NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 K 4.2866 8.1733 121.7891 56.3171 33.6202 176.5103 5 R 3.8545 8.5495 125.4287 58.7119 30.1826 177.4642 6 A 4.0089 8.3642 121.9990 55.0903 18.7196 179.0667 7 A 3.9412 7.9507 118.8582 55.0964 18.5387 179.7304 8 L 3.9218 7.6126 116.2740 58.0633 41.7764 179.6516 9 I 3.6932 7.4991 119.4226 64.5168 36.9845 178.2379 10 Q 3.9851 8.3699 120.4959 59.3323 28.8972 178.0424 11 N 4.3442 8.5015 117.7516 56.2775 38.3323 177.2328 12 L 4.0625 7.6640 119.2357 58.0942 41.5721 179.4972 13 R 4.2538 8.0443 117.4963 58.7907 29.9226 178.7369 14 D 4.4561 8.3450 118.9881 57.1332 40.9123 178.3167 15 S 4.4987 7.8647 112.4260 59.2978 64.3525 174.2613 16 Y 4.4883 7.4121 118.6923 56.2958 38.7019 174.6432 17 T 4.5014 7.7301 115.4734 59.7980 71.4702 176.0333 18 E 4.2376 8.4652 121.6512 58.9021 29.3887 178.4453 19 T 4.0516 7.8259 115.6942 66.1009 67.9481 176.9281 20 S 4.0663 7.8218 117.3943 61.6344 62.6628 176.7151 21 S 4.0792 7.9846 116.1357 60.8649 63.1884 176.0765 22 F 4.0980 8.5972 124.5493 60.7207 39.1039 176.6598 23 A 3.6832 8.0819 120.8522 55.2917 18.1285 179.6953 24 V 3.1172 6.9598 115.4370 66.1955 31.5066 178.3739 25 I 3.3472 6.7352 118.7814 63.9705 36.8967 178.3451 26 E 3.6967 7.4951 119.6778 59.1441 29.1277 178.9333 27 E 3.9237 7.7446 118.9064 59.0985 29.7509 178.9082 28 W 4.3134 8.2268 118.8416 59.7997 28.8492 178.3913 29 A 4.1838 8.0492 119.6701 54.8989 17.8123 177.7729 30 A 4.3604 8.2153 118.6409 53.7006 19.3430 179.5885 31 G 3.4272 7.8815 101.6307 47.4481 0.0000 175.5148 32 T 3.8842 8.1614 119.1645 66.2408 68.5981 176.9522 33 L 3.9394 7.5929 119.2087 57.2887 41.4736 179.4106 34 Q 3.9566 7.5851 119.7566 58.9757 29.1332 177.3963 35 E 3.9274 8.2792 120.3394 59.2433 29.5312 178.9141 36 I 3.6839 8.0025 120.0667 64.4636 37.2505 178.0416 37 E 4.0295 8.1237 119.7534 59.0652 29.3045 179.0766 38 G 3.5904 8.3120 106.0304 47.8332 0.0000 175.6903 39 I 3.7039 7.8200 122.2536 64.0826 37.1990 178.3139 40 A 3.9430 8.1128 121.6049 55.1329 18.1465 179.8694 41 K 3.9519 8.0236 116.6965 59.1599 32.1865 179.3635 42 A 3.9647 8.2718 121.1525 55.2883 18.3679 179.5853 43 A 3.8981 8.3126 119.2895 55.2728 18.3468 179.7598 44 A 4.1400 7.9935 119.1502 54.9990 18.3730 179.5653 45 E 3.8715 8.4091 117.9990 59.4375 29.6478 178.9367 46 A 4.0596 8.2316 120.9021 55.2599 18.3861 179.0912 47 H 4.2349 8.4871 117.2235 59.1661 29.7497 177.8067 48 G 3.5648 7.8876 107.3925 47.6943 0.0000 175.5520 49 V 3.6518 7.3016 119.4580 66.0677 31.8821 177.9455 50 I 3.9757 7.6002 119.0239 64.3110 36.7053 178.3724 51 R 3.8641 7.8583 118.7540 59.3773 29.8963 177.8823 52 N 4.5304 7.7815 115.2828 54.4063 39.1031 175.8777 53 S 4.4453 7.3583 116.1402 58.4138 63.6952 173.6779 54 T 4.5637 8.3801 120.9383 62.6042 69.6678 173.7628 55 Y 4.8881 8.6141 123.1005 56.3431 40.0781 175.1416 56 G 4.3032 8.8097 111.5427 43.3234 0.0000 173.4117 57 R 3.4988 8.7349 117.3403 59.2159 30.3777 178.8871 58 A 3.9495 8.3349 120.3001 55.5324 18.6154 179.5258 59 Q 3.8036 8.7682 114.6666 58.3316 28.8397 177.5774 60 A 4.3722 7.7353 118.8736 52.8313 18.5744 177.4072 61 E 4.5285 7.6848 114.9227 55.7402 30.0572 175.9561 62 K 4.4326 7.4237 119.0134 55.1470 35.4198 175.2744 63 S 4.3706 8.6042 122.9506 56.9838 63.5158 172.0231 64 P 4.2957 0.0000 0.0000 62.6365 31.0614 176.9074 65 E 4.1283 8.7722 124.6527 58.2742 29.5930 178.2868 66 Q 3.9504 7.9703 119.6030 59.3639 29.2183 177.7908 67 L 3.8703 7.7637 119.5033 57.8986 41.7698 179.1511 68 L 4.0924 8.1686 118.5563 57.9836 41.4657 179.8640 69 G 3.5377 7.8026 105.3624 47.7496 0.0000 175.6033 70 V 3.6040 7.6804 121.5799 65.6712 31.5433 177.9498 71 L 4.0248 8.2080 118.7452 58.0850 41.5133 179.5126 72 Q 4.0298 8.2587 119.3243 59.0477 29.0428 178.1126 73 R 3.9220 8.1611 119.9395 59.4879 30.0676 177.9863 74 Y 4.0593 8.1193 119.3935 60.7366 38.8703 177.2866 75 Q 3.7864 8.2533 120.5040 59.3932 28.9270 178.2900 76 D 4.3656 8.1564 119.7868 57.1198 40.8074 178.3637 77 L 3.8331 