NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 E 4.3114 8.4444 120.2291 56.1885 30.9808 174.2455 5 R 4.2575 8.1875 120.0591 54.3299 31.0118 173.6198 6 P 4.5259 0.0000 0.0000 62.4918 33.4870 175.1677 7 T 4.5617 8.2118 116.4689 63.1478 69.6393 174.5467 8 F 5.3086 9.2214 125.1119 56.3158 41.4881 174.5503 9 Y 5.1043 8.7969 118.1357 55.4915 41.4023 174.4514 10 R 5.1617 8.7767 118.9607 55.0037 32.8601 174.8697 11 Q 4.6481 8.6426 122.1532 55.1189 33.7915 173.1095 12 E 5.1458 8.6771 121.3522 55.0212 31.4624 173.8125 13 L 4.5175 9.1118 126.2305 55.0612 43.6098 175.0750 14 N 4.3144 9.3079 113.0614 54.2833 35.9015 175.6195 15 K 3.8839 8.4636 113.7476 57.3096 30.6820 175.3144 16 T 4.7685 7.8557 115.3598 61.4267 71.4638 172.9161 17 I 4.9715 8.1351 123.7234 60.2041 38.2395 175.4526 18 W 4.8210 9.1125 126.3000 54.8716 31.8984 174.0327 19 E 5.3321 9.0672 126.3149 53.8026 30.8796 175.3194 20 V 4.3680 7.8970 119.1152 58.4527 36.7138 173.4405 21 P 4.2152 0.0000 0.0000 62.5715 31.7411 177.5655 22 E 4.4319 8.5226 120.5553 58.5520 30.1798 178.1971 23 R 4.0510 7.7248 116.5019 58.3278 30.3531 175.6291 24 Y 5.1030 7.6785 117.4060 57.1311 38.3083 175.2830 25 Q 4.7937 9.2340 123.8151 53.8276 32.6534 175.2642 26 N 4.4840 8.6726 115.3277 54.4991 35.9184 175.3677 27 L 5.1051 8.1418 116.9336 54.4873 42.9291 178.4386 28 S 4.6035 8.4281 117.9096 55.5187 65.8956 171.6073 29 P 4.5583 0.0000 0.0000 63.3238 31.3427 176.3182 30 V 4.3627 8.9996 119.9282 61.2229 33.4691 175.5423 31 G 4.2792 7.4277 110.4675 46.5825 0.0000 171.7592 32 S 4.5539 8.2489 114.1255 56.9007 65.2662 174.1190 *36 G 3.9228 8.6478 115.4147 45.5198 0.0000 171.4514 37 S 4.9672 8.0658 112.9572 57.0262 65.6645 173.2579 38 V 5.1472 8.6728 121.1390 61.5132 34.4459 173.9888 39 C 5.2454 9.0124 123.7485 57.5970 31.5552 173.5432 40 A 4.6947 8.7919 124.6132 52.3813 19.5964 176.1831 41 A 5.0338 8.9069 120.7994 51.1681 23.9104 174.7620 42 F 5.1190 9.1181 121.3209 56.6195 42.0373 174.0123 43 D 4.9186 8.7866 127.8238 53.3637 40.7593 176.6334 44 T 3.8829 8.9801 118.7594 64.4819 69.3717 176.9819 45 K 3.8104 7.8840 123.5405 59.0932 32.2011 177.5508 46 T 4.1937 7.6202 105.3133 60.7023 69.6638 175.0556 47 G 3.6934 7.6872 109.9706 46.1381 0.0000 173.0874 48 L 4.6592 6.8514 118.9144 52.8042 44.2823 176.0242 49 R 4.8135 8.4793 121.4623 56.1257 31.5579 175.9732 50 V 5.0805 8.9180 115.9902 59.5275 36.4882 174.1494 51 A 5.0265 8.9490 125.0134 50.5825 21.0860 176.1987 52 V 4.5551 8.8262 123.5044 61.1772 33.6972 174.1972 53 K 4.9245 9.1949 130.8483 54.7427 34.3140 174.7221 54 K 3.9236 8.4461 129.5941 54.2558 33.2347 175.5492 55 L 4.0771 7.8285 128.5851 54.7853 42.2374 176.8476 56 S 4.2481 8.4031 117.6181 58.2322 63.8349 174.0583 57 R 3.6306 8.3842 126.3055 56.5326 27.4635 176.1995 58 P 3.9564 0.0000 0.0000 64.3621 30.3121 177.3548 59 F 4.8974 7.3087 117.3199 57.0229 40.1379 176.7648 60 Q 4.2105 7.7725 125.1230 58.8133 29.0689 176.1294 61 S 4.6990 7.5542 110.7405 55.8957 67.4587 175.0675 62 I 3.8568 8.3568 121.8585 64.7557 36.7884 178.7353 63 I 3.6449 7.7168 