NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 59 P 4.5119 0.0000 0.0000 62.6612 32.8866 175.5407 60 I 4.1857 8.3863 126.1683 60.0837 38.7824 173.7642 61 G 4.5330 10.6895 115.1047 43.4768 0.0000 172.0055 62 P 3.5833 0.0000 0.0000 65.2020 30.8883 178.8606 63 E 3.9438 7.9251 114.8893 59.4394 29.4613 178.4712 64 D 4.4674 7.8255 118.4919 56.0347 41.2949 177.7735 65 V 4.1464 7.2888 111.0014 61.3813 33.3020 177.3629 66 L 4.0847 7.9493 117.8695 56.6118 41.5297 177.9513 67 G 4.0882 7.7600 105.4071 44.7995 0.0000 173.1941 68 L 4.1495 7.8450 120.1902 55.0055 41.9145 177.1381 69 Q 4.8313 8.6941 120.1006 55.7795 29.7985 175.5308 70 R 4.2459 7.3606 115.7537 53.7218 34.2077 174.7633 71 I 3.4904 7.2530 120.5904 60.7866 38.6590 175.9467 72 T 4.1913 8.8038 116.8612 61.3291 69.3968 175.2692 73 G 3.6143 8.5064 112.1503 48.1415 0.0000 172.4304 74 D 4.4255 7.3735 116.6283 52.9119 44.2790 173.5056 75 Y 4.2047 8.2288 118.0571 58.0236 38.1716 176.2626 76 L 4.5008 9.1917 122.9998 55.6120 42.3077 176.3289 77 C 4.8967 7.6275 111.6595 57.1637 32.0701 173.7717 78 S 4.5033 8.5238 116.0033 56.9990 63.4940 173.6862 79 P 4.2881 0.0000 0.0000 65.3332 31.2101 178.4648 80 E 4.1004 7.4668 116.4727 58.4048 29.5303 177.5771 81 E 4.1394 7.9773 117.0062 57.6628 30.0906 177.2211 82 N 4.7804 7.6362 120.5800 52.3266 37.2256 175.3432 83 I 3.8346 7.3897 111.6733 62.3060 38.7633 177.0475 84 Y 4.2766 7.8003 118.3661 57.1053 38.3190 175.3202 85 K 4.0277 7.5406 118.3489 57.2049 30.3676 175.5963 86 I 3.9233 6.9908 117.3992 61.2043 37.7964 175.7303 87 D 4.6143 8.6331 124.3041 52.4465 44.1876 174.2107 88 F 4.9153 9.0388 125.8124 57.6638 39.3840 175.9740 89 V 4.4640 9.2524 116.8332 61.3817 33.7407 175.5684 90 R 5.2847 7.9488 120.7410 55.1632 33.8867 173.2944 91 F 5.6772 9.2977 127.9888 56.7793 43.3897 173.0906 92 K 4.8887 8.8964 127.4172 54.9630 35.5032 174.4511 93 I 4.9636 8.3771 121.8665 59.1276 40.0540 174.8906 94 R 4.9875 8.8007 121.1161 54.5477 33.4146 175.2391 95 D 4.3073 8.7171 120.3910 53.8904 43.5202 175.9842 *97 D 4.7091 8.7298 116.2497 53.9818 42.6252 176.2217 98 S 4.4615 7.9689 110.4452 56.8762 64.6893 175.0912 99 G 3.9615 8.6645 109.4277 45.2687 0.0000 174.0590 100 T 3.8099 7.4466 116.7769 63.6952 68.8896 173.4968 101 V 4.1990 8.2409 125.9577 62.6704 31.8183 175.5876 102 L 4.4444 8.7327 128.3300 56.8218 42.5239 176.8624 103 F 4.7755 7.8968 117.7170 57.8177 42.6301 172.2255 104 E 4.9667 7.3721 121.9055 55.3522 32.5174 174.2430 105 I 4.6268 8.5319 125.7666 59.5115 41.8761 173.6896 106 K 5.3935 8.4429 126.7064 54.9119 36.2269 175.2758 107 K 4.5643 8.7163 118.4669 55.5213 34.9265 174.3873 108 P 4.1012 0.0000 0.0000 65.3435 31.6078 176.0141 *126 G 3.8110 7.6208 104.9376 45.3554 0.0000 172.2715 127 R 4.4494 8.2242 115.8022 57.1889 31.0636 176.4488 128 F 5.8677 7.9516 120.4862 55.3547 42.7284 173.8080 129 V 3.8801 6.9973 124.0454 60.7446 35.0021 173.5273 130 R 4.3084 7.8257 127.4597 54.6791 31.7026 174.3545 131 Y 4.0290 8.0548 124.5243 56.4540 40.1100 175.0031 132 Q 4.3529 8.1586 122.2669 54.5387 30.3316 174.2775 133 F 5.5430 8.5779 125.6757 55.8116 42.3089 174.7015 134 T 4.8539 8.5692 107.9563 59.5361 71.2599 172.9360 135 P 4.3735 0.0000 0.0000 65.2712 31.6479 178.9604 136 A 4.0750 7.9868 120.7467 54.8392 18.1921 179.2154 137 F 3.8410 8.4500 119.4843 61.4324 39.2195 176.8473 138 L 4.1655 7.6698 115.5769 56.0260 41.3461 177.6988 139 R 4.5573 7.6147 117.4641 55.7002 30.5391 176.0194 140 L 4.2086 7.5172 117.8446 54.6555 42.6538 176.6286 141 R 4.3650 8.3596 121.7156 57.9355 31.8474 175.8489 142 Q 4.6642 7.4565 117.6654 54.5176 32.1983 174.1100 143 V 4.4686 8.3378 118.7204 59.3291 36.0658 174.5535 144 G 4.4070 8.9760 110.3706 44.3573 0.0000 171.7666 145 A 5.1774 9.1635 127.4618 50.5037 