NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 P 4.2332 0.0000 0.0000 62.5133 32.0993 174.9680 12 F 4.2505 7.3340 119.7504 54.0192 41.1460 174.3919 13 P 4.2567 0.0000 0.0000 65.0974 31.9813 177.5384 14 G 3.7736 8.3575 105.0887 44.8922 0.0000 173.5098 15 S 4.6829 7.7925 112.2070 57.5572 64.0998 175.7439 16 V 3.6026 7.8935 123.2252 66.0357 31.4816 177.3721 17 Q 4.1905 8.3003 119.4909 58.3736 28.4789 182.3845 18 D 4.4780 7.6596 115.7843 52.6985 40.0667 177.1595 19 P 5.6687 0.0000 0.0000 61.7149 32.9315 175.8035 20 G 3.7776 7.2604 106.3951 44.4384 0.0000 172.3340 21 L 5.1662 7.9705 124.9171 53.5336 45.2374 176.6024 22 H 4.4740 9.0174 121.6674 53.9973 33.1061 172.7434 23 V 4.8440 7.5131 115.1465 59.3789 35.6848 174.4976 24 W 5.5309 10.2561 125.2361 55.0751 33.4093 174.2472 25 R 3.7103 9.5485 125.9293 54.6518 30.8315 175.4004 26 V 3.2967 8.8005 130.3418 64.9980 31.1985 176.3714 27 E 3.9592 9.3834 129.5054 57.2104 28.5496 175.3635 28 K 4.4144 8.2670 118.0102 53.8525 35.2514 178.8443 29 L 4.5616 7.9191 122.7845 55.3236 43.0864 176.9153 30 K 4.3521 7.6242 121.0715 53.8268 33.8155 172.6053 31 P 4.9274 0.0000 0.0000 62.0830 32.5799 175.0902 32 V 4.5981 8.4574 124.5039 60.3189 33.6632 172.6904 33 P 4.9790 0.0000 0.0000 62.5232 32.3655 175.8720 34 V 3.9614 8.2967 124.4352 61.8357 32.4980 175.5255 35 A 3.8748 8.8534 129.7298 52.7206 18.5712 177.7520 36 Q 3.8958 8.8782 124.0372 59.4236 29.3072 178.6571 37 E 4.0812 8.2494 116.9058 59.5201 30.0042 178.7183 38 N 4.3609 7.9810 115.6127 55.6580 38.8455 175.6068 39 Q 3.9365 7.0658 115.6015 57.1560 29.3910 177.2270 40 G 3.5665 8.4845 108.7182 44.5593 0.0000 173.1194 41 V 5.0530 6.5655 118.1161 58.6116 34.0673 175.1944 42 F 4.2586 8.5940 122.6622 54.8839 42.0072 174.2601 43 F 4.9615 9.8534 128.1151 58.5763 40.4022 175.3845 44 S 4.7039 9.1902 119.7624 58.9064 64.0203 175.4758 45 G 3.4864 5.8574 108.9252 45.2132 0.0000 172.6970 46 D 5.4085 7.1475 118.8484 52.5550 44.9884 174.9150 47 S 5.3076 8.4993 114.2666 57.4549 66.7177 173.0364 48 Y 5.6198 10.5533 119.8666 56.5578 42.6905 174.2379 49 L 5.6990 10.0043 120.0188 53.2837 45.8100 176.4444 50 V 5.2211 9.4466 123.1564 59.9696 34.8084 174.2453 51 L 5.2859 10.5993 128.3598 54.1882 45.3150 175.1344 *52 H 6.1448 9.2021 124.1447 52.4194 31.9413 169.0717 53 N 5.3897 8.6893 120.1380 50.1797 40.1531 174.6519 54 G 4.0817 8.6071 111.9621 44.4417 0.0000 172.6224 55 P 4.4887 0.0000 0.0000 64.6724 31.3606 177.3168 56 E 4.7466 7.9178 112.8909 57.1702 36.4324 181.3333 57 E 4.2973 8.0250 112.5153 55.7161 30.4442 181.7658 58 V 4.0424 7.9718 116.0265 64.2487 32.6785 173.9384 59 S 5.0861 8.4507 113.7232 57.7663 67.3654 172.8342 60 H 5.3699 9.1435 121.5281 53.8370 31.8914 172.9179 61 L 4.9977 9.6925 125.9882 53.9615 44.2047 174.8346 62 H 5.4201 9.3298 124.0115 54.1984 32.0260 173.8343 63 L 5.1664 8.7013 122.7599 53.2340 44.0932 174.7964 64 W 4.9194 9.5583 135.0000 55.9597 32.6010 174.6380 65 I 4.4389 7.4266 121.7790 57.6253 39.1049 175.6483 66 G 3.2088 7.4778 114.3500 45.7488 0.0000 173.9987 67 Q 3.8683 8.6240 122.6984 58.4069 29.3221 177.2233 68 Q 4.4073 8.0191 115.2983 55.4108 28.9310 174.5992 69 S 4.8336 7.3246 113.2360 56.3252 63.2675 173.9301 70 S 4.0755 8.6031 121.3608 58.7770 62.4409 175.2932 71 R 3.9393 8.6361 125.6045 59.0919 30.3277 177.9774 72 D 4.6572 8.1962 119.2916 57.2544 41.7570 179.0136 73 E 3.8736 9.0192 119.8604 61.5728 29.5171 181.2366 74 Q 4.2280 8.1945 117.3147 58.9333 28.7910 178.4654 75 G 3.7400 8.3554 106.4391 48.2736 0.0000 174.6763 76 A 3.9415 8.0904 122.9366 55.2884 18.1473 178.8423 77 C 3.9689 8.2967 115.7067 62.6021 31.6059 175.8277 78 A 3.9913 8.4921 122.4554 55.1671 17.9881 179.4432 79 V 3.5069 8.3372 116.9878 66.4273 31.5737 177.9371 80 L 3.9411 8.0560 119.4277 57.9845 41.7260 178.7552 81 A 4.0323 8.2729 121.1236 55.6884 18.3824 179.0161 82 V 3.5294 8.1868 118.4530 67.3103 31.2802 178.5453 83 Q 4.0152 8.5251 119.7511 60.5622 27.7973 181.5410 84 L 4.2603 7.8683 120.4846 57.7934 42.0913 177.7023 85 D 4.5136 8.5831 118.4566 57.8159 40.9583 178.4538 86 D 4.4703 8.3712 119.1109 57.3414 40.7351 177.5633 87 Y 4.2593 7.6210 116.6881 58.9326 38.7514 175.9161 88 L 4.5797 7.3376 114.8510 53.2969 44.0294 174.3910 89 G 3.5911 8.9080 112.3095 46.6570 0.0000 172.9615 90 G 3.9872 8.8854 109.5026 47.6114 0.0000 174.4136 91 R 3.9742 12.0000 122.1665 59.1154 30.0749 174.8687 92 P 4.6600 0.0000 0.0000 62.7453 32.1973 175.5977 93 V 4.0679 8.8012 123.1376 62.2283 33.1730 174.5650 94 Q 5.4996 8.3377 125.3333 53.7977 31.0141 174.6924 95 H 4.9590 8.6248 119.3859 54.0143 33.4826 172.2156 96 R 4.7258 8.7485 122.7401 55.0400 31.2047 174.9212 97 E 4.5377 8.8606 127.1952 54.7466 31.6312 175.5545 98 V 4.2958 7.9391 117.8705 59.0821 34.2670 175.4916 99 Q 4.3456 7.5858 126.2132 57.6462 29.2796 176.5958 100 G 4.1500 11.3000 114.1456 45.6180 0.0000 173.5631 101 N 4.8255 7.3928 117.0042 52.1579 39.6349 173.0859 102 E 4.3161 8.1492 118.6056 56.1028 31.3067 176.9778 103 S 4.7758 8.1783 114.6376 57.5447 65.1956 174.8324 104 D 4.5466 8.8990 125.4122 56.5600 40.9610 177.9451 105 L 4.7397 7.6792 121.6154 56.2273 42.9310 177.5193 106 F 4.6492 10.4165 120.2457 62.1056 39.3182 177.0124 107 M 4.2219 8.8044 118.4264 58.5421 31.7591 178.6870 108 S 4.1604 7.9174 115.0951 61.2252 62.6718 175.6169 109 Y 4.0978 6.9520 117.4122 57.3455 37.8168 175.1346 110 F 4.8729 7.5268 118.9093 54.3809 41.8450 173.0741 111 P 4.0537 0.0000 0.0000 65.9146 29.9381 178.2873 112 R 3.9413 9.2945 113.4770 58.9134 30.0298 179.2293 113 G 4.2238 7.4149 102.4318 43.4471 0.0000 171.6586 114 L 4.4905 7.6011 119.7492 53.6379 43.3119 177.6704 115 K 4.3073 8.5485 121.0618 54.5971 34.5370 174.1447 116 Y 4.9228 8.1334 122.3257 58.0084 38.8657 175.4935 117 Q 4.7838 8.9495 123.6264 54.9118 32.0257 173.8622 118 E 4.9774 9.0425 119.0475 56.5811 32.3835 176.6500 119 G 3.7108 10.2976 112.7953 48.0079 0.0000 172.2830 120 G 3.7653 