 3.7159 7.5208 116.7692 66.6190 68.1608 176.9126 242 I 2.8069 7.0225 120.3122 63.8586 37.0101 178.1382 243 A 4.1526 7.8182 120.9200 53.9881 18.1059 178.2297 244 S 4.7497 7.4800 111.5321 58.1292 63.8039 174.0112 245 N 4.6726 8.0774 123.6506 53.7369 39.4817 174.3098 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 4.26 1.77 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 1.31 0.66 0.91 0.00 0.00 17 V 8.57 4.35 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 0.93 0.00 0.00 0.95 0.00 0.00 18 G 8.44 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 7.94 4.39 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 20 Y 7.90 4.94 0.00 2.96 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 21 T 8.53 4.37 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 1.22 0.00 0.00 22 C 8.59 4.18 0.00 2.72 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 23 G 8.50 4.11 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 0.00 24 A 8.57 4.34 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 25 N 8.86 4.26 0.00 2.87 2.90 0.00 0.00 7.15 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 7.69 4.15 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 27 V 7.07 4.01 1.75 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 0.29 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.49 0.00 2.38 2.38 0.00 3.79 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.95 0.00 29 Y 6.89 4.75 0.00 3.28 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 30 Q 7.52 4.36 0.00 1.76 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.68 0.00 0.00 0.00 0.00 0.00 1.86 2.42 0.00 31 V 9.00 4.76 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 0.92 0.00 0.00 1.11 0.00 0.00 32 S 8.93 4.91 0.00 3.19 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 33 L 8.67 4.66 0.00 0.61 1.19 0.82 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.15 5.96 0.00 2.48 2.52 0.00 0.00 6.77 7.91 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 *37 S 8.40 4.17 0.00 3.67 3.60 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 38 G 9.44 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 Y 6.57 4.52 0.00 3.07 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 40 H 8.97 4.63 0.00 2.89 3.21 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.07 5.07 0.00 3.17 3.24 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 42 C 6.67 4.67 0.00 2.03 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 43 G 8.86 4.31 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 0.00 0.00 0.00 44 G 8.35 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 45 S 8.93 5.46 0.00 3.82 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 46 L 9.28 4.72 0.00 1.86 1.68 1.07 0.81 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 I 8.36 4.52 1.90 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 1.58 0.92 0.95 0.00 0.00 48 N 7.57 4.54 0.00 2.98 2.99 0.00 0.00 5.99 7.91 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 49 S 8.51 4.25 0.00 4.19 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 0.00 50 Q 9.15 4.56 0.00 1.92 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.79 0.00 0.00 0.00 0.00 0.00 2.18 2.29 0.00 51 W 8.40 5.28 0.00 3.29 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 52 V 9.08 5.15 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 1.16 0.00 0.00 0.99 0.00 0.00 53 V 8.75 4.94 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 0.81 0.00 0.00 1.04 0.00 0.00 54 S 8.96 4.88 0.00 3.88 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 55 A 8.80 4.71 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 3.83 0.40 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 57 H 8.35 4.47 0.00 3.35 3.54 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 7.96 4.74 0.00 3.20 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 59 Y 7.86 4.28 0.00 2.97 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 60 K 6.76 3.70 0.00 1.22 1.17 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.52 0.00 0.00 2.35 0.00 0.00 0.00 0.00 0.80 0.97 7.81 61 S 7.97 4.25 0.00 3.79 3.72 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 0.00 0.00 0.00 0.00 62 G 8.39 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 0.00 0.00 0.00 63 I 7.47 4.16 1.87 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 1.33 0.96 0.95 0.00 0.00 64 Q 9.14 4.86 0.00 1.94 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.93 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 65 V 8.66 4.31 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 0.90 0.00 0.00 0.91 0.00 0.00 66 R 9.09 5.09 0.00 1.64 1.88 0.00 2.72 0.00 0.00 2.70 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 1.26 0.00 67 L 9.06 4.71 0.00 1.63 1.64 0.96 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.25 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 0.00 0.00 0.00 0.00 70 E 8.10 4.47 0.00 2.21 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 2.45 2.09 0.00 71 D 7.99 5.00 0.00 2.78 2.71 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 