21.6429 175.2758 146 T 4.9220 9.1103 120.8710 62.5257 70.4732 174.5195 147 V 5.4471 9.2399 126.2922 60.0650 34.6839 174.3522 148 E 5.5408 9.7415 124.0581 54.7624 32.7290 174.9508 149 F 5.3963 8.9086 117.6854 55.9757 41.8070 173.1758 150 T 4.8964 8.8311 110.7980 60.1786 71.5494 173.3882 151 V 4.6025 7.9662 121.7873 61.1586 35.5041 176.3252 152 G 4.1259 8.3726 112.4515 45.9292 0.0000 173.6551 153 D 4.7141 8.6622 117.8324 55.6007 41.3087 177.1640 154 K 4.2365 7.8365 119.2368 55.0306 32.7163 174.9534 155 P 4.2725 0.0000 0.0000 62.6604 31.8584 175.7155 156 V 3.8850 8.1220 121.8788 60.9407 32.4194 174.1048 157 N 4.9904 8.0367 125.1317 52.8147 41.9689 173.2499 158 N 4.1889 8.7472 119.0460 54.3730 35.9111 174.1777 159 F 5.0773 8.1561 120.8654 58.4360 41.0955 174.4907 160 R 5.0631 8.9071 126.6843 54.3384 34.1662 172.6749 *162 I 4.3331 8.2192 118.0638 61.4945 39.0095 174.3487 163 E 5.1879 9.3118 129.0826 54.4625 32.1557 174.6105 164 R 5.0785 9.0846 126.1682 54.7311 33.3472 174.4747 165 H 5.4414 8.9736 120.9791 54.3407 31.5316 173.2364 166 Y 5.3009 9.3630 119.5235 56.2396 42.8883 174.5113 167 F 5.1305 9.3703 124.3303 57.1867 41.3808 175.3693 168 R 3.4154 8.9042 129.8934 57.4567 27.4950 176.9048 169 N 4.2480 8.0572 109.6646 53.4127 36.9256 174.3328 170 Q 4.5904 7.7626 120.7663 53.6062 30.5193 174.5220 171 L 4.3167 8.7329 127.9999 55.5369 42.7405 175.9561 172 L 4.3477 8.7381 126.9742 56.3306 42.3523 176.9063 173 K 4.1694 7.2102 116.7002 55.4136 35.4531 173.2260 174 S 4.9647 8.1646 119.5919 56.3765 65.0218 172.8723 175 F 4.5736 9.3185 125.2908 55.5134 42.0016 174.1321 176 D 4.7320 7.9521 121.2862 52.6021 43.2534 174.3560 177 F 5.0890 8.2590 124.3844 55.8676 42.5099 174.2022 178 H 5.2067 8.6820 118.8051 53.9341 30.7048 174.1409 179 F 4.3420 9.6451 123.2298 57.4132 39.7602 176.9178 180 G 4.1250 8.7009 108.5357 45.7385 0.0000 172.5832 181 F 4.4192 9.0785 122.0534 58.5664 39.8598 174.8011 182 C 4.6150 7.4840 125.0900 57.7097 29.1949 173.6016 183 I 3.8103 8.4090 127.2850 60.0406 36.8984 174.7543 184 P 4.2739 0.0000 0.0000 63.5038 31.5742 175.9146 185 S 4.3067 9.0960 113.6405 57.6065 61.1481 171.8875 186 S 4.4381 7.1484 112.1670 57.2453 66.9508 172.7369 187 K 4.3827 8.3968 121.6101 56.0108 32.5081 175.5605 188 N 4.9605 8.8807 125.0656 51.6214 41.9717 173.6429 189 T 5.3327 8.2445 116.4764 62.3573 72.4926 172.8394 190 C 4.9286 9.3155 123.1826 58.1346 35.8612 172.1545 191 E 5.0232 8.6654 124.3043 54.7796 31.7916 174.2900 192 H 4.4585 8.8970 124.3380 53.8980 31.3841 173.5581 193 I 4.7091 7.9247 123.2896 59.9316 39.0219 174.4850 194 Y 4.5079 9.2121 125.9346 56.5437 39.6797 174.7247 195 D 5.1602 8.9700 125.4046 52.6120 41.7760 176.6804 196 F 5.0858 8.6874 123.7929 56.7010 39.6453 174.2247 197 P 4.3903 0.0000 0.0000 61.6238 31.9694 174.3903 198 P 4.3256 0.0000 0.0000 62.7775 31.2831 175.6078 199 L 4.4256 8.2066 124.1102 53.0845 43.0710 177.6828 200 S 4.3478 8.2914 117.9711 58.2170 65.2141 175.3111 201 E 3.9454 8.5945 122.2969 59.5378 29.2590 179.4595 202 E 3.9481 8.0766 118.2661 59.3338 29.3694 179.0120 203 L 3.8862 7.6531 119.2567 58.1334 42.2190 178.6758 204 I 3.6061 7.3786 118.8359 64.2701 37.2652 178.3611 205 S 4.2803 7.8910 115.7522 61.4873 62.7541 177.8849 206 E 4.2363 7.7956 119.1400 56.8934 29.0239 179.1369 *208 I 4.1560 7.6916 121.2580 61.6522 38.9346 177.4735 209 R 4.1245 8.3640 117.0665 58.1502 30.2472 176.7813 210 H 4.9992 8.0629 115.4796 52.4449 29.1035 170.6160 211 P 4.0143 0.0000 0.0000 64.0945 31.7930 177.5150 212 Y 3.9436 8.2359 117.2136 58.8098 36.5226 170.0161 213 E 4.4247 8.0887 119.1011 56.9306 30.3665 175.3275 214 T 5.2884 8.0516 117.2666 62.4514 70.3168 173.8033 215 Q 5.5399 9.5375 124.9789 54.3941 34.0154 174.2551 216 S 5.4112 9.6698 114.7943 