8.6063 108.0687 44.8152 0.0000 172.7904 121 V 4.3277 7.7896 113.4822 59.3986 35.0375 175.7721 122 E 3.9211 8.7530 118.2550 55.8853 30.2445 178.0594 123 S 4.3798 8.5544 114.4330 58.5697 63.9375 174.1503 124 G 3.8703 8.8307 105.0641 45.9878 0.0000 172.9485 125 F 4.0011 8.1296 121.4273 58.2468 39.3511 174.9243 126 K 4.5921 8.0375 127.0778 55.2557 34.1725 176.1298 127 H 4.7122 8.1894 120.3913 53.5881 29.2255 171.7861 128 V 3.4692 7.9324 122.4235 62.8521 31.6926 176.4411 129 V 3.9949 7.8682 128.1855 59.5361 30.3821 170.7620 130 P 3.9960 0.0000 0.0000 62.6537 31.4254 175.7750 131 N 4.6897 8.4103 122.7704 51.0505 38.8324 173.5929 132 E 4.0624 8.5240 125.7324 56.4997 30.3182 176.0761 133 V 4.6174 7.9917 121.6021 61.0537 35.0635 174.5875 134 V 4.2374 8.5349 126.2405 61.5060 33.0651 174.5275 135 V 4.6889 8.3754 128.2569 61.7019 32.7100 174.7535 136 Q 4.6798 8.7937 127.9683 54.9978 29.6162 175.2951 137 R 4.5585 8.9615 123.8114 54.2470 34.3408 173.3984 138 L 5.0304 7.9305 124.6693 53.4499 45.2572 174.5240 139 Y 4.8570 8.9852 123.6677 56.3403 41.0878 174.9225 140 Q 3.8531 8.8109 125.0348 53.8619 29.5118 174.8958 141 V 3.8425 7.4621 125.1454 63.2255 32.6711 175.3284 142 K 4.2056 7.7813 119.5205 55.0218 37.2825 172.9639 143 G 4.3208 9.0163 112.9808 45.0577 0.0000 172.7998 144 A 4.0816 8.4725 129.8089 54.9580 18.7660 177.9881 145 K 4.2634 7.8311 112.4345 58.0531 33.5686 176.3104 146 N 4.5953 7.7811 115.7813 52.3720 39.3690 174.1850 147 I 4.4629 8.2127 124.6663 60.4458 38.0780 175.7662 148 R 4.4522 8.6085 125.8475 54.3415 33.5598 174.3246 149 A 4.5344 8.5143 126.7448 50.9653 20.1366 176.0452 150 T 4.5843 8.0590 119.0524 61.6479 70.7519 174.1593 151 E 4.1244 9.1597 127.9273 56.8290 30.1552 175.9251 152 R 4.7405 9.1250 126.1709 53.9433 33.7824 174.9416 153 A 4.1641 8.2375 121.2609 51.3400 19.4683 178.8113 154 L 4.2677 7.8214 121.7401 53.5431 39.2846 175.7695 155 N 4.7994 7.6540 118.4296 51.3842 42.8543 175.1291 156 W 4.3044 8.6893 124.8931 59.8634 29.2509 177.7151 157 D 4.6004 8.1982 116.5616 56.4762 40.4397 177.4464 158 S 4.4225 8.4119 115.3909 60.5715 63.3937 175.1898 159 F 3.3334 8.0806 117.5344 56.9500 39.0320 173.7138 160 N 5.2835 8.5335 120.6503 52.3048 42.2816 173.8321 161 T 4.5151 8.8147 109.6642 62.1170 70.3098 176.2237 162 G 4.2897 8.8145 108.8123 46.1273 0.0000 172.8772 163 D 5.2792 8.3788 119.4032 52.6705 45.9400 174.3076 164 C 5.6064 8.5102 116.7954 58.9689 31.4410 172.8427 165 F 5.0731 9.5198 117.7133 56.2944 43.7234 173.6285 166 I 5.7516 8.8027 121.3135 58.8100 40.6837 174.7530 167 L 4.9472 8.7644 125.9783 53.0565 44.2763 175.2098 168 D 4.7226 9.2258 125.9844 52.9949 41.4508 176.1348 169 L 4.8893 8.7129 127.2217 54.1360 42.5832 179.6286 170 G 3.7109 8.9420 113.8171 46.9851 0.0000 177.1751 171 Q 4.2397 9.2079 122.5745 57.1117 29.5070 178.4447 172 N 5.5141 7.7696 111.1641 51.5602 42.4757 173.9529 173 I 5.6605 8.3458 122.8663 58.6108 41.3479 174.5506 174 F 5.1933 8.7810 122.2949 55.9350 43.4131 173.9397 175 A 5.9064 8.5811 125.1071 49.0240 18.8837 174.5372 176 W 4.9442 8.8404 130.9717 57.5584 32.8654 174.1080 177 C 5.0106 8.8293 124.7398 57.4640 30.5115 173.5749 178 G 3.7984 8.8773 111.7670 46.7222 0.0000 174.4470 179 G 3.5547 8.9586 114.5858 48.7030 0.0000 175.1221 180 K 4.5006 8.3297 120.6013 54.2533 31.9516 178.3170 181 S 4.9288 7.2537 114.1737 57.0248 65.4966 173.4291 182 N 4.6350 8.2141 118.4595 53.2005 39.2388 176.5418 183 I 3.9284 8.1404 119.6756 63.9141 37.2230 178.8248 184 L 3.9670 7.7746 119.6935 57.9207 41.6413 178.8563 185 E 3.9613 8.2506 118.0108 59.6851 29.3633 179.4255 186 R 3.9572 7.8514 118.1215 59.4422 30.0471 178.3045 187 N 4.4644 8.0474 115.8550 55.6722 38.4701 177.6017 188 K 3.8856 8.0428 119.8900 59.4066 32.1978 178.6791 189 A 4.0173 7.7589 120.6616 55.5626 18.2063 179.8618 190 R 3.9235 8.0754 114.0756 59.4659 29.3206 178.7912 191 D 4.2752 8.3923 119.7416 57.0363 40.9109 178.1971 192 L 3.8304 8.1114 120.7655 58.4110 41.9056 179.0653 193 A 4.0559 7.9160 118.7346 54.6796 18.0187 179.0151 194 L 4.0306 8.2088 119.4847 58.2104 42.0073 178.5155 195 A 3.9984 8.1810 121.1280 55.2000 18.2227 180.0104 196 I 3.5420 8.0176 119.7296 64.6905 37.2637 178.8967 197 R 4.2006 7.8898 122.7846 61.4055 29.7487 181.6215 198 D 4.5524 8.2985 122.0148 59.2103 39.8260 180.6067 199 S 4.5533 7.9762 116.7323 60.3566 62.8710 176.1691 200 E 3.9208 8.1949 125.7810 60.0628 29.6481 179.2644 201 R 4.2211 7.6571 114.4958 55.5334 30.0086 179.0087 202 Q 4.1603 8.7009 115.5770 57.0139 28.3110 172.8662 203 G 4.0242 8.6306 111.5479 46.7115 0.0000 176.1155 204 K 4.1835 7.9108 123.2826 53.6949 30.4567 177.0464 205 A 4.8282 7.5813 127.8980 51.1165 21.3071 175.7851 206 Q 4.3048 8.2624 121.5316 55.3543 30.4143 175.2965 207 V 4.8059 7.9505 121.1496 60.6416 34.8067 174.9133 208 E 4.6776 8.1045 123.8111 55.4501 33.7571 174.4390 209 I 4.2896 8.5794 126.3356 61.0984 38.3318 175.5611 210 V 4.6718 8.8129 126.1465 61.2754 34.6693 174.0565 211 T 4.5640 8.3059 117.1972 59.5052 71.0963 173.0721 212 D 3.8636 7.6817 124.3478 56.5229 41.3553 175.4960 213 G 4.3790 10.7252 119.5897 46.1652 0.0000 175.2649 214 E 4.5932 7.8712 117.9748 55.5203 29.5164 176.5871 215 E 3.9876 7.7745 117.2516 56.4482 29.6769 175.4595 216 P 4.4323 0.0000 0.0000 61.7011 32.3332 176.5297 217 A 4.0187 8.6300 120.6398 55.8479 17.7071 179.6112 218 E 3.8596 8.1475 115.3400 60.0280 29.7066 179.6027 219 M 3.8117 7.3933 118.1546 58.7202 32.0148 178.9705 220 I 4.2617 7.6386 122.6083 63.9388 37.2537 178.5757 221 Q 4.2725 8.3467 120.8617 58.6967 27.9539 181.5211 222 V 4.3218 7.1089 115.5648 65.3939 32.9939 177.2536 223 L 3.9438 7.7042 116.7812 57.1684 42.0323 177.7991 224 G 3.8762 8.8163 106.0852 43.4024 0.0000 170.0914 225 P 4.3116 0.0000 0.0000 62.0215 31.7791 175.9966 226 K 2.6337 8.3757 125.6654 55.0216 32.6642 174.2944 227 P 4.6150 0.0000 0.0000 61.3268 33.6608 174.8220 228 A 4.1897 8.1598 120.2162 52.2785 19.2418 