72 N 8.88 5.10 0.00 2.83 2.94 0.00 0.00 7.18 7.75 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 73 I 8.17 3.97 1.43 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 1.15 0.92 -0.53 0.00 0.00 74 N 8.73 4.77 0.00 2.81 2.88 0.00 0.00 6.63 7.47 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 75 V 7.50 4.34 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 0.78 0.00 0.00 0.99 0.00 0.00 76 V 8.46 4.11 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 0.85 0.00 0.00 1.01 0.00 0.00 77 E 10.15 4.45 0.00 1.96 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 2.27 2.44 0.00 78 G 7.49 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 0.00 0.00 0.00 79 N 8.18 4.97 0.00 2.63 2.79 0.00 0.00 7.15 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 8.05 4.85 0.00 1.38 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 2.72 2.62 0.00 81 Q 9.05 4.46 0.00 1.97 1.96 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 2.22 2.27 0.00 82 F 8.93 5.50 0.00 2.78 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 83 I 8.70 4.60 1.87 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 1.25 0.86 0.88 0.00 0.00 84 S 8.77 4.66 0.00 3.75 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 A 8.40 4.54 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 86 S 8.97 4.54 0.00 3.77 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 87 K 7.58 4.68 0.00 1.85 1.90 0.00 1.46 0.00 0.00 1.92 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.54 7.81 88 S 8.74 5.36 0.00 3.97 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 89 I 8.93 4.61 2.07 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.00 1.17 0.00 0.00 90 V 8.47 4.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.84 0.00 0.00 91 H 8.52 3.61 0.00 2.72 2.94 0.00 5.65 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 92 P 0.00 4.26 0.00 2.17 2.17 0.00 2.85 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.92 0.00 93 S 7.79 4.68 0.00 3.94 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 94 Y 8.16 4.35 0.00 3.03 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 95 N 8.42 4.55 0.00 2.57 2.44 0.00 0.00 6.56 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 96 S 7.67 3.99 0.00 3.96 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 97 N 8.09 4.35 0.00 2.79 2.79 0.00 0.00 6.83 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 98 T 8.07 4.03 4.12 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 1.10 0.00 0.00 99 L 7.60 3.75 0.00 1.37 1.69 0.86 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 100 N 7.70 4.39 0.00 2.75 2.66 0.00 0.00 7.24 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 0.00 101 N 8.70 4.97 0.00 2.95 2.66 0.00 0.00 7.21 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 7.58 4.60 0.00 3.20 2.64 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 0.00 103 I 7.08 5.02 1.40 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 1.51 1.24 -0.02 0.00 0.00 104 M 9.22 5.43 0.00 2.08 2.28 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.62 0.00 105 L 9.15 5.45 0.00 1.76 1.86 1.01 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.10 4.96 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.95 0.94 0.00 0.00 107 K 8.44 3.82 0.00 0.79 1.01 0.00 1.42 0.00 0.00 1.37 0.00 0.00 2.69 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.74 0.21 7.81 108 L 7.99 4.77 0.00 1.54 1.49 0.95 1.06 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 K 8.83 4.21 0.00 1.70 1.89 0.00 1.52 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.36 7.81 110 S 7.76 4.66 0.00 3.92 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 0.00 111 A 8.37 4.42 1.24 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 0.00 112 A 8.77 4.23 1.24 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 0.00 113 S 9.29 4.45 0.00 3.72 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 0.00 114 L 8.46 4.51 0.00 1.64 1.62 0.96 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 0.00 115 N 8.66 4.55 0.00 2.84 2.91 0.00 0.00 6.85 7.68 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 0.00 116 S 8.92 4.45 0.00 4.01 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 0.00 117 R 8.89 4.18 0.00 2.05 2.02 0.00 3.12 0.00 0.00 3.10 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.55 4.91 0.00 3.85 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 8.37 4.41 0.00 2.91 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 0.00 129 A 8.05 4.26 1.02 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 0.00 130 S 8.03 4.52 0.00 3.81 3.72 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 0.00 0.00 0.00 0.00 *132 A 8.25 4.32 1.23 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 0.00 0.00 133 G 9.03 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 0.00 0.00 0.00 134 T 7.69 3.97 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 1.15 0.00 0.00 135 Q 8.61 4.58 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 136 C 9.28 5.26 0.00 2.77 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 0.00 137 L 8.86 5.15 0.00 1.79 1.58 1.