56.9773 67.2723 172.3936 217 D 5.2362 9.0525 120.4227 52.6308 44.1838 175.1020 218 S 4.6858 9.0275 119.9895 56.8737 65.1983 172.9317 219 F 5.1361 8.8314 124.9159 56.0023 40.4273 175.2101 220 Y 5.0199 8.6210 120.8902 56.2775 40.6862 174.7089 221 F 5.6559 10.0074 122.3013 55.7809 43.5611 174.3492 222 V 4.7986 8.6353 120.8958 60.4409 34.5035 175.3265 223 D 4.2414 9.1721 128.7770 55.8785 38.7850 173.6037 224 D 4.5535 8.5698 112.1538 55.2475 38.7431 174.0637 225 R 5.0016 7.9526 117.6437 53.9788 33.0736 174.7136 226 L 4.0853 8.6430 125.0818 55.2311 42.3059 176.8520 227 V 4.4360 8.7303 118.5154 61.7454 33.2341 175.1198 *229 H 4.9440 8.1021 120.1856 56.5185 30.0720 171.9607 230 N 5.4485 9.1310 123.4173 51.7076 41.6497 174.3004 231 K 5.0495 9.4190 119.5197 55.1872 36.8376 174.9952 232 A 4.9538 8.6788 120.9207 51.9251 23.0103 175.0850 233 D 5.3553 7.8669 117.9011 51.9976 43.6901 173.7923 234 Y 4.9820 9.4148 116.5137 56.2275 42.4789 174.4732 235 S 4.4368 8.1764 115.9861 56.1709 65.7247 174.0069 236 Y 4.9809 8.3377 123.8178 57.8780 38.5624 175.7330 237 S 4.4489 7.2984 114.7180 58.7896 63.9727 173.6243 238 G 3.7941 9.5392 110.9260 45.9699 0.0000 174.5892 239 T 4.2458 8.0449 109.8025 61.2301 69.3349 169.7700 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 59 P 0.00 4.51 0.00 2.15 2.20 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.04 0.00 60 I 8.39 4.19 1.97 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 1.34 0.81 1.01 0.00 0.00 61 G 10.69 4.53 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 0.00 0.00 0.00 62 P 0.00 3.58 0.00 1.85 1.57 0.00 3.38 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 1.93 0.77 0.00 63 E 7.93 3.94 0.00 2.07 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 2.22 2.31 0.00 64 D 7.83 4.47 0.00 2.81 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 65 V 7.29 4.15 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 0.31 0.00 0.00 0.98 0.00 0.00 66 L 7.95 4.08 0.00 1.58 1.68 0.82 0.61 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 67 G 7.76 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 68 L 7.85 4.15 0.00 1.88 1.75 0.92 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 69 Q 8.69 4.83 0.00 2.04 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.78 0.00 0.00 0.00 0.00 0.00 2.47 2.32 0.00 70 R 7.36 4.25 0.00 1.58 1.57 0.00 3.34 0.00 0.00 3.12 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.48 0.00 71 I 7.25 3.49 1.67 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.59 0.80 0.00 0.00 72 T 8.80 4.19 4.41 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 1.45 0.00 0.00 73 G 8.51 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 74 D 7.37 4.43 0.00 2.57 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 75 Y 8.23 4.20 0.00 3.05 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 76 L 9.19 4.50 0.00 1.91 1.86 1.18 0.90 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 77 C 7.63 4.90 0.00 3.35 2.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 S 8.52 4.50 0.00 4.18 4.03 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 79 P 0.00 4.29 0.00 2.15 2.08 0.00 3.54 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 80 E 7.47 4.10 0.00 1.75 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.30 0.00 81 E 7.98 4.14 0.00 2.13 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 2.36 2.26 0.00 82 N 7.64 4.78 0.00 2.90 2.86 0.00 0.00 6.86 7.