176.7709 229 L 4.7520 8.1530 121.1747 53.3508 45.1572 177.2449 230 K 4.4045 8.3459 124.2785 54.2405 32.8978 178.5320 231 E 4.4669 7.9461 111.9976 56.8540 30.0684 176.7908 232 G 5.2551 7.1582 124.0868 46.7990 0.0000 172.3474 233 N 5.1948 7.8216 117.0366 49.8442 41.4056 178.1618 234 P 4.6634 0.0000 0.0000 61.9925 30.5164 177.5541 *245 A 4.0371 8.6244 124.9749 52.9531 18.9567 178.0499 246 Q 4.6815 8.2172 120.8866 53.8138 29.9867 171.4659 247 A 3.9868 8.3362 125.1706 54.5842 19.0530 178.3376 248 A 4.2511 7.3184 116.9898 51.9365 18.9623 176.7694 249 A 4.8798 9.2057 124.0816 50.2409 22.9310 174.4557 250 L 4.7867 8.5877 125.4882 53.8834 43.6958 175.0503 251 Y 5.2836 8.9627 122.7723 56.0566 42.4661 174.3693 252 K 4.1316 9.2071 121.7795 54.3157 36.0413 174.9621 253 V 4.7408 8.3526 126.0612 60.2000 34.2398 174.1381 254 S 5.1548 8.4672 121.1512 57.2588 65.9050 173.8949 255 D 5.4908 9.1426 123.2114 52.2227 39.9186 177.8798 256 A 3.9678 7.9159 124.5078 56.1505 18.2350 180.3624 257 T 4.0525 7.9838 102.7430 62.0613 68.0959 176.1160 258 G 4.0121 8.9357 109.5044 46.5345 0.0000 174.0737 259 Q 4.4276 7.5469 119.9729 54.2897 32.4829 173.0561 260 M 4.6651 8.6455 124.4603 55.6863 32.8193 174.4993 261 N 5.5467 9.0946 123.6380 51.4293 42.7984 173.2502 262 L 5.0609 8.9936 123.2514 53.7206 45.2550 175.3782 263 T 4.8776 8.7367 121.6568 61.8689 73.0865 173.6255 264 K 4.1181 8.5740 128.2094 55.0479 30.4546 177.0103 265 V 3.7539 7.9256 117.5237 63.7928 32.4498 175.7318 266 A 4.6752 7.9523 120.1227 51.1178 22.6858 176.7428 267 D 4.7891 8.6870 116.1484 52.8285 41.2351 175.6286 268 S 4.6114 7.8250 115.6743 57.3924 64.6891 174.3926 269 S 3.2886 8.2465 116.3168 60.8429 62.2295 173.5692 270 P 4.3590 0.0000 0.0000 62.6496 29.9241 174.8553 271 F 4.4853 7.6799 122.7313 56.9408 40.3479 174.4229 272 A 4.3896 8.6858 125.7347 51.5863 18.9590 177.8111 273 L 3.8225 9.1621 125.3018 58.2707 42.4210 178.7089 274 E 3.8251 8.4239 116.5712 59.6976 29.5976 178.3965 275 L 3.9292 7.7766 117.5114 57.7397 41.7918 178.0296 276 L 2.5801 7.2762 118.8156 53.8924 41.7425 176.3907 277 I 4.2737 7.0593 125.0028 59.8798 38.1863 176.8723 278 S 4.6496 8.8653 121.2808 60.4028 62.9410 174.6908 279 D 4.9462 8.1922 119.1278 54.1006 41.7322 174.2123 280 D 5.8500 8.4573 117.1185 53.0197 46.1516 173.8044 281 C 5.5392 8.8758 116.5638 58.8028 31.2346 173.3249 282 F 5.0632 9.6943 118.8212 55.9250 43.9013 174.2336 283 V 4.7263 8.8966 119.3159 61.6088 34.7210 174.1666 284 L 4.8903 9.3626 132.2466 53.7118 42.7130 174.4084 285 D 4.9435 9.3252 127.2869 53.9786 42.1866 176.2235 286 N 4.8749 8.7417 121.9993 53.7304 41.1212 175.7182 287 G 3.0372 7.6745 107.7751 48.2594 0.0000 175.5075 288 L 4.0656 7.6497 120.3769 57.8974 42.5706 177.5325 289 C 4.7641 8.4686 112.9066 55.9571 30.4546 170.7696 290 G 3.8715 7.9398 116.5392 45.8256 0.0000 175.5568 291 K 4.8455 9.0705 125.2823 53.2869 36.2839 177.6588 292 I 4.8330 8.5892 119.8699 60.7709 40.0320 174.9782 293 Y 5.1704 8.9617 125.1092 57.0841 40.5223 175.3497 294 I 5.0275 8.5810 121.4405 59.6330 40.8128 174.0801 295 W 5.7019 9.2822 135.0000 56.0317 32.4768 175.5616 296 K 4.8979 8.2385 130.3837 53.3201 34.1206 172.7946 297 G 3.7747 8.4696 111.6903 44.4801 0.0000 174.8383 298 R 3.8895 8.7556 122.8419 59.5346 30.1279 178.8530 299 K 4.2933 7.7020 115.5373 54.5013 32.2511 178.8562 300 A 4.7478 7.8254 121.2479 52.6419 18.9249 178.3308 301 N 4.7715 8.5733 119.5088 52.3209 40.8455 175.1124 302 E 4.0430 8.5548 118.6086 59.1340 29.8572 178.7112 303 K 3.9404 8.0876 118.1795 59.6058 32.0503 178.8739 304 E 4.0060 8.3510 121.3359 59.8815 29.2378 180.2578 305 R 3.9173 7.6449 120.6426 61.4742 29.4559 180.0916 306 Q 4.1438 9.6874 120.3992 59.3480 28.9865 178.8698 307 A 3.9287 8.6361 121.4644 55.0896 18.2207 179.3878 308 A 3.9088 8.1525 118.7270 55.1417 18.5433 179.6622 309 L 4.0390 7.6697 117.8413 58.1054 41.6358 179.6559 310 Q 3.9980 7.7862 117.8360 58.5200 28.5200 178.7592 311 V 3.4669 7.6063 119.0891 65.0539 31.6511 177.8227 312 A 3.6423 7.3728 120.5019 55.0921 18.1406 178.9937 313 E 3.9850 8.1291 116.7814 59.6044 29.5414 179.4230 314 G 4.0855 8.0229 105.6889 48.0334 0.0000 175.5785 315 F 4.5423 8.1042 119.8503 60.8597 39.0247 177.9166 316 I 4.4164 7.9615 119.0920 64.5073 36.8990 178.2173 317 S 4.0762 8.7289 114.4620 61.5253 62.0531 176.2620 318 R 3.8490 8.1529 121.2062 59.6248 29.9702 177.3284 319 M 3.9959 7.6739 113.7145 54.7683 32.4136 175.9637 320 Q 3.3461 7.3487 116.9896 57.1547 26.8300 173.3929 321 Y 4.3981 8.2606 114.0608 57.1145 39.1507 176.2279 322 A 4.0850 8.7540 124.2850 51.9578 19.1757 176.3252 323 P 4.4172 0.0000 0.0000 66.0261 31.5063 178.0305 324 N 4.8177 8.0472 113.0976 52.9348 37.0556 174.7173 325 T 4.1085 7.4642 116.2022 64.4506 69.1254 173.8012 326 Q 4.4776 8.2154 125.5317 54.6151 30.9067 175.5592 327 V 5.2103 8.0015 123.4670 59.3872 30.9740 172.7649 328 E 4.1526 7.9466 128.1036 56.5736 30.8713 175.1649 329 I 4.5037 8.3838 129.0073 61.1514 38.2483 175.4659 330 L 4.7240 8.9254 127.6593 52.1761 44.0628 174.5572 331 P 4.5543 0.0000 0.0000 61.5910 33.4355 175.2282 332 Q 3.5419 7.6312 122.8583 57.7305 28.9694 174.6449 333 G 4.3172 10.3245 117.0165 45.8083 0.0000 175.0707 334 R 4.3752 6.8159 118.2507 54.7580 29.4354 176.4216 335 E 4.2097 7.3990 117.0032 54.7621 31.5705 177.1694 336 S 4.2619 8.1562 117.4592 57.3153 63.8788 173.4511 337 P 4.1631 0.0000 0.0000 65.3027 31.5161 177.4597 338 I 3.9361 7.2430 117.5420 63.5426 38.2106 176.3655 339 F 3.7309 7.7154 120.8822 61.2468 39.1105 176.1367 340 K 4.3937 7.6258 119.9658 55.7376 30.2491 176.4725 341 Q 4.7425 8.3370 126.5495 55.6847 29.1189 175.6520 342 F 5.1742 8.1463 114.8248 56.0246 41.9815 174.8637 343 F 3.8351 8.2543 120.6083 62.6077 39.4526 175.5086 344 K 3.9191 8.5064 121.3732 56.0113 33.4090 177.0556 345 D 4.3819 8.5697 121.4781 53.1330 39.8666 173.8941 346 W 4.5356 8.9370 133.4455 56.7541 30.7775 175.6720 