120.0056 64.6438 36.9524 178.0770 64 H 4.0408 8.1341 116.6175 58.7069 28.5223 177.7463 65 A 4.3468 8.2410 124.0781 54.6692 18.2792 179.6181 66 K 2.8317 8.0078 118.4849 59.1496 32.0029 178.9902 67 R 3.8482 7.9756 119.1052 59.4983 30.0438 178.6387 68 T 3.7041 7.9397 115.6026 66.6909 68.3933 175.6883 69 Y 4.2543 7.9374 121.3316 60.8472 38.7625 177.9059 70 R 3.7598 8.1914 119.8336 59.6932 30.0495 177.8770 71 E 3.8611 8.2488 118.7422 59.1786 29.6179 178.5491 72 L 3.8670 7.8488 120.3498 58.1010 41.9354 179.0917 73 R 3.8349 7.7046 117.3032 59.1337 30.2611 178.6685 74 L 3.9236 8.0246 118.6654 57.9840 41.6126 179.6159 75 L 3.9967 8.0759 118.7490 57.8823 41.3326 179.9064 76 K 4.2531 8.0826 117.5407 59.5435 32.0058 178.4969 77 H 4.6065 7.9492 117.9351 57.7310 29.8332 175.0205 78 M 4.5282 7.2923 119.4739 54.8292 31.6292 176.5283 79 K 4.5290 8.6383 124.0614 53.8648 33.2734 174.6793 80 H 4.4225 7.5844 119.6446 54.2036 32.9526 174.2451 81 E 3.9197 8.4182 125.4891 58.9639 29.5571 177.6148 82 N 5.3868 8.0977 114.1304 51.8545 39.1949 173.6270 83 V 4.8228 7.4505 117.0200 60.7402 34.6923 174.9945 84 I 3.8224 8.5929 128.2228 61.4386 38.5574 174.8589 85 G 4.3000 8.5309 114.4960 44.3723 0.0000 171.0668 86 L 4.6435 8.3985 121.3004 53.4741 42.9347 175.8735 87 L 4.4485 8.7030 127.1653 57.5854 42.4610 176.7642 88 D 4.6813 7.5684 115.3187 53.2380 44.6394 174.7297 89 V 4.8371 7.6637 122.4681 59.9729 34.4188 174.3155 90 F 5.2548 8.6275 117.7085 55.8417 41.8249 172.9686 91 T 5.4720 8.7654 113.5798 59.7867 69.8852 172.2905 92 P 3.3595 0.0000 0.0000 64.3632 31.7615 176.7397 93 A 4.1085 7.6650 122.5683 52.6589 18.6032 177.7269 94 R 4.3007 8.8206 121.2822 57.5019 30.6875 176.3949 95 S 4.6478 7.4658 110.4873 56.5447 66.0975 173.8963 96 L 3.0763 8.0845 122.1720 57.8485 41.8676 178.8559 97 E 3.8895 7.9917 116.6829 59.1784 29.4349 177.6037 98 E 4.1240 7.6749 115.9476 56.8209 29.9143 176.3431 99 F 4.6786 7.9310 121.7573 58.2143 38.4685 174.0443 100 N 4.8925 8.5724 123.9945 52.3757 40.8899 174.6270 101 D 4.7568 7.8615 116.0740 52.1127 44.7430 174.8786 102 V 4.6108 7.6023 120.5548 61.3930 35.2617 173.5983 103 Y 4.9063 8.5696 124.2507 55.9544 41.7287 174.2941 104 L 4.8463 8.6573 123.2210 52.7392 45.0464 175.4750 105 V 4.9102 8.6378 123.7639 61.3021 34.2020 174.4717 106 T 5.1058 8.7202 116.9538 59.5445 72.8678 172.6669 107 H 4.3922 8.8281 118.3703 56.3971 29.4259 175.2299 108 L 4.3752 8.5268 125.0277 54.5921 42.2236 175.8970 109 M 4.5715 8.6276 126.4710 53.8862 33.6645 176.9346 110 G 3.6902 8.7101 111.2769 47.9913 0.0000 173.2823 111 A 4.7029 7.8074 119.9340 50.4120 22.4971 173.8053 112 D 5.7577 8.0648 117.4851 50.4534 42.2159 175.7870 113 L 4.1235 8.2105 117.1102 56.1974 41.8110 177.7997 114 N 4.4136 7.7615 117.8658 52.6627 37.0519 172.8952 *120 Q 4.0881 8.0113 122.9771 55.1958 30.3019 174.8914 121 K 4.3615 8.3872 123.7359 55.5380 33.1858 176.9703 122 L 4.2696 8.2601 122.4314 54.5764 42.4471 177.9422 123 T 4.1656 8.2793 112.3333 61.5111 70.8295 174.9323 124 D 4.4450 8.7590 121.3884 58.0172 41.2344 178.4830 125 D 4.4454 