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 I 7.39 3.83 1.59 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 -0.36 0.82 0.00 0.00 84 Y 7.80 4.28 0.00 2.92 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 85 K 7.54 4.03 0.00 1.78 1.81 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.35 1.34 7.81 86 I 6.99 3.92 1.65 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.28 0.29 0.00 0.00 87 D 8.63 4.61 0.00 2.71 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 0.00 0.00 0.00 0.00 88 F 9.04 4.92 0.00 3.00 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 89 V 9.25 4.46 2.38 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 0.74 0.00 0.00 1.05 0.00 0.00 90 R 7.95 5.28 0.00 1.95 1.86 0.00 3.19 0.00 0.00 3.55 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 91 F 9.30 5.68 0.00 3.27 3.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 K 8.90 4.89 0.00 1.78 1.55 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.27 1.32 7.81 93 I 8.38 4.96 1.77 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 1.27 1.21 0.62 0.00 0.00 94 R 8.80 4.99 0.00 1.89 1.97 0.00 2.73 0.00 0.00 3.06 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.48 0.00 95 D 8.72 4.31 0.00 2.57 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 *97 D 8.73 4.71 0.00 2.78 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 98 S 7.97 4.46 0.00 3.88 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 99 G 8.66 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 0.00 100 T 7.45 3.81 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 101 V 8.24 4.20 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 0.81 0.00 0.00 0.91 0.00 0.00 102 L 8.73 4.44 0.00 1.63 1.81 0.70 0.60 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 0.00 103 F 7.90 4.78 0.00 3.35 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 0.00 104 E 7.37 4.97 0.00 1.84 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.33 0.00 105 I 8.53 4.63 1.75 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 1.30 1.22 1.18 0.00 0.00 106 K 8.44 5.39 0.00 1.64 1.68 0.00 1.84 0.00 0.00 1.77 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.39 7.81 107 K 8.72 4.56 0.00 1.76 1.77 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.85 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.40 1.44 7.81 108 P 0.00 4.10 0.00 2.06 2.19 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.12 0.00 *126 G 7.62 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 R 8.22 4.45 0.00 1.61 1.71 0.00 3.05 0.00 0.00 2.54 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.31 0.00 128 F 7.95 5.87 0.00 3.06 2.90 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 0.00 129 V 7.00 3.88 1.45 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 -0.12 0.00 0.00 0.73 0.00 0.00 130 R 7.83 4.31 0.00 1.70 1.57 0.00 3.05 0.00 0.00 2.50 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.76 0.00 131 Y 8.05 4.03 0.00 2.04 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 0.00 132 Q 8.16 4.35 0.00 1.83 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.72 0.00 0.00 0.00 0.00 0.00 2.13 2.26 0.00 133 F 8.58 5.54 0.00 2.61 2.84 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 0.00 134 T 8.57 4.85 4.48 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 135 P 0.00 4.37 0.00 2.24 2.17 0.00 3.66 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.35 0.00 136 A 7.99 4.08 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 0.00 137 F 8.45 3.84 0.00 3.17 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 L 7.67 4.17 0.00 1.69 1.47 0.46 -0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 139 R 7.61 4.56 0.00 1.85 1.88 0.00 3.14 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.53 0.00 140 L 7.52 4.21 0.00 1.74 1.29 0.04 0.69 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 0.00 141 R 8.36 4.36 0.00 1.83 1.97 0.00 3.11 0.00 0.00 3.22 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 142 Q 7.46 4.66 0.00 2.