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 11 P 0.00 4.23 0.00 2.04 2.07 0.00 3.41 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 1.65 1.86 0.00 12 F 7.33 4.25 0.00 2.75 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 13 P 0.00 4.26 0.00 2.26 2.30 0.00 3.81 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 2.18 2.33 0.00 14 G 8.36 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 15 S 7.79 4.68 0.00 4.05 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 16 V 7.89 3.60 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 0.71 0.00 0.00 0.68 0.00 0.00 17 Q 8.30 4.19 0.00 2.11 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.52 0.00 0.00 0.00 0.00 0.00 2.26 1.92 0.00 18 D 7.66 4.48 0.00 2.68 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 19 P 0.00 5.67 0.00 2.05 2.17 0.00 3.72 0.00 0.00 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.08 0.00 20 G 7.26 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 21 L 7.97 5.17 0.00 1.47 1.34 0.85 0.82 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 22 H 9.02 4.47 0.00 2.05 1.95 0.00 5.80 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.51 4.84 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 0.87 0.00 0.00 0.77 0.00 0.00 24 W 10.26 5.53 0.00 3.31 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 25 R 9.55 3.71 0.00 1.51 1.64 0.00 3.32 0.00 0.00 3.13 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.50 0.00 26 V 8.80 3.30 2.26 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 0.77 0.00 0.00 1.00 0.00 0.00 27 E 9.38 3.96 0.00 2.04 1.61 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 2.26 2.13 0.00 28 K 8.27 4.41 0.00 1.74 1.52 0.00 1.74 0.00 0.00 1.76 0.00 0.00 2.96 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.26 0.96 7.81 29 L 7.92 4.56 0.00 1.68 1.76 0.87 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 30 K 7.62 4.35 0.00 1.71 1.63 0.00 1.67 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.38 1.32 7.81 31 P 0.00 4.93 0.00 1.88 1.80 0.00 3.51 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.84 0.00 32 V 8.46 4.60 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 1.04 0.00 0.00 1.00 0.00 0.00 33 P 0.00 4.98 0.00 2.16 2.25 0.00 3.95 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.23 0.00 34 V 8.30 3.96 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 0.69 0.00 0.00 1.08 0.00 0.00 35 A 8.85 3.87 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 36 Q 8.88 3.90 0.00 1.96 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 7.02 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 37 E 8.25 4.08 0.00 2.04 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 2.38 2.31 0.00 38 N 7.98 4.36 0.00 2.81 2.82 0.00 0.00 7.12 6.90 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 39 Q 7.07 3.94 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.43 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 40 G 8.48 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 41 V 6.57 5.05 1.99 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 0.96 0.00 0.00 1.00 0.00 0.00 42 F 8.59 4.26 0.00 1.82 1.55 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 43 F 9.85 4.96 0.00 3.12 3.21 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 44 S 9.19 4.70 0.00 4.10 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 45 G 5.86 3.49 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 46 D 7.15 5.41 0.00 2.87 2.53 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 47 S 8.50 5.31 0.00 3.75 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 48 Y 10.55 5.62 0.00 3.47 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 49 L 10.00 5.70 0.00 2.14 2.02 1.17 1.27 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 50 V 9.45 5.22 2.44 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 1.24 0.00 0.00 0.93 0.00 0.00 51 L 10.60 5.29 0.00 2.05 1.78 1.05 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 *52 H 9.20 6.14 0.00 2.62 2.87 0.00 7.19 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 N 8.69 5.39 0.00 2.83 2.97 0.00 0.00 6.16 6.99 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 54 G 8.61 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 P 0.00 4.49 0.00 2.06 2.13 0.00 3.71 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 2.09 0.00 56 E 7.92 4.75 0.00 1.95 1.78 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 2.17 2.12 0.00 57 E 8.03 4.30 0.00 1.98 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 2.23 1.87 0.00 58 V 7.97 4.04 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 0.92 0.00 0.00 0.98 0.00 0.00 59 S 8.45 5.09 0.00 3.81 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 60 H 9.14 5.37 0.00 3.20 3.22 0.00 5.75 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 L 9.69 5.00 0.00 1.70 1.57 1.13 0.96 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 62 H 9.33 5.42 0.00 3.26 3.30 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 L 8.70 5.17 0.00 1.86 1.58 0.99 0.84 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 64 W 9.56 4.92 0.00 3.34 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 65 I 7.43 4.44 1.57 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 0.93 1.18 0.74 0.00 0.00 66 G 7.48 3.21 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 67 Q 8.62 3.87 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 7.16 0.00 0.00 0.00 0.00 0.00 2.29 2.21 0.00 68 Q 8.02 4.41 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.21 0.00 69 S 7.32 4.83 0.00 3.83 3.63 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 70 S 8.60 4.08 0.00 3.86 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 71 R 8.64 3.94 0.00 1.80 1.96 0.00 3.21 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 72 D 8.20 4.66 0.00 2.69 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 73 E 9.02 3.87 0.00 1.86 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 