7.7208 120.5679 58.5410 42.1941 178.5998 78 C 3.7473 7.7218 116.5704 63.2390 28.0011 175.9477 79 H 4.2401 8.2786 119.6017 59.4352 29.4980 177.1726 80 N 4.3718 7.9080 118.1807 56.0890 38.3487 177.7278 81 V 3.8963 8.0370 119.9643 65.9723 31.5756 177.3897 82 Y 4.0043 8.1649 119.2948 61.1820 38.4952 178.1102 83 C 4.3545 8.1049 115.8452 62.6141 28.4419 175.9776 84 Q 4.1172 8.4179 119.6206 58.7427 28.4915 177.8048 85 A 4.1389 8.6578 122.2711 55.8202 18.3623 179.6325 86 E 3.8727 8.1556 116.2916 59.2019 29.4070 179.8078 87 T 3.8979 7.8522 116.2788 66.6060 68.5459 176.5398 88 I 3.6126 7.5529 121.0745 64.5080 37.1344 178.0728 89 R 3.8909 8.2207 119.7232 59.9610 29.7989 178.5838 90 T 3.6947 7.7755 115.2610 66.4129 68.1454 176.5815 91 V 3.6265 7.6062 118.9676 66.2124 31.7380 177.9422 92 I 3.8702 7.8016 118.9556 64.5017 36.5149 178.3379 93 A 3.9643 8.3075 123.2750 55.0916 18.3130 178.9270 94 I 4.0931 7.6108 106.6078 61.9836 37.9096 176.5493 95 R 4.4940 7.9279 119.3301 55.9160 30.7151 175.6717 96 I 4.1457 7.6204 119.0518 60.1497 36.8370 174.4939 97 P 4.5868 0.0000 0.0000 60.9791 32.8756 175.0540 98 E 3.8269 8.6616 118.0091 57.0322 29.6092 175.9637 99 H 4.3612 8.7080 125.4100 55.9907 30.4857 174.3581 100 K 4.7091 7.9714 124.4800 55.4149 36.0976 175.0911 101 E 4.5760 8.5006 117.7330 55.8504 29.5527 175.6567 102 E 4.5254 7.9815 115.6036 55.8605 32.1381 173.7061 103 D 4.8599 8.5742 114.4760 55.3650 39.8518 173.4445 104 N 4.8267 7.5367 111.5928 52.8919 38.4698 176.5926 105 L 4.0965 7.9207 124.1730 57.7820 41.6365 179.5742 106 G 3.9169 7.8264 106.3907 47.0885 0.0000 175.7491 107 V 3.7040 7.8559 120.2893 65.8265 31.3366 177.8159 108 A 4.0013 8.1296 120.4613 54.9211 18.1763 179.7892 109 V 3.5272 7.2831 116.5016 66.1236 31.4621 178.1219 110 Q 3.9736 8.0896 117.7063 59.6096 28.7232 178.7759 111 H 4.2508 8.4256 116.9166 58.6731 28.4493 177.9190 112 A 3.9726 8.1599 122.6954 55.3338 18.3065 179.9523 113 V 3.6381 7.9788 116.8034 65.9824 31.5657 178.2220 114 L 4.0737 8.3945 119.3313 57.5382 41.3758 179.3924 115 K 3.9908 7.9933 119.6950 59.4038 32.1284 178.7958 116 I 3.8188 7.5600 118.9561 63.9525 37.8736 177.9690 117 I 3.8788 7.9356 120.9590 64.1430 36.7837 178.0103 118 D 4.3689 8.3358 120.1213 57.2560 40.6216 178.3911 119 E 3.9145 8.1080 119.7981 59.0963 29.6423 178.3657 120 L 3.9064 7.8657 120.3087 58.3834 42.1722 178.9002 121 E 4.0198 8.1471 118.0591 59.6299 29.5622 179.5532 122 I 3.9100 8.1774 120.0209 63.8471 37.0053 178.0993 123 K 4.1910 8.0819 118.2853 58.4886 32.6699 179.2045 124 T 3.8395 7.7025 113.7334 66.7894 68.3355 175.8531 125 L 4.0705 8.5806 120.1195 54.7879 42.5488 176.6967 126 G 4.3084 7.1244 107.4625 46.9096 0.0000 173.7247 127 S 4.1091 7.7405 108.0866 58.2878 64.3748 175.4988 128 G 4.0125 7.7278 110.0940 44.8149 0.0000 173.8953 129 E 4.1009 8.8516 119.0918 58.5444 29.6725 177.3571 130 K 4.5902 7.7937 117.8985 54.2903 34.5594 175.7360 131 S 4.5271 8.5852 120.6586 57.3137 64.4769 175.1318 132 G 3.8893 8.2128 110.4025 45.3668 0.0000 174.2220 133 S 4.5228 8.5976 114.4095 58.8600 63.0853 174.9161 134 G 3.6066 8.0354 109.2100 45.8857 0.0000 175.1797 135 G 3.7164 7.6558 109.7974 44.5258 0.0000 172.8075 136 A 4.5889 8.2021 121.7082 49.8144 19.3807 174.7532 137 P 4.3768 0.0000 0.0000 65.6759 32.2415 177.7069 138 T 4.0585 7.7289 113.6686 61.0507 67.9053 173.1599 139 P 4.1681 0.0000 0.0000 65.3285 31.6570 176.6915 140 I 4.4819 6.9744 113.8303 59.4269 41.2078 175.1506 141 G 3.9591 7.7858 115.2237 45.1893 0.0000 172.9028 142 M 3.9537 7.5062 117.2484 58.8063 32.4705 177.8148 143 Y 4.6707 6.8396 116.3949 57.4954 37.3602 176.5270 144 A 4.2799 7.9274 125.0969 54.7776 19.5794 178.7654 145 L 3.9595 8.0582 118.4463 58.5438 42.1445 179.0846 146 R 3.8975 8.0800 117.8308 59.5227 30.1246 177.9529 147 E 4.0664 8.1509 118.1412 59.6852 29.4011 178.7476 148 Y 2.9969 7.9660 119.2565 60.3442 38.8837 177.6830 149 L 3.5765 7.9920 119.8862 57.9609 41.7171 179.7207 150 S 4.0562 8.0614 