8.1767 118.7197 57.5472 40.8131 178.1411 126 H 4.4585 8.1261 118.6834 59.1031 29.9667 177.4091 127 V 3.6404 8.2591 120.4584 66.1078 31.3347 177.7473 128 Q 4.0046 8.5109 118.1887 59.2275 28.7066 179.0741 129 F 3.6002 8.1149 120.8469 60.9819 39.3740 177.2473 130 L 3.6592 7.8894 118.6317 57.8891 41.3845 179.6331 131 I 3.7787 8.0034 119.7765 64.2101 36.9250 177.8167 132 Y 3.1498 8.1245 120.6221 60.5933 38.5624 178.3795 133 Q 3.5786 7.5817 118.3360 58.6037 28.6985 178.4253 134 I 3.5302 7.4591 120.8403 64.6325 37.1295 178.4627 135 L 3.8959 7.8046 119.6365 57.4642 41.1783 179.7062 136 R 3.6970 7.7588 119.1020 59.2641 30.0261 178.6487 137 G 3.4805 7.8751 105.4973 47.9642 0.0000 175.5840 138 L 3.8802 8.1971 121.8453 56.9894 41.5547 179.3405 139 K 3.8316 8.1935 120.0672 59.6400 31.8758 178.0322 140 Y 3.9828 7.4218 118.0676 60.8187 39.1668 177.8008 141 I 3.7946 7.9035 120.5452 64.9120 37.2718 178.2743 142 H 4.5808 8.8326 118.8682 58.2633 28.2566 177.9993 143 S 4.2135 8.0654 115.0534 60.7394 62.8157 175.4001 144 A 4.2876 7.6232 122.8233 51.0421 18.3225 176.7338 145 D 4.5153 7.8078 116.6967 55.7708 39.4990 173.6957 146 I 4.5104 7.0657 115.1875 59.5773 39.2554 175.1587 147 I 4.4629 8.0440 124.9751 59.6663 39.0821 175.0952 148 H 4.0991 9.2697 126.4156 59.5436 29.8212 176.9317 149 R 4.2269 9.6607 116.4050 56.3756 29.1723 176.2277 150 D 4.8227 7.7174 117.0147 52.9174 41.4094 175.1593 151 L 3.9180 8.0718 118.4386 54.4561 42.5462 176.8971 152 K 3.7568 7.9158 119.9117 55.2439 34.9798 174.0809 153 P 4.0454 0.0000 0.0000 65.6640 31.2447 178.9292 154 S 4.1948 7.6945 110.8541 60.2451 63.3579 174.2765 155 N 4.6390 7.9871 118.6883 52.8204 38.5300 173.9885 156 L 5.0299 7.6658 118.9112 52.8654 44.4973 175.5231 157 A 4.8291 8.7448 126.7264 51.3457 20.1735 176.4642 158 V 5.5178 8.7155 113.6097 58.7182 36.1597 175.7625 159 N 5.0769 8.3958 120.9285 51.5120 40.1470 174.1988 160 E 4.1180 8.7296 116.0983 60.1975 29.5949 178.6311 161 D 4.5636 8.1336 114.4595 55.2303 40.6764 176.2775 162 C 3.9402 7.9900 115.3366 60.4919 26.3643 172.5594 163 E 4.4333 8.5883 120.6401 55.9849 30.4013 175.5164 164 L 5.2041 9.1236 126.6092 53.1619 45.4602 175.1274 165 K 4.8996 8.9294 123.8344 54.5328 36.4708 175.5519 166 I 4.4120 8.6693 126.0768 61.2269 38.1335 175.1909 167 L 5.0625 8.6420 127.3781 53.0661 43.3081 176.7572 168 D 4.3630 9.1622 121.2617 56.2703 40.8429 178.9518 169 F 3.1722 7.4499 114.3951 57.4402 39.8782 177.9960 *184 A 4.2486 8.4829 135.0000 52.7066 19.9116 177.2773 185 T 3.5814 7.7371 113.2212 63.5900 69.1113 174.2233 186 R 4.5774 8.0534 120.7887 55.7029 29.8893 177.8221 187 W 4.6485 8.0143 119.1224 59.5216 29.0142 176.2528 188 Y 4.8004 8.0050 114.4360 57.5768 38.2202 175.4287 189 R 4.2235 7.9523 119.8385 55.3942 31.1008 176.5404 190 A 3.2285 8.3635 125.0099 50.9806 19.4226 176.8275 191 P 4.0567 0.0000 0.0000 65.7823 31.1454 178.8763 192 E 4.0802 7.7091 116.9120 59.2626 29.4877 179.1124 193 I 3.9706 7.4635 121.7268 63.9803 36.9396 178.1626 194 M 4.3230 7.9903 117.5311 57.2421 31.9497 177.4403 195 L 4.4771 7.5942 