2.26 2.27 0.00 74 Q 8.19 4.23 0.00 2.24 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.26 2.51 0.00 75 G 8.36 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 0.00 0.00 0.00 76 A 8.09 3.94 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 77 C 8.30 3.97 0.00 3.18 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 78 A 8.49 3.99 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 79 V 8.34 3.51 2.28 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 0.98 0.00 0.00 0.96 0.00 0.00 80 L 8.06 3.94 0.00 1.95 1.87 0.66 0.84 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 81 A 8.27 4.03 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 82 V 8.19 3.53 2.31 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 1.00 0.00 0.00 1.01 0.00 0.00 83 Q 8.53 4.02 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.59 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 84 L 7.87 4.26 0.00 1.78 2.02 -0.64 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 85 D 8.58 4.51 0.00 2.76 2.83 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 86 D 8.37 4.47 0.00 3.04 2.72 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 87 Y 7.62 4.26 0.00 2.92 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 88 L 7.34 4.58 0.00 1.84 1.65 0.93 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 89 G 8.91 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 G 8.89 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 91 R 12.00 3.97 0.00 2.31 2.02 0.00 3.28 0.00 0.00 3.56 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 92 P 0.00 4.66 0.00 2.00 2.01 0.00 4.07 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 93 V 8.80 4.07 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 0.83 0.00 0.00 0.79 0.00 0.00 94 Q 8.34 5.50 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.49 0.00 0.00 0.00 0.00 0.00 2.28 2.19 0.00 95 H 8.62 4.96 0.00 3.19 3.25 0.00 5.59 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 R 8.75 4.73 0.00 1.81 1.82 0.00 3.16 0.00 0.00 3.20 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.61 0.00 97 E 8.86 4.54 0.00 1.53 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 2.16 1.83 0.00 98 V 7.94 4.30 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 0.80 0.00 0.00 0.84 0.00 0.00 99 Q 7.59 4.35 0.00 1.94 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.37 0.00 0.00 0.00 0.00 0.00 2.04 1.16 0.00 100 G 11.30 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 0.00 101 N 7.39 4.83 0.00 2.63 2.71 0.00 0.00 7.17 9.00 0.00 0.00 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 E 8.15 4.32 0.00 2.35 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.63 0.00 103 S 8.18 4.78 0.00 4.03 4.51 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 0.00 104 D 8.90 4.55 0.00 2.70 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 0.00 105 L 7.68 4.74 0.00 1.79 1.77 0.84 1.13 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 0.00 106 F 10.42 4.65 0.00 3.45 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 0.00 107 M 8.80 4.22 0.00 2.09 2.15 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 3.15 0.00 108 S 7.92 4.16 0.00 3.08 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 0.00 109 Y 6.95 4.10 0.00 1.43 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 0.00 0.00 0.00 0.00 110 F 7.53 4.87 0.00 2.89 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 0.00 111 P 0.00 4.05 0.00 2.16 1.91 0.00 3.89 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 2.02 1.98 0.00 112 R 9.29 3.94 0.00 1.85 1.93 0.00 3.29 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.24 0.00 113 G 7.41 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 0.00 0.00 0.00 0.00 114 L 7.60 4.49 0.00 1.15 1.22 1.16 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 115 K 8.55 4.31 0.00 1.60 1.67 0.00 1.62 0.00 0.00 1.60 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.29 1.30 7.81 116 Y 8.13 4.92 0.00 2.97 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 0.00 117 Q 8.95 4.78 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.38 0.00 118 E 9.04 4.98 0.00 2.07 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.60 0.00 119 G 10.30 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 0.00 120 G 8.61 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 0.00 121 V 7.79 4.33 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 0.31 0.00 0.00 0.22 0.00 0.00 122 E 8.75 3.92 0.00 1.98 1.78 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 2.24 1.91 0.00 123 S 8.55 4.38 0.00 4.00 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 0.00 124 G 8.83 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 0.00 125 F 8.13 4.00 0.00 3.23 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 0.00 126 K 8.04 4.59 0.00 1.66 1.69 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.64 7.81 127 H 8.19 4.71 0.00 3.18 3.26 0.00 5.76 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 V 7.93 3.47 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 0.76 0.00 0.00 0.83 0.00 0.00 129 V 7.87 3.99 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 0.86 0.00 0.00 0.78 0.00 0.00 130 P 0.00 4.00 0.00 2.06 2.02 0.00 3.66 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 131 N 8.41 4.69 0.00 2.76 2.71 0.00 0.00 7.16 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 0.00 132 E 8.52 4.06 0.00 2.22 1.86 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 2.30 1.89 0.00 133 V 7.99 4.62 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 0.87 0.00 0.00 0.91 0.00 0.00 134 V 8.53 4.24 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 0.81 0.00 0.00 0.94 0.00 0.00 135 V 8.38 4.69 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 0.92 0.00 0.00 0.97 0.00 0.00 136 Q 8.79 4.68 0.00 1.94 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.60 6.45 0.00 0.00 0.00 0.00 0.00 