112.5598 61.2690 62.3780 176.0862 151 A 4.0876 7.9791 123.5772 54.9454 18.1124 179.6952 152 R 3.7491 7.9661 117.8911 59.4406 30.0905 178.7924 153 S 4.5386 8.4168 113.7445 60.9934 62.8361 176.5252 154 T 3.9092 7.4746 118.8783 66.5533 68.3859 176.9465 155 V 3.6179 7.3685 119.5112 65.8212 31.6291 177.9334 156 E 3.9477 8.6489 118.8271 59.4453 27.7371 178.8257 157 D 4.3753 7.7703 118.9190 57.6306 40.5179 179.3027 158 K 4.2696 7.8382 118.4931 59.3723 32.0984 179.2279 159 L 3.9124 8.0350 118.3904 55.0106 41.7224 178.2303 160 L 4.4119 8.9109 117.1376 53.1534 43.8921 176.0210 161 G 3.7730 5.3800 112.6620 45.0653 0.0000 177.3439 *172 G 3.7052 9.1175 117.8329 44.8327 0.0000 174.4149 173 G 4.4493 8.3366 121.3004 44.6678 0.0000 171.8334 174 S 4.7171 8.0951 118.1744 56.7526 64.8755 173.8928 175 Q 4.4449 8.5297 124.3355 55.8550 28.9346 175.9169 176 S 4.2974 7.7394 114.7610 57.3201 63.0698 173.0111 177 P 4.3772 0.0000 0.0000 66.1859 31.1232 178.7648 178 S 4.1184 7.9995 114.5146 61.1511 62.7089 176.0552 179 L 3.9283 7.9855 123.1557 58.0059 41.1723 178.9301 180 L 4.0093 7.6270 119.0385 58.1227 42.0029 178.9613 181 L 4.0042 7.6623 119.1012 57.4503 41.3747 179.1300 182 E 3.8672 8.3174 119.6759 59.0686 29.4744 178.2289 183 L 3.9594 7.6171 120.4058 58.4619 41.9950 178.9812 184 R 2.9543 7.3587 117.1142 59.2910 29.9093 178.2945 185 Q 3.9611 8.2382 119.5903 59.0616 28.9664 178.1401 186 I 3.9820 8.6365 121.7664 64.4831 36.9988 178.1541 187 D 4.5937 8.0618 119.4701 57.2725 40.6721 178.5573 188 A 4.0428 8.3569 121.6055 55.4416 18.4579 179.4127 189 D 4.2697 8.7163 117.5266 57.6526 40.4149 179.2092 190 F 4.0196 8.4761 117.9708 60.3188 38.7998 177.6791 191 M 4.0573 7.9261 118.9753 57.8518 31.8236 178.1814 192 L 3.7231 7.9969 120.5637 58.2867 42.1863 178.9625 193 K 3.7065 8.3893 118.5200 59.7896 31.9499 179.3967 194 V 3.1468 7.2701 117.2940 65.5504 31.4008 177.9267 195 E 3.8493 7.8650 118.3814 59.3302 29.3389 179.2657 196 L 3.8593 8.1341 118.9343 57.8912 41.6923 179.5066 197 A 4.0082 8.0728 121.0732 55.2537 18.2325 179.8052 198 T 3.8756 7.8107 108.3344 65.2114 68.9188 176.8376 199 T 3.8066 7.7475 118.7182 66.6841 68.6412 176.0322 200 H 4.2226 8.3346 119.9829 59.1917 29.7860 177.0462 201 L 3.8930 8.3837 122.6242 57.9762 41.7601 179.2396 202 S 4.0195 7.9758 115.2925 61.7408 62.8026 176.4093 203 T 3.8458 7.7001 118.2061 67.2107 68.2833 176.3382 204 M 4.0478 7.7933 119.9418 58.5019 31.9484 179.0928 205 V 3.3885 7.9921 118.6121 65.8777 31.6295 178.4243 206 R 3.9108 8.3217 117.8719 59.0868 29.8963 178.4709 207 A 4.0383 8.4030 121.1136 55.6261 18.2641 179.9692 208 V 3.7030 8.0414 116.3405 66.0625 31.6067 178.2213 209 I 3.8311 7.8705 119.7748 64.3882 36.9869 177.9419 210 N 4.3458 8.4817 117.4938 56.7177 38.6741 176.4193 211 A 4.0408 8.1454 121.2645 55.6914 18.8056 178.8119 212 Y 4.1933 8.4112 117.6244 60.9839 38.7926 177.8182 213 L 4.3114 8.1249 118.5455 57.8661 41.8065 179.2212 214 L 4.2937 8.0201 117.9348 56.4978 41.9607 177.9772 215 N 4.8618 7.7508 114.1244 52.3005 39.6231 176.2367 216 W 3.8656 7.8726 120.0371 59.2274 28.1552 178.2620 217 K 2.8009 6.6017 118.7441 58.9016 31.3331 179.0622 218 K 4.2865 7.4633 118.6758 57.9057 31.9140 179.2027 219 L 4.0800 7.4201 118.9981 57.3167 41.5032 178.9756 220 I 4.2818 7.4333 118.3506 62.4741 38.4701 176.5229 221 Q 4.4775 7.6985 122.0607 53.4946 28.5528 174.0281 222 P 4.7196 0.0000 0.0000 62.3138 32.2624 176.7648 223 R 4.7713 7.4295 117.1890 55.0368 34.0296 174.1213 224 T 4.4552 8.2534 118.1268 62.2692 70.6092 175.2196 225 H 4.5810 8.3311 124.7021 54.3384 27.3509 172.7830 226 L 4.3430 7.8641 120.9580 54.9557 41.1768 177.2311 227 D 5.0137 8.5753 123.4917 53.0505 39.7129 177.9508 228 V 3.9714 7.8848 119.1008 64.9141 31.8222 176.4137 229 L 4.2282 7.8509 117.4743 55.8595 42.2288 175.8920 230 Y 4.7888 7.3114 114.2841 56.3404 40.5550 175.7072 231 R 4.1960 8.3645 121.1779 56.9966 30.0802 174.6476 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 4 K 