117.0768 53.2579 42.6765 175.5271 196 N 4.3384 8.3215 116.4262 54.2833 37.7648 175.0578 197 W 3.8452 8.7502 128.6732 58.8484 31.4424 176.7063 198 M 2.5500 7.7734 116.2421 56.6938 30.2094 175.3418 199 H 3.9062 8.6090 112.3412 57.2589 26.6214 174.7231 200 Y 4.2998 7.2122 115.2905 58.4128 38.6800 176.0056 201 N 4.7549 8.5183 120.4523 52.2146 40.3695 176.2674 202 Q 4.0167 8.6158 119.4337 59.2167 28.5255 178.8259 203 T 4.2367 7.7899 108.5611 62.7824 68.5598 176.2982 204 V 3.6610 7.7284 116.8321 65.1872 31.5901 177.9884 205 D 4.4908 8.3968 118.3195 57.2362 40.5878 178.8438 206 I 3.8651 7.7841 120.1191 63.7366 37.1130 177.9814 207 W 4.1061 8.1591 129.6718 60.6755 30.5926 178.2301 208 S 4.6204 8.0587 116.0048 61.1280 62.1923 176.7894 209 V 3.7001 8.0566 121.1290 65.9117 31.1677 178.1988 210 G 3.5149 8.2433 105.5427 48.1387 0.0000 175.4110 211 C 4.0154 7.9559 119.2578 62.4450 28.0855 176.4034 212 I 3.8933 7.9647 121.4939 64.4516 36.7096 178.1227 213 M 3.9653 8.3783 119.1744 58.5403 32.2182 177.7440 214 A 3.6986 7.9534 121.1731 55.4671 18.5108 179.3287 215 E 4.2768 7.9134 118.3714 58.9080 29.4733 178.9842 216 L 4.0803 7.9595 118.3914 57.6184 41.6887 179.0868 217 L 4.2316 7.7961 118.6998 56.8595 41.7582 178.3811 218 T 4.5030 7.8379 107.0022 60.3794 69.9031 175.3150 219 G 3.9875 8.1100 108.9572 45.8259 0.0000 173.3675 220 R 4.6445 7.7549 115.3113 53.5832 32.2543 175.1339 221 T 3.9075 8.3760 116.0755 64.1416 68.9286 174.0566 222 L 3.7012 8.3906 128.3014 57.5497 42.6613 177.1974 223 F 4.9856 7.1478 114.1722 55.3882 39.5431 174.1131 224 P 2.9700 0.0000 0.0000 61.0525 30.5089 177.6991 225 G 3.8656 7.4378 107.4359 46.6074 0.0000 172.5526 226 T 4.3952 8.7830 111.1777 62.6599 69.7954 173.9026 227 D 4.8224 7.5860 120.0812 51.3345 42.6361 175.3768 228 H 4.2850 8.8911 115.1199 58.9618 28.4358 178.0853 229 I 3.7560 7.8379 121.4801 64.2907 37.0227 177.7042 230 D 4.3204 9.1422 119.2960 57.3565 41.0732 178.0502 231 Q 3.9932 8.3332 120.1301 59.2798 29.0187 178.3018 232 L 3.9454 8.0755 120.0139 57.5246 41.7211 179.3738 233 K 3.9535 8.2925 119.8161 59.5019 31.6607 178.9335 234 L 4.0734 7.9645 119.3303 57.6845 41.5385 179.5199 235 I 3.0150 7.5376 119.7452 64.2746 37.0520 178.5757 236 L 4.0704 8.0874 119.8291 57.6657 41.1425 179.5618 237 R 4.0242 7.7465 117.9378 59.0546 30.2449 178.1789 238 L 4.1404 7.8511 119.5631 58.0498 42.1154 178.7428 239 V 4.3598 8.0713 109.4720 60.4864 32.3277 177.4316 240 G 4.1198 8.0842 103.6027 45.1854 0.0000 173.3191 241 T 4.1700 7.8116 109.2282 60.1302 69.5060 172.9772 242 P 4.1984 0.0000 0.0000 63.3318 31.9171 177.4966 243 G 3.9661 8.5154 109.1045 43.5508 0.0000 174.4398 244 A 4.0490 8.4291 121.3615 55.0900 18.0266 179.4464 245 E 3.9016 8.0942 116.5488 59.4415 30.0767 178.4064 246 L 4.1520 7.8807 119.8828 58.0395 42.3613 178.6760 247 L 4.1041 8.0045 119.0490 57.6308 41.2816 179.5335 248 K 4.1082 7.8890 117.1807 58.4693 31.9457 177.7925 249 K 4.4002 7.7822 116.4700 55.9908 32.2845 176.0081 250 I 4.4015 7.5319 121.3728 59.7346 37.3545 175.8806 251 S 4.1505 8.4247 121.1177 