2.35 2.29 0.00 137 R 8.96 4.56 0.00 1.70 1.19 0.00 2.76 0.00 0.00 3.50 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.41 0.00 138 L 7.93 5.03 0.00 1.60 1.25 0.60 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 139 Y 8.99 4.86 0.00 2.89 2.82 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 0.00 140 Q 8.81 3.85 0.00 1.83 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.94 0.00 0.00 0.00 0.00 0.00 1.96 1.38 0.00 141 V 7.46 3.84 1.99 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 0.73 0.00 0.00 0.88 0.00 0.00 142 K 7.78 4.21 0.00 1.67 1.58 0.00 1.72 0.00 0.00 1.63 0.00 0.00 3.09 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.20 1.18 7.81 143 G 9.02 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 0.00 0.00 0.00 0.00 144 A 8.47 4.08 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 0.00 145 K 7.83 4.26 0.00 2.00 1.84 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.91 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.37 1.01 7.81 146 N 7.78 4.60 0.00 2.76 2.72 0.00 0.00 6.94 7.46 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 0.00 147 I 8.21 4.46 1.83 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 1.32 0.34 0.85 0.00 0.00 148 R 8.61 4.45 0.00 1.65 1.77 0.00 3.08 0.00 0.00 3.15 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 149 A 8.51 4.53 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 0.00 150 T 8.06 4.58 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 151 E 9.16 4.12 0.00 1.85 1.86 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 2.17 2.09 0.00 152 R 9.13 4.74 0.00 1.62 1.74 0.00 3.41 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.73 0.00 153 A 8.24 4.16 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 0.00 154 L 7.82 4.27 0.00 1.46 1.52 0.84 0.73 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 0.00 155 N 7.65 4.80 0.00 2.80 2.54 0.00 0.00 7.05 7.95 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 0.00 156 W 8.69 4.30 0.00 3.27 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 0.00 157 D 8.20 4.60 0.00 2.65 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 0.00 158 S 8.41 4.42 0.00 3.99 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 0.00 159 F 8.08 3.33 0.00 2.61 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 0.00 0.00 0.00 0.00 160 N 8.53 5.28 0.00 2.80 2.98 0.00 0.00 6.98 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 0.00 161 T 8.81 4.52 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 1.38 0.00 0.00 162 G 8.81 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 0.00 163 D 8.38 5.28 0.00 2.98 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 0.00 164 C 8.51 5.61 0.00 2.92 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 0.00 165 F 9.52 5.07 0.00 3.08 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 0.00 166 I 8.80 5.75 2.13 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 1.35 1.32 1.04 0.00 0.00 167 L 8.76 4.95 0.00 1.82 1.69 0.92 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 168 D 9.23 4.72 0.00 2.92 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 0.00 169 L 8.71 4.89 0.00 1.89 1.71 1.02 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 170 G 8.94 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 0.00 171 Q 9.21 4.24 0.00 1.99 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.81 0.00 0.00 0.00 0.00 0.00 2.37 1.96 0.00 172 N 7.77 5.51 0.00 2.61 2.42 0.00 0.00 6.67 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 0.00 173 I 8.35 5.66 1.78 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 1.21 0.72 1.00 0.00 0.00 174 F 8.78 5.19 0.00 3.10 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 0.00 175 A 8.58 5.91 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176 W 8.84 4.94 0.00 3.66 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 0.00 177 C 8.83 5.01 0.00 2.67 2.72 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 0.00 178 G 8.88 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 0.00 0.00 0.00 179 G 8.96 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 180 K 8.33 4.50 0.00 1.75 1.68 0.00 1.78 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.34 1.23 7.81 181 S 7.25 4.93 0.00 4.24 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 0.00 182 N 8.21 4.63 0.00 2.92 2.89 0.00 0.00 7.38 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 183 I 8.14 3.93 1.87 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 1.63 1.19 0.91 0.00 0.00 184 L 7.77 3.97 0.00 1.68 1.71 0.92 0.97 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 0.00 185 E 8.25 3.96 0.00 2.24 2.03 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 2.41 2.39 0.00 186 R 7.85 3.96 0.00 1.92 2.09 0.00 3.08 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.69 0.00 187 N 8.05 4.46 0.00 2.92 2.84 0.00 0.00 6.99 8.14 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 0.00 188 K 8.04 3.89 0.00 1.99 1.84 0.00 1.90 0.00 0.00 1.64 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.45 7.81 189 A 7.76 4.02 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 0.00 190 R 8.08 3.92 0.00 2.14 2.24 0.00 2.83 0.00 0.00 3.18 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.95 0.00 191 D 8.39 4.28 0.00 2.97 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 0.00 192 L 8.11 3.83 0.00 1.81 1.81 0.80 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 193 A 7.92 4.06 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 0.00 194 L 8.21 4.03 0.00 2.09 1.76 0.91 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 195 A 8.18 4.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 I 8.02 3.54 2.02 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.83 1.06 0.00 0.00 197 R 7.89 4.20 0.00 1.85 1.92 0.00 3.27 0.00 0.00 3.