8.17 4.29 0.00 1.85 1.75 0.00 1.57 0.00 0.00 1.82 0.00 0.00 3.03 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.60 7.81 5 R 8.55 3.85 0.00 1.98 1.95 0.00 3.19 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 6 A 8.36 4.01 1.31 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 7 A 7.95 3.94 1.36 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 8 L 7.61 3.92 0.00 1.92 1.74 0.93 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 9 I 7.50 3.69 2.03 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 1.42 0.81 0.93 0.00 0.00 10 Q 8.37 3.99 0.00 2.30 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.80 0.00 0.00 0.00 0.00 0.00 2.37 2.65 0.00 11 N 8.50 4.34 0.00 2.92 2.88 0.00 0.00 7.05 7.30 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 12 L 7.66 4.06 0.00 1.98 1.78 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 13 R 8.04 4.25 0.00 1.91 2.01 0.00 3.16 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.85 0.00 14 D 8.35 4.46 0.00 2.67 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 15 S 7.86 4.50 0.00 3.96 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 16 Y 7.41 4.49 0.00 2.93 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 17 T 7.73 4.50 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 18 E 8.47 4.24 0.00 2.13 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 2.57 2.45 0.00 19 T 7.83 4.05 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 1.24 0.00 0.00 20 S 7.82 4.07 0.00 4.02 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 7.98 4.08 0.00 3.89 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 22 F 8.60 4.10 0.00 3.26 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 A 8.08 3.68 1.31 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 24 V 6.96 3.12 1.60 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 -0.18 0.00 0.00 0.69 0.00 0.00 25 I 6.74 3.35 1.54 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 -0.05 0.86 0.00 0.00 26 E 7.50 3.70 0.00 1.83 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 0.00 1.54 1.47 0.00 27 E 7.74 3.92 0.00 1.99 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 0.00 2.33 2.54 0.00 28 W 8.23 4.31 0.00 3.49 3.11 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 29 A 8.05 4.18 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 30 A 8.22 4.36 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 G 7.88 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.16 3.88 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 0.98 0.00 0.00 33 L 7.59 3.94 0.00 1.74 1.71 1.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 7.59 3.96 0.00 2.18 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 35 E 8.28 3.93 0.00 2.12 2.06 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 2.30 2.40 0.00 36 I 8.00 3.68 1.99 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.48 0.94 0.00 0.00 37 E 8.12 4.03 0.00 2.16 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 2.30 2.32 0.00 38 G 8.31 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 39 I 7.82 3.70 2.10 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.85 0.98 0.00 0.00 40 A 8.11 3.94 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 41 K 8.02 3.95 0.00 1.97 1.86 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.54 7.81 42 A 8.27 3.96 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 43 A 8.31 3.90 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.99 4.14 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 45 E 8.41 3.87 0.00 2.26 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 2.31 2.33 0.00 46 A 8.23 4.06 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 47 H 8.49 4.23 0.00 3.31 3.49 0.00 5.59 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 7.89 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 V 7.30 3.65 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 0.90 0.00 0.00 0.95 0.00 0.00 50 I 7.60 3.98 1.85 