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.54 0.00 0.00 0.00 0.00 0.00 2.10 2.40 0.00 143 V 8.34 4.47 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 0.09 0.00 0.00 0.61 0.00 0.00 144 G 8.98 4.41 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 0.00 145 A 9.16 5.18 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 0.00 0.00 146 T 9.11 4.92 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 1.28 0.00 0.00 147 V 9.24 5.45 2.50 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 1.39 0.00 0.00 1.61 0.00 0.00 148 E 9.74 5.54 0.00 2.03 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 0.00 2.26 2.33 0.00 149 F 8.91 5.40 0.00 2.55 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 0.00 0.00 0.00 0.00 150 T 8.83 4.90 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 151 V 7.97 4.60 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 0.83 0.00 0.00 0.79 0.00 0.00 152 G 8.37 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 D 8.66 4.71 0.00 2.67 2.74 0.00 0.00 0.00 0.00 0.00 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0.00 0.00 1.19 0.51 1.01 0.00 0.00 163 E 9.31 5.19 0.00 2.11 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 2.53 2.49 0.00 164 R 9.08 5.08 0.00 1.99 1.54 0.00 3.43 0.00 0.00 3.58 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.79 0.00 165 H 8.97 5.44 0.00 2.99 3.16 0.00 5.56 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 0.00 166 Y 9.36 5.30 0.00 2.86 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 0.00 167 F 9.37 5.13 0.00 3.06 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 0.00 168 R 8.90 3.42 0.00 1.23 1.61 0.00 2.81 0.00 0.00 2.96 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.64 0.00 169 N 8.06 4.25 0.00 2.84 2.94 0.00 0.00 6.97 7.69 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 0.00 170 Q 7.76 4.59 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.99 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 171 L 8.73 4.32 0.00 1.76 1.61 0.50 1.00 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 0.00 172 L 8.74 4.35 0.00 1.54 1.63 0.94 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 173 K 7.21 4.17 0.00 1.63 1.33 0.00 1.30 0.00 0.00 1.60 0.00 0.00 2.37 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.56 7.81 174 S 8.16 4.96 0.00 3.72 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 0.00 175 F 9.32 4.57 0.00 2.76 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 0.00 0.00 0.00 0.00 176 D 7.95 4.73 0.00 2.45 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 0.00 0.00 0.00 0.00 177 F 8.26 5.09 0.00 2.56 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 H 8.68 5.21 0.00 3.06 3.30 0.00 5.70 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 0.00 179 F 9.65 4.34 0.00 3.19 3.30 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 0.00 180 G 8.70 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 0.00 0.00 0.00 181 F 9.08 4.42 0.00 3.04 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 0.00 182 C 7.48 4.61 0.00 2.72 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 0.00 183 I 8.41 3.81 1.81 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 1.51 0.53 0.94 0.00 0.00 184 P 0.00 4.27 0.00 2.17 1.96 0.00 3.77 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.07 0.00 185 S 9.10 4.31 0.00 3.92 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 S 7.15 4.44 0.00 3.63 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 0.00 187 K 8.40 4.38 0.00 1.71 1.67 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.69 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.26 1.40 7.81 188 N 8.88 4.96 0.00 1.44 2.08 0.00 0.00 6.37 5.12 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 0.00 189 T 8.24 5.33 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 1.34 