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.09 5.59 1.87 0.00 0.00 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 0.75 1.37 1.03 0.00 0.00 139 S 8.38 4.87 0.00 3.53 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 0.00 140 G 7.72 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 0.00 141 W 8.83 4.96 0.00 3.19 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 8.32 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 0.00 143 N 7.96 3.68 0.00 2.14 2.53 0.00 0.00 7.08 8.52 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 0.00 144 T 8.16 5.10 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 1.26 0.00 0.00 145 K 7.80 4.65 0.00 1.70 1.89 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.31 1.36 7.81 146 S 8.70 4.29 0.00 4.06 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 0.00 147 S 8.10 4.37 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 0.00 148 G 9.25 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 0.00 0.00 0.00 149 T 8.03 4.91 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 1.51 0.00 0.00 150 S 9.66 4.57 0.00 3.85 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 8.82 4.87 0.00 2.90 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 0.00 152 P 0.00 4.63 0.00 2.42 2.08 0.00 4.03 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 1.99 0.00 153 D 8.71 4.63 0.00 2.80 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.45 5.15 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 1.03 0.00 0.00 0.96 0.00 0.00 155 L 8.22 3.31 0.00 1.29 1.22 -0.65 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.07 4.86 0.00 1.69 1.49 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.79 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.45 7.81 157 C 8.48 5.18 0.00 1.41 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 0.00 0.00 0.00 0.00 158 L 8.59 5.07 0.00 1.72 1.46 1.09 0.75 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 0.00 159 K 9.05 5.11 0.00 1.80 1.81 0.00 1.80 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.52 1.67 7.81 160 A 9.26 4.91 1.16 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 0.00 161 P 0.00 4.96 0.00 2.02 2.24 0.00 3.06 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.73 0.00 162 I 8.44 4.28 1.93 0.00 0.00 0.76 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 0.48 0.84 0.00 0.00 163 L 8.54 4.90 0.00 1.70 1.61 0.90 0.79 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 0.00 164 S 8.44 4.31 0.00 4.01 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 0.00 165 D 8.76 4.40 0.00 2.84 2.73 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 0.00 0.00 0.00 0.00 166 S 8.03 4.15 0.00 4.10 4.12 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 0.00 167 S 7.98 4.13 0.00 4.02 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 0.00 168 C 8.22 4.29 0.00 3.21 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 0.00 169 K 8.35 3.94 0.00 1.88 1.90 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.53 1.68 7.81 170 S 8.26 4.18 0.00 3.94 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 0.00 171 A 8.10 4.03 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 8.01 4.78 0.00 3.07 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 0.00 173 P 0.00 4.42 0.00 2.22 2.10 0.00 3.50 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 174 G 9.05 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 0.00 175 Q 8.01 4.54 0.00 2.46 2.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.55 6.72 0.00 0.00 0.00 0.00 0.00 2.28 2.55 0.00 176 I 7.91 4.31 1.97 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 1.81 0.91 0.98 0.00 0.00 177 T 8.24 4.49 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 1.26 0.00 0.00 178 S 8.56 4.44 0.00 4.01 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 0.00 179 N 8.19 5.15 0.00 2.93 3.07 0.00 0.00 6.68 8.04 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 0.00 180 M 8.03 5.49 0.00 1.87 2.10 0.00 0.00 0.00 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.63 0.00 181 F 8.82 5.12 0.00 3.01 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 0.00 182 C 8.91 5.39 0.00 2.98 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 0.00 183 A 9.09 5.00 1.17 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 0.00 0.00 184 G 6.97 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 0.00 0.00 0.00 184A Y 8.23 4.56 0.00 3.01 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 0.00 185 L 8.65 4.23 0.00 1.73 1.72 0.92 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 186 E 8.23 3.95 0.00 2.02 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 0.00 2.34 2.35 0.00 186D G 8.12 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 0.00 0.00 0.00 187 G 9.67 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 0.00 0.00 0.00 188 K 7.42 5.07 0.00 1.50 1.75 0.00 1.46 0.00 0.00 0.78 0.00 0.00 2.38 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.47 1.30 