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 1.56 0.93 0.88 0.00 0.00 51 R 7.86 3.86 0.00 1.68 2.06 0.00 3.24 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 52 N 7.78 4.53 0.00 2.85 2.87 0.00 0.00 7.06 7.42 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 53 S 7.36 4.45 0.00 4.22 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 54 T 8.38 4.56 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 55 Y 8.61 4.89 0.00 2.80 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 56 G 8.81 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 0.00 0.00 0.00 0.00 57 R 8.73 3.50 0.00 1.88 2.03 0.00 3.29 0.00 0.00 3.34 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.68 0.00 58 A 8.33 3.95 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 59 Q 8.77 3.80 0.00 1.97 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.86 0.00 0.00 0.00 0.00 0.00 1.16 1.80 0.00 60 A 7.74 4.37 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 61 E 7.68 4.53 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 2.24 2.20 0.00 62 K 7.42 4.43 0.00 1.70 1.60 0.00 1.80 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.34 1.53 7.81 63 S 8.60 4.37 0.00 3.91 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 P 0.00 4.30 0.00 2.27 2.07 0.00 3.78 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.16 0.00 65 E 8.77 4.13 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 2.39 2.38 0.00 66 Q 7.97 3.95 0.00 2.17 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.70 0.00 0.00 0.00 0.00 0.00 2.43 2.45 0.00 67 L 7.76 3.87 0.00 1.61 1.41 0.99 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 68 L 8.17 4.09 0.00 1.71 1.78 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 69 G 7.80 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 V 7.68 3.60 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 0.99 0.00 0.00 0.97 0.00 0.00 71 L 8.21 4.02 0.00 1.65 1.74 0.33 0.76 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 72 Q 8.26 4.03 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.80 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 73 R 8.16 3.92 0.00 2.10 2.13 0.00 3.16 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.66 0.00 74 Y 8.12 4.06 0.00 3.10 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Q 8.25 3.79 0.00 2.23 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.58 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 76 D 8.16 4.37 0.00 2.97 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 7.72 3.83 0.00 1.73 1.63 0.87 0.88 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 78 C 7.72 3.75 0.00 2.84 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 H 8.28 4.24 0.00 3.23 3.48 0.00 5.60 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 N 7.91 4.37 0.00 2.74 2.87 0.00 0.00 6.69 8.91 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 81 V 8.04 3.90 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 0.71 0.00 0.00 0.75 0.00 0.00 82 Y 8.16 4.00 0.00 3.23 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 C 8.10 4.35 0.00 3.09 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 8.42 4.12 0.00 2.66 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 85 A 8.66 4.14 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.16 3.87 0.00 2.11 1.94 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 2.08 2.22 0.00 87 T 7.85 3.90 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 88 I 7.55 3.61 1.92 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.36 0.92 0.00 0.00 89 R 8.22 3.89 0.00 1.88 1.93 0.00 3.18 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.67 0.00 90 T 7.78 3.69 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 0.46 0.00 0.00 91 V 7.61 3.63 2.34 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 0.95 0.00 0.00 1.14 0.00 0.00 92 I 7.80 3.87 1.90 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.65 0.92 0.00 0.00 93 A 8.31 3.96 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 