0.00 0.00 190 C 9.32 4.93 0.00 3.54 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 0.00 191 E 8.67 5.02 0.00 1.96 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.27 0.00 192 H 8.90 4.46 0.00 2.66 1.31 0.00 5.66 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 0.00 193 I 7.92 4.71 1.86 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.80 0.88 0.00 0.00 194 Y 9.21 4.51 0.00 2.60 2.63 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 0.00 195 D 8.97 5.16 0.00 2.68 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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0.00 204 I 7.38 3.61 1.91 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.61 0.80 0.00 0.00 205 S 7.89 4.28 0.00 4.02 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 0.00 206 E 7.80 4.24 0.00 2.08 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 2.53 2.64 0.00 *208 I 7.69 4.16 2.04 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.50 0.92 0.00 0.00 209 R 8.36 4.12 0.00 1.65 1.82 0.00 3.10 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.77 0.00 210 H 8.06 5.00 0.00 3.63 3.53 0.00 5.63 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 0.00 211 P 0.00 4.01 0.00 1.37 1.75 0.00 4.00 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 1.98 1.94 0.00 212 Y 8.24 3.94 0.00 3.24 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 213 E 8.09 4.42 0.00 2.37 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 2.34 2.54 0.00 214 T 8.05 5.29 4.63 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 1.42 0.00 0.00 215 Q 9.54 5.54 0.00 2.12 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.70 0.00 0.00 0.00 0.00 0.00 2.46 2.45 0.00 216 S 9.67 5.41 0.00 3.76 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 D 9.05 5.24 0.00 2.63 1.59 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 0.00 218 S 9.03 4.69 0.00 3.85 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 0.00 219 F 8.83 5.14 0.00 3.13 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 0.00 220 Y 8.62 5.02 0.00 3.06 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 0.00 221 F 10.01 5.66 0.00 3.03 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 0.00 222 V 8.64 4.80 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 0.51 0.00 0.00 0.69 0.00 0.00 223 D 9.17 4.24 0.00 2.93 2.80 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 0.00 224 D 8.57 4.55 0.00 2.88 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 225 R 7.95 5.00 0.00 2.21 1.95 0.00 3.25 0.00 0.00 3.19 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.63 0.00 226 L 8.64 4.09 0.00 1.59 1.60 0.45 0.89 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 0.00 227 V 8.73 4.44 2.24 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 1.00 0.00 0.00 1.16 0.00 0.00 *229 H 8.10 4.94 0.00 3.38 3.51 0.00 5.72 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 N 9.13 5.45 0.00 2.81 2.75 0.00 0.00 6.43 6.92 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 0.00 231 K 9.42 5.05 0.00 1.81 1.82 0.00 0.61 0.00 0.00 1.33 0.00 0.00 2.51 0.00 0.00 2.57 0.00 0.00 0.00 0.00 1.42 1.07 7.81 232 A 8.68 4.95 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 D 7.87 5.36 0.00 3.08 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 0.00 234 Y 9.41 4.98 0.00 2.64 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 235 S 8.18 4.44 0.00 2.72 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 0.00 236 Y 8.34 4.98 0.00 2.99 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 237 S 7.30 4.45 0.00 3.86 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 0.00 238 G 9.54 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 239 T 8.04 4.25 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.