7.81 189 D 8.79 4.69 0.00 2.77 2.52 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 0.00 190 S 8.14 4.95 0.00 4.07 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 0.00 191 C 9.15 4.74 0.00 2.92 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 0.00 192 Q 8.57 4.40 0.00 2.31 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.17 0.00 0.00 0.00 0.00 0.00 2.56 2.54 0.00 193 G 9.21 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 0.00 0.00 0.00 0.00 194 D 8.32 4.60 0.00 3.00 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 8.09 4.41 0.00 3.97 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 0.00 196 G 8.83 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 0.00 0.00 0.00 0.00 197 G 7.70 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 0.00 0.00 0.00 0.00 198 P 0.00 5.07 0.00 2.37 2.39 0.00 3.70 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.17 0.00 199 V 8.48 4.42 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 0.79 0.00 0.00 0.59 0.00 0.00 200 V 8.60 4.86 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 0.93 0.00 0.00 0.65 0.00 0.00 201 C 8.80 5.07 0.00 2.79 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 9.82 3.72 0.00 3.94 3.89 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 0.00 203 G 8.43 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 0.00 204 K 7.64 4.72 0.00 1.71 1.62 0.00 1.85 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.33 4.22 0.00 1.50 1.63 0.99 0.76 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 0.00 210 Q 8.87 4.61 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.39 0.00 0.00 0.00 0.00 0.00 2.42 2.33 0.00 211 G 8.02 5.32 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 0.00 212 I 8.22 5.17 1.93 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 1.30 0.90 0.97 0.00 0.00 213 V 8.75 3.96 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 1.02 0.00 0.00 1.18 0.00 0.00 214 S 8.48 4.70 0.00 3.90 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 0.00 215 W 7.36 5.04 0.00 3.27 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 8.40 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 0.00 217 S 8.53 4.56 0.00 4.22 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 *219 G 8.04 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 0.00 0.00 0.00 220 C 8.05 4.81 0.00 2.95 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 0.00 221 A 9.09 3.93 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 221A Q 7.30 4.57 0.00 2.31 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.36 4.27 0.00 1.72 1.73 0.00 1.86 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.50 1.47 7.81 223 N 9.06 4.42 0.00 2.88 2.86 0.00 0.00 6.85 8.46 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 0.00 224 K 7.59 4.25 0.00 1.73 1.90 0.00 1.55 0.00 0.00 1.83 0.00 0.00 3.04 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.34 1.18 7.81 225 P 0.00 4.61 0.00 2.24 2.11 0.00 3.69 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 226 G 8.17 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.84 4.39 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 0.33 0.00 0.00 -0.88 0.00 0.00 228 Y 8.06 4.98 0.00 1.43 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 0.00 0.00 0.00 0.00 229 T 8.66 4.34 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 1.25 0.00 0.00 230 K 9.20 5.14 0.00 2.16 1.92 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.77 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.58 7.81 231 V 9.06 4.02 2.40 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 1.12 0.00 0.00 1.16 0.00 0.00 232 C 8.41 4.41 0.00 3.13 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 0.00 233 N 7.98 4.14 0.00 2.16 2.29 0.00 0.00 6.84 7.29 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 0.00 234 Y 8.10 4.79 0.00 3.27 3.29 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 0.00 235 V 7.78 3.69 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 1.14 0.00 0.00 1.02 0.00 0.00 236 S 8.10 4.12 0.00 4.14 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 0.00 237 W 8.29 4.14 0.00 3.49 3.60 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 0.00 238 I 8.27 3.01 2.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.05 0.73 0.00 0.00 239 K 8.12 3.78 0.00 1.83 1.77 0.00 1.59 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.58 7.81 240 Q 7.96 3.87 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.95 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 241 T 7.52 3.72 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 0.70 0.00 0.00 242 I 7.02 2.81 1.60 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 -0.30 -0.36 0.59 0.00 0.00 243 A 7.82 4.15 1.30 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 0.00 244 S 7.48 4.75 0.00 3.80 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 0.00 245 N 8.08 4.67 0.00 2.95 2.98 0.00 0.00 6.94 7.56 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 * Residues marked with a * may have inaccurate shift predictions.