I 7.61 4.09 1.87 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 1.61 0.66 0.87 0.00 0.00 95 R 7.93 4.49 0.00 1.90 1.96 0.00 3.31 0.00 0.00 3.45 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.69 0.00 96 I 7.62 4.15 1.98 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 1.01 1.42 0.92 0.00 0.00 97 P 0.00 4.59 0.00 2.18 2.09 0.00 3.78 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.92 0.00 98 E 8.66 3.83 0.00 1.95 1.94 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 2.32 2.35 0.00 99 H 8.71 4.36 0.00 3.14 3.21 0.00 5.95 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.97 4.71 0.00 1.68 1.62 0.00 1.78 0.00 0.00 1.69 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.58 7.81 101 E 8.50 4.58 0.00 1.95 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 2.26 2.23 0.00 102 E 7.98 4.53 0.00 2.09 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 0.00 103 D 8.57 4.86 0.00 2.76 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 N 7.54 4.83 0.00 2.74 2.78 0.00 0.00 7.05 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.92 4.10 0.00 1.65 1.69 0.90 1.07 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 0.00 106 G 7.83 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 0.00 107 V 7.86 3.70 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 1.09 0.00 0.00 0.93 0.00 0.00 108 A 8.13 4.00 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 0.00 109 V 7.28 3.53 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 1.03 0.00 0.00 0.89 0.00 0.00 110 Q 8.09 3.97 0.00 2.22 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.56 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 111 H 8.43 4.25 0.00 3.17 3.34 0.00 5.62 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.16 3.97 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 0.00 113 V 7.98 3.64 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 1.14 0.00 0.00 0.98 0.00 0.00 114 L 8.39 4.07 0.00 1.76 1.74 0.95 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 115 K 7.99 3.99 0.00 1.89 2.16 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.47 7.81 116 I 7.56 3.82 1.91 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 1.59 1.22 1.05 0.00 0.00 117 I 7.94 3.88 2.03 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.62 0.97 0.00 0.00 118 D 8.34 4.37 0.00 3.01 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 0.00 119 E 8.11 3.91 0.00 2.27 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 2.33 2.48 0.00 120 L 7.87 3.91 0.00 1.82 1.88 0.78 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.15 4.02 0.00 2.09 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.43 0.00 122 I 8.18 3.91 2.08 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 1.59 1.10 0.95 0.00 0.00 123 K 8.08 4.19 0.00 2.00 1.86 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.48 7.81 124 T 7.70 3.84 4.40 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 1.13 0.00 0.00 125 L 8.58 4.07 0.00 1.93 1.65 1.01 0.87 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 0.00 126 G 7.12 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 0.00 127 S 7.74 4.11 0.00 3.78 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 0.00 128 G 7.73 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.85 4.10 0.00 2.01 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 2.30 2.30 0.00 130 K 7.79 4.59 0.00 1.69 1.68 0.00 1.78 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.32 1.40 7.81 131 S 8.59 4.53 0.00 4.04 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 0.00 132 G 8.21 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 0.00 0.00 0.00 133 S 8.60 4.52 0.00 4.00 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 0.00 134 G 8.04 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 G 7.66 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 0.00 0.00 0.00 136 A 8.20 4.59 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 0.00 137 P 0.00 