60.2337 63.6743 174.8572 252 S 4.0631 7.6378 115.6828 57.6566 62.6071 173.6803 253 E 3.8925 8.6912 131.1562 59.3973 29.4930 178.6684 254 S 4.1232 7.9968 113.5958 61.2222 63.1016 176.0664 255 A 3.9585 7.9429 124.3631 55.0931 18.2984 179.5709 256 R 3.9078 8.1621 116.7065 59.6970 29.9325 179.0869 257 N 4.3374 8.0338 114.8176 56.3615 38.9533 176.5869 258 Y 4.1734 8.0176 120.8283 60.9001 39.1045 177.9683 259 I 3.6212 7.9759 120.9641 64.4148 37.0403 177.9636 260 Q 4.1890 7.7604 116.1798 57.9031 28.8874 177.7245 261 S 4.1761 7.4721 115.3069 59.4843 63.6322 174.5983 262 L 4.0320 6.6345 122.4045 54.2255 42.0137 176.9993 263 T 3.7994 8.2589 118.7583 63.5642 68.8221 173.9151 264 Q 3.9942 8.7000 127.4196 56.6916 29.5568 174.8327 265 M 4.8834 8.4695 125.2725 52.8839 34.6957 174.0122 266 P 4.8152 0.0000 0.0000 61.7844 33.1928 175.7133 267 K 4.0937 8.5592 122.8965 56.7355 32.4406 176.5460 268 M 4.2998 8.6409 127.7575 55.6143 33.2372 175.7292 269 N 4.7072 8.7301 120.2835 53.0875 39.9326 176.1792 270 F 4.4113 9.0039 123.9841 60.4558 38.7766 177.5608 271 A 4.1430 8.2715 119.4303 54.7067 18.2245 178.1543 272 N 4.6562 7.8919 112.3026 53.5875 38.9493 175.6894 273 V 3.8573 7.3982 119.9356 63.1437 33.8533 176.0037 274 F 4.6879 7.7640 119.4510 55.6509 37.8724 174.4063 275 I 3.9645 7.3939 122.2401 62.4598 37.7977 177.2179 276 G 3.9297 9.0010 113.4918 45.0897 0.0000 173.4868 277 A 4.1181 7.4394 121.9826 51.2998 19.1809 176.8386 278 N 4.1382 8.8269 118.0516 53.8069 39.4032 173.9183 279 P 4.2853 0.0000 0.0000 65.8705 31.3425 178.6035 280 L 3.9954 8.5503 117.7990 57.4145 41.4055 179.2904 281 A 2.7308 7.4731 120.7979 54.6845 18.2552 179.8082 282 V 3.3469 7.4503 116.2249 66.0557 31.4189 177.3987 283 D 4.2464 7.8077 116.5887 57.3433 41.4758 177.7628 284 L 3.8693 7.7407 120.6558 58.0270 41.9688 178.8569 285 L 3.9090 7.9300 119.1661 57.8887 41.2923 179.3681 286 E 3.2968 7.9689 117.4667 58.9438 29.5756 179.0775 287 K 4.1555 7.8380 117.6487 58.4792 32.0091 178.9232 288 M 4.1639 7.7712 117.8127 56.6206 33.8802 177.1534 289 L 4.0370 7.7716 120.1217 53.2671 40.4964 176.2276 290 V 4.5681 7.3733 117.9242 60.6317 34.2498 175.0029 291 L 3.9617 8.8649 128.9971 58.0777 42.3412 176.5337 292 D 4.3928 8.0345 120.3697 53.6667 40.5075 176.5128 293 S 4.1877 8.5087 122.9169 61.2721 63.2187 176.3707 294 D 4.4088 8.0464 119.7884 56.4422 40.5562 177.1031 295 K 4.4166 7.7866 116.3377 56.2531 32.8491 176.9355 296 R 4.3893 7.4635 118.4010 55.7331 30.5494 176.6291 297 I 3.9254 8.3377 124.0274 61.8164 38.7624 175.6537 298 T 4.4453 8.4778 117.9515 60.7175 70.8039 175.5039 299 A 3.9454 8.7789 123.2051 55.3409 18.1144 179.7942 300 A 3.9689 7.8985 117.5638 55.4137 18.8805 179.3907 301 Q 4.1185 8.1934 116.4103 59.1232 28.8229 178.9111 302 A 4.2044 8.4375 122.0795 55.1611 18.1808 179.6722 303 L 4.0038 7.9348 116.5510 57.3431 41.7320 178.5388 304 A 4.1195 7.4972 117.8575 51.6328 19.4908 176.9087 305 H 4.4076 8.0117 118.5480 55.4506 30.8370 176.2493 306 A 4.1022 8.2478 127.7117 54.8743 18.5505 179.0745 307 Y 4.1605 8.2292 116.2680 60.4700 