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 198 D 8.30 4.55 0.00 2.65 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 0.00 199 S 7.98 4.55 0.00 3.84 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 0.00 200 E 8.19 3.92 0.00 2.19 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 0.00 2.32 2.31 0.00 201 R 7.66 4.22 0.00 1.78 1.82 0.00 3.42 0.00 0.00 3.15 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.42 0.00 202 Q 8.70 4.16 0.00 2.13 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.18 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 203 G 8.63 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 0.00 204 K 7.91 4.18 0.00 1.79 1.66 0.00 1.91 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.35 1.00 7.81 205 A 7.58 4.83 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 0.00 206 Q 8.26 4.30 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.66 0.00 0.00 0.00 0.00 0.00 2.33 2.28 0.00 207 V 7.95 4.81 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 1.13 0.00 0.00 0.89 0.00 0.00 208 E 8.10 4.68 0.00 1.89 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 2.33 2.33 0.00 209 I 8.58 4.29 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 1.27 0.40 1.03 0.00 0.00 210 V 8.81 4.67 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 1.26 0.00 0.00 1.28 0.00 0.00 211 T 8.31 4.56 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 0.00 212 D 7.68 3.86 0.00 2.01 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 0.00 213 G 10.73 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 0.00 0.00 0.00 0.00 214 E 7.87 4.59 0.00 2.11 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 2.33 2.24 0.00 215 E 7.77 3.99 0.00 2.12 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 0.00 2.52 2.51 0.00 216 P 0.00 4.43 0.00 2.14 2.08 0.00 3.41 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 1.86 2.16 0.00 217 A 8.63 4.02 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 0.00 218 E 8.15 3.86 0.00 2.08 2.15 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 2.57 2.59 0.00 219 M 7.39 3.81 0.00 1.93 2.06 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 2.23 0.00 220 I 7.64 4.26 2.03 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 1.65 1.16 0.96 0.00 0.00 221 Q 8.35 4.27 0.00 2.11 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.23 0.00 222 V 7.11 4.32 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 0.93 0.00 0.00 0.94 0.00 0.00 223 L 7.70 3.94 0.00 1.36 0.64 -0.67 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 224 G 8.82 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 0.00 225 P 0.00 4.31 0.00 2.13 2.07 0.00 3.84 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.94 0.00 226 K 8.38 2.63 0.00 0.79 1.26 0.00 1.17 0.00 0.00 1.36 0.00 0.00 2.82 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.66 0.21 7.81 227 P 0.00 4.61 0.00 2.08 1.94 0.00 2.89 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.84 0.00 228 A 8.16 4.19 1.20 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 0.00 229 L 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 A 7.32 4.25 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 0.00 249 A 9.21 4.88 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 0.00 250 L 8.59 4.79 0.00 0.39 0.95 1.08 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 251 Y 8.96 5.28 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 0.00 252 K 9.21 4.13 0.00 0.79 1.26 0.00 1.43 0.00 0.00 1.44 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.75 0.51 7.81 253 V 8.35 4.74 2.03 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 1.05 0.00 0.00 0.84 0.00 0.00 254 S 8.47 5.15 0.00 3.98 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 0.00 255 D 9.14 5.49 0.00 2.88 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 1.14 0.00 0.00 264 K 8.57 4.12 0.00 1.60 1.46 0.00 1.47 0.00 0.00 1.51 0.00 0.00 2.62 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.89 0.21 7.81 265 V 7.93 3.75 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 0.78 0.00 0.00 0.96 0.00 0.00 266 A 7.95 4.68 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 0.00 267 D 8.69 4.79 0.00 2.68 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 0.00 268 S 7.82 4.61 0.00 3.81 3.73 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 0.00 269 S 8.25 3.29 0.00 3.63 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 0.00 270 P 0.00 4.36 0.00 2.06 2.27 0.00 3.58 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.15 0.00 271 F 7.68 4.49 0.00 1.70 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 0.00 0.00 0.00 272 A 8.69 4.39 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 0.00 273 L 9.16 3.82 0.00 1.64 1.59 -0.09 0.13 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 0.00 274 E 8.42 3.83 0.00 1.93 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 2.30 2.39 0.00 275 L 7.78 3.93 0.00 1.94 1.71 0.86 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 276 L 7.28 2.58 0.00 1.10 0.45 0.07 -1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 277 I 7.06 4.27 2.30 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.61 1.24 0.00 0.00 278 S 8.87 4.65 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 0.00 279 D 8.19 4.95 0.00 2.74 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 0.00 280 D 8.46 5.85 0.00 2.94 2.83 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 0.00 281 C 8.88 5.54 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 0.00 282 F 9.69 5.06 0.00 3.06 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 0.00 283 V 8.90 4.73 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 1.00 0.00 0.00 0.91 0.00 0.00 284 L 9.36 4.89 0.00 2.31 2.18 1.15 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 285 D 9.33 4.94 0.00 3.17 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 0.00 286 N 8.74 4.87 0.00 3.01 3.02 0.00 0.00 6.61 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 287 G 7.67 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 