4.38 0.00 2.06 2.11 0.00 3.70 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.07 0.00 138 T 7.73 4.06 4.47 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 1.27 0.00 0.00 139 P 0.00 4.17 0.00 2.11 2.00 0.00 3.73 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 1.96 2.00 0.00 140 I 6.97 4.48 1.74 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.63 0.79 0.00 0.00 141 G 7.79 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 M 7.51 3.95 0.00 1.60 0.99 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.25 0.00 143 Y 6.84 4.67 0.00 3.12 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 0.00 144 A 7.93 4.28 1.57 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 0.00 145 L 8.06 3.96 0.00 1.85 1.77 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 146 R 8.08 3.90 0.00 2.00 2.01 0.00 3.29 0.00 0.00 3.33 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 147 E 8.15 4.07 0.00 2.47 2.35 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 2.48 2.62 0.00 148 Y 7.97 3.00 0.00 2.20 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 0.00 149 L 7.99 3.58 0.00 1.67 1.63 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 150 S 8.06 4.06 0.00 3.96 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 0.00 151 A 7.98 4.09 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 R 7.97 3.75 0.00 1.34 1.53 0.00 2.47 0.00 0.00 3.12 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.48 0.00 153 S 8.42 4.54 0.00 3.98 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 0.00 154 T 7.47 3.91 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 1.20 0.00 0.00 155 V 7.37 3.62 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.93 0.00 0.00 156 E 8.65 3.95 0.00 1.96 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 2.31 2.45 0.00 157 D 7.77 4.38 0.00 2.84 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 0.00 158 K 7.84 4.27 0.00 1.88 1.86 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.68 7.81 159 L 8.04 3.91 0.00 1.88 1.72 0.95 0.42 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 0.00 160 L 8.91 4.41 0.00 1.71 1.39 0.91 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 161 G 5.38 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 *172 G 9.12 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 0.00 173 G 8.34 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 174 S 8.10 4.72 0.00 3.68 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 0.00 175 Q 8.53 4.44 0.00 2.08 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.74 0.00 0.00 0.00 0.00 0.00 2.29 2.27 0.00 176 S 7.74 4.30 0.00 3.89 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177 P 0.00 4.38 0.00 2.30 2.30 0.00 3.75 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 178 S 8.00 4.12 0.00 3.89 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 0.00 179 L 7.99 3.93 0.00 1.78 1.84 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 180 L 7.63 4.01 0.00 1.88 1.84 0.99 0.70 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 0.00 181 L 7.66 4.00 0.00 1.84 1.66 0.91 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 182 E 8.32 3.87 0.00 2.02 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 2.32 2.33 0.00 183 L 7.62 3.96 0.00 1.80 1.99 0.96 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 184 R 7.36 2.95 0.00 0.67 1.70 0.00 2.56 0.00 0.00 2.75 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.16 0.00 185 Q 8.24 3.96 0.00 2.27 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.58 0.00 186 I 8.64 3.98 2.12 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 1.67 0.61 1.05 0.00 0.00 187 D 8.06 4.59 0.00 2.88 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 0.00 188 A 8.36 4.04 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 189 D 8.72 4.27 0.00 2.87 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 F 8.48 4.02 0.00 3.35 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 0.00 191 M 7.93 4.06 