38.9080 176.7452 308 F 4.8677 8.1523 116.6540 57.1378 39.1855 177.2456 309 A 4.0430 7.8593 127.1023 55.3529 18.1337 179.9727 310 Q 3.9209 7.7968 112.2383 58.1710 29.0571 176.3562 311 Y 4.3593 7.4782 115.1142 58.6186 39.4485 175.8659 312 H 4.5115 8.0982 119.7039 56.2766 30.3978 173.9779 313 D 4.4849 9.0687 125.7475 51.7572 42.5113 173.8666 314 P 4.3184 0.0000 0.0000 65.0953 31.4087 176.8599 315 D 4.8213 8.2135 117.6944 54.2894 40.9591 175.7352 316 D 4.9484 8.1649 119.0945 54.2996 42.0047 175.8081 317 E 4.7424 8.0499 113.8347 53.6814 29.9935 173.8851 318 P 4.5450 0.0000 0.0000 62.6801 32.6426 176.5419 319 V 4.5089 8.1538 111.3686 59.5467 34.8294 174.8380 320 A 4.5467 8.0163 123.9992 50.2166 20.3314 177.1757 321 D 4.5889 8.4589 120.7293 53.4840 41.5765 175.0553 322 P 4.3521 0.0000 0.0000 63.0382 31.8715 175.0394 323 Y 4.4898 8.3261 121.8321 55.7730 39.9754 175.0473 324 D 4.4177 8.2317 127.5850 53.9214 40.2887 174.7237 325 Q 4.3363 8.0031 125.2413 55.6086 29.3606 178.4199 326 S 4.1666 8.2629 117.5402 61.3080 62.7104 176.0342 327 F 4.5261 8.4228 117.9780 59.9530 37.3580 177.0327 328 E 3.6629 7.0685 118.6287 58.7085 29.2161 178.4377 329 S 4.4069 7.7354 111.6475 58.2362 63.9481 174.1877 330 R 4.4925 7.6259 122.1889 55.1079 31.2959 175.8391 331 D 5.0119 8.6084 121.1433 52.8542 41.8936 175.2293 332 L 4.6387 8.3451 122.7967 51.9794 45.2449 177.0680 333 L 4.3561 8.4394 119.7392 54.1274 43.5598 178.3005 334 I 3.9180 8.4464 122.2738 65.2937 37.1372 178.5048 335 D 4.3815 8.0448 118.6584 57.0674 40.6467 178.6658 336 E 3.8065 7.8390 118.8237 59.1879 29.5948 179.0953 337 W 4.3045 7.9547 118.9614 59.6657 29.0148 178.4715 338 K 3.7201 8.5950 120.0465 59.4631 31.4609 178.8672 339 S 4.1177 8.1604 113.4111 61.3127 62.3333 175.9240 340 L 3.9938 7.9805 121.7263 58.2073 41.2573 179.8012 341 T 4.2375 8.2438 115.5439 66.8945 68.4969 176.0468 342 Y 3.6126 8.4359 121.6955 60.7211 38.8108 177.7780 343 D 4.2994 8.3923 119.8475 57.7392 40.7708 178.9559 344 E 4.0593 8.0428 117.4485 59.1730 29.5784 179.3113 345 V 3.7373 7.9290 118.4333 66.2110 31.4125 178.2117 346 I 3.5992 7.3348 118.3184 63.8623 36.9850 177.7408 347 S 4.4569 7.7031 112.1371 57.6539 63.7800 174.3662 348 F 4.1564 7.4644 126.0102 58.5195 39.6219 174.1747 349 V 4.0146 7.0544 126.6957 59.8130 33.4434 173.4686 350 P 4.2497 0.0000 0.0000 61.7049 32.0627 174.4671 351 P 4.3642 0.0000 0.0000 63.1610 31.4418 176.1324 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 E 8.44 4.31 0.00 1.99 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.32 0.00 5 R 8.19 4.26 0.00 1.93 1.88 0.00 3.31 0.00 0.00 3.29 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.92 0.00 6 P 0.00 4.53 0.00 1.72 1.80 0.00 3.94 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 2.03 0.00 7 T 8.21 4.56 4.46 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 1.29 0.00 0.00 8 F 9.22 5.31 0.00 2.79 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 9 Y 8.80 5.10 0.00 3.02 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 10 R 8.78 5.16 0.00 1.79 1.95 0.00 3.54 