0.00 0.00 0.00 288 L 7.65 4.07 0.00 1.82 1.82 1.08 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 289 C 8.47 4.76 0.00 3.08 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 0.00 290 G 7.94 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 0.00 291 K 9.07 4.85 0.00 1.44 1.67 0.00 1.73 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.34 1.00 7.81 292 I 8.59 4.83 1.77 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 1.24 0.39 0.93 0.00 0.00 293 Y 8.96 5.17 0.00 3.33 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 0.00 294 I 8.58 5.03 1.94 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 1.17 0.90 1.05 0.00 0.00 295 W 9.28 5.70 0.00 3.29 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 0.00 296 K 8.24 4.90 0.00 1.46 1.64 0.00 1.84 0.00 0.00 1.82 0.00 0.00 2.76 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.34 0.97 7.81 297 G 8.47 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 0.00 298 R 8.76 3.89 0.00 1.79 1.98 0.00 3.20 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 299 K 7.70 4.29 0.00 1.74 1.70 0.00 1.81 0.00 0.00 1.71 0.00 0.00 2.93 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.35 1.25 7.81 300 A 7.83 4.75 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 0.00 0.00 0.00 0.00 0.00 301 N 8.57 4.77 0.00 2.94 3.02 0.00 0.00 5.84 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 0.00 302 E 8.55 4.04 0.00 2.09 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 0.00 2.34 2.44 0.00 303 K 8.09 3.94 0.00 1.93 1.85 0.00 1.73 0.00 0.00 1.97 0.00 0.00 2.92 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.53 1.49 7.81 304 E 8.35 4.01 0.00 2.27 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 0.00 2.49 2.33 0.00 305 R 7.64 3.92 0.00 1.79 1.93 0.00 3.29 0.00 0.00 3.09 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.50 0.00 306 Q 9.69 4.14 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 307 A 8.64 3.93 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 0.00 308 A 8.15 3.91 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 0.00 309 L 7.67 4.04 0.00 1.81 1.68 0.90 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 310 Q 7.79 4.00 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.78 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 311 V 7.61 3.47 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 0.02 0.00 0.00 0.81 0.00 0.00 312 A 7.37 3.64 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 0.00 313 E 8.13 3.98 0.00 2.19 1.96 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 2.52 2.29 0.00 314 G 8.02 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 0.00 315 F 8.10 4.54 0.00 3.27 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 0.00 316 I 7.96 4.42 2.10 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 1.60 0.79 1.08 0.00 0.00 317 S 8.73 4.08 0.00 3.86 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 0.00 318 R 8.15 3.85 0.00 1.82 2.20 0.00 3.33 0.00 0.00 3.24 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 319 M 7.67 4.00 0.00 0.89 1.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.29 0.00 320 Q 7.35 3.35 0.00 2.07 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.95 0.00 0.00 0.00 0.00 0.00 2.28 2.40 0.00 321 Y 8.26 4.40 0.00 2.97 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 0.00 322 A 8.75 4.08 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 0.00 323 P 0.00 4.42 0.00 2.32 2.34 0.00 3.46 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.09 0.00 324 N 8.05 4.82 0.00 2.83 2.95 0.00 0.00 6.04 7.71 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 0.00 325 T 7.46 4.11 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 326 Q 8.22 4.48 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.84 0.00 0.00 0.00 0.00 0.00 2.28 2.35 0.00 327 V 8.00 5.21 2.03 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 0.80 0.00 0.00 0.95 0.00 0.00 328 E 7.95 4.15 0.00 2.04 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 329 I 8.38 4.50 1.86 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 1.35 0.64 0.93 0.00 0.00 330 L 8.93 4.72 0.00 1.22 1.20 0.60 0.81 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 0.00 331 P 0.00 4.55 0.00 1.93 2.01 0.00 3.80 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 1.91 1.84 0.00 332 Q 7.63 3.54 0.00 1.37 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 5.48 0.00 0.00 0.00 0.00 0.00 2.36 2.18 0.00 333 G 10.32 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 0.00 0.00 0.00 0.00 334 R 6.82 4.38 0.00 1.69 1.83 0.00 3.09 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.51 0.00 335 E 7.40 4.21 0.00 1.37 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 2.23 2.11 0.00 336 S 8.16 4.26 0.00 4.01 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 0.00 337 P 0.00 4.16 0.00 2.04 2.16 0.00 3.63 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 338 I 7.24 3.94 1.94 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 1.31 0.80 1.04 0.00 0.00 339 F 7.72 3.73 0.00 2.63 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 0.00 340 K 7.63 4.39 0.00 1.73 1.78 0.00 1.39 0.00 0.00 1.00 0.00 0.00 2.13 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.85 1.32 7.81 341 Q 8.34 4.74 0.00 2.12 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.81 0.00 0.00 0.00 0.00 0.00 2.56 2.33 0.00 342 F 8.15 5.17 0.00 3.15 3.22 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 0.00 343 F 8.25 3.84 0.00 2.90 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 0.00 344 K 8.51 3.92 0.00 2.10 1.71 0.00 1.96 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.63 0.00 0.00 0.00 0.00 1.42 1.00 7.81 345 D 8.57 4.38 0.00 2.69 2.51 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 0.00 346 W 8.94 4.54 0.00 3.32 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 * Residues marked with a * may have inaccurate shift predictions.