0.00 2.16 2.29 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.79 0.00 192 L 8.00 3.72 0.00 1.60 1.76 0.78 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 193 K 8.39 3.71 0.00 1.55 1.64 0.00 0.90 0.00 0.00 1.42 0.00 0.00 2.68 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.26 1.36 7.81 194 V 7.27 3.15 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 0.74 0.00 0.00 0.78 0.00 0.00 195 E 7.86 3.85 0.00 2.07 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 2.25 2.46 0.00 196 L 8.13 3.86 0.00 1.69 1.64 0.84 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 197 A 8.07 4.01 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 198 T 7.81 3.88 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 1.19 0.00 0.00 199 T 7.75 3.81 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 1.20 0.00 0.00 200 H 8.33 4.22 0.00 3.21 3.43 0.00 5.78 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 L 8.38 3.89 0.00 1.88 1.87 0.75 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 202 S 7.98 4.02 0.00 4.09 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 0.00 203 T 7.70 3.85 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 204 M 7.79 4.05 0.00 1.97 1.98 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.59 0.00 205 V 7.99 3.39 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 0.74 0.00 0.00 0.54 0.00 0.00 206 R 8.32 3.91 0.00 2.04 1.98 0.00 3.21 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.82 0.00 207 A 8.40 4.04 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 0.00 208 V 8.04 3.70 2.34 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 1.36 0.00 0.00 1.12 0.00 0.00 209 I 7.87 3.83 2.14 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.14 1.01 0.00 0.00 210 N 8.48 4.35 0.00 2.91 3.03 0.00 0.00 7.11 8.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 211 A 8.15 4.04 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 0.00 212 Y 8.41 4.19 0.00 3.21 3.15 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 0.00 213 L 8.12 4.31 0.00 1.84 1.90 1.07 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 214 L 8.02 4.29 0.00 1.68 1.75 0.96 1.05 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 0.00 215 N 7.75 4.86 0.00 2.92 2.72 0.00 0.00 6.59 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 0.00 216 W 7.87 3.87 0.00 3.16 2.68 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 0.00 0.00 0.00 0.00 217 K 6.60 2.80 0.00 1.00 1.35 0.00 1.02 0.00 0.00 1.39 0.00 0.00 2.66 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.72 0.21 7.81 218 K 7.46 4.29 0.00 1.66 1.75 0.00 1.86 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.39 1.22 7.81 219 L 7.42 4.08 0.00 1.79 1.76 0.89 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 220 I 7.43 4.28 1.93 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.03 0.99 0.00 0.00 221 Q 7.70 4.48 0.00 1.97 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 222 P 0.00 4.72 0.00 2.17 2.32 0.00 3.79 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 2.03 1.99 0.00 223 R 7.43 4.77 0.00 1.66 1.68 0.00 3.16 0.00 0.00 3.33 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.59 0.00 224 T 8.25 4.46 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 225 H 8.33 4.58 0.00 3.14 3.24 0.00 5.69 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 226 L 7.86 4.34 0.00 1.77 1.71 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 227 D 8.58 5.01 0.00 2.95 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 0.00 228 V 7.88 3.97 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 0.82 0.00 0.00 0.95 0.00 0.00 229 L 7.85 4.23 0.00 0.96 1.24 0.82 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 230 Y 7.31 4.79 0.00 2.96 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 0.00 231 R 8.36 4.20 0.00 1.75 1.75 0.00 3.28 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.64 0.00 * Residues marked with a * may have inaccurate shift predictions.