0.00 0.00 3.21 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.70 0.00 11 Q 8.64 4.65 0.00 2.10 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.74 0.00 0.00 0.00 0.00 0.00 2.28 2.39 0.00 12 E 8.68 5.15 0.00 2.02 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.37 0.00 13 L 9.11 4.52 0.00 1.70 1.61 0.22 0.13 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 14 N 9.31 4.31 0.00 3.06 3.13 0.00 0.00 6.94 7.61 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 15 K 8.46 3.88 0.00 1.95 1.95 0.00 1.73 0.00 0.00 1.73 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.41 7.81 16 T 7.86 4.77 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 17 I 8.14 4.97 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 1.45 1.43 1.05 0.00 0.00 18 W 9.11 4.82 0.00 3.25 3.23 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 19 E 9.07 5.33 0.00 2.05 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 2.35 2.34 0.00 20 V 7.90 4.37 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 0.83 0.00 0.00 0.67 0.00 0.00 21 P 0.00 4.22 0.00 1.59 1.36 0.00 2.32 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.46 0.00 22 E 8.52 4.43 0.00 2.05 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 0.00 2.52 2.18 0.00 23 R 7.72 4.05 0.00 1.49 1.94 0.00 2.74 0.00 0.00 2.75 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.00 24 Y 7.68 5.10 0.00 3.05 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 25 Q 9.23 4.79 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.33 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 26 N 8.67 4.48 0.00 2.91 2.88 0.00 0.00 6.98 7.85 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 27 L 8.14 5.11 0.00 1.47 1.41 1.07 0.85 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 28 S 8.43 4.60 0.00 3.80 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 29 P 0.00 4.56 0.00 1.89 2.15 0.00 3.52 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.86 0.00 30 V 9.00 4.36 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 0.80 0.00 0.00 0.99 0.00 0.00 31 G 7.43 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 S 8.25 4.55 0.00 3.83 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 *36 G 8.65 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 37 S 8.07 4.97 0.00 4.12 4.10 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 38 V 8.67 5.15 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.92 0.00 0.00 39 C 9.01 5.25 0.00 2.45 2.48 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 0.00 40 A 8.79 4.69 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 41 A 8.91 5.03 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 42 F 9.12 5.12 0.00 3.13 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 43 D 8.79 4.92 0.00 2.90 2.46 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 44 T 8.98 3.88 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 45 K 7.88 3.81 0.00 1.53 1.72 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.30 7.81 46 T 7.62 4.19 4.19 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 1.19 0.00 0.00 47 G 7.69 3.69 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 0.00 0.00 0.00 48 L 6.85 4.66 0.00 1.51 1.55 0.88 0.88 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 49 R 8.48 4.81 0.00 1.86 1.99 0.00 3.17 0.00 0.00 3.42 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.77 0.00 50 V 8.92 5.08 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 0.79 0.00 0.00 1.01 0.00 0.00 51 A 8.95 5.03 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 52 V 8.83 4.56 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 1.23 0.00 0.00 0.77 0.00 0.00 53 K 9.19 4.92 0.00 1.76 1.55 0.00 1.52 0.00 0.00 1.43 0.00 0.00 2.64 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.20 1.28 7.81 54 K 8.45 3.92 0.00 0.79 0.74 0.00 0.61 0.00 0.00 0.95 0.00 0.00 2.44 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.47 0.21 7.81 55 L 7.83 4.08 0.00 1.21 1.29 0.69 0.58 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 56 S 8.40 4.25 0.00 3.70 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 R 8.38 3.63 0.00 1.81 1.82 0.00 3.09 0.00 0.00 3.42 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.46 0.00 58 P 0.00 3.96 0.00 0.67 1.72 0.00 3.52 0.00 0.00 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.48 0.00 59 F 7.31 4.90 0.00 2.99 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 60 Q 7.77 4.21 0.00 1.75 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.43 6.64 0.00 0.00 0.00 0.00 0.00 2.29 2.24 0.00 61 S 7.55 4.70 0.00 4.14 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 62 I 8.36 3.86 1.96 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 1.79 0.79 1.20 0.00 0.00 63 I 7.72 3.64 1.81 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 1.61 0.63 0.81 0.00 0.00 64 H 8.13 4.04 0.00 3.37 3.35 0.00 5.82 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 65 A 8.24 4.35 1.71 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 66 K 8.01 2.83 0.00 0.85 1.39 0.00 1.44 0.00 0.00 1.40 0.00 0.00 3.04 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.06 0.21 7.81 67 R 7.98 3.85 0.00 1.89 1.98 0.00 3.06 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 68 T 7.94 3.70 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 69 Y 7.94 4.25 0.00 3.10 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 70 R 8.19 3.76 0.00 2.14 2.15 0.00 3.19 0.00 0.00 3.16 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 2.11 0.00 71 E 8.25 3.86 0.00 2.11 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 2.22 2.24 0.00 72 L 7.85 3.87 0.00 1.77 1.57 0.85 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 73 R 7.70 3.83 0.00 1.72 2.02 0.00 3.16 0.00 0.00 2.85 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.53 0.00 74 L 8.02 3.92 0.00 1.94 1.66 0.97 0.29 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 75 L 8.08 4.00 0.00 1.63 1.69 0.84 0.88 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 76 K 8.08 4.25 0.00 2.01 2.00 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.12 0.00 0.00 3.33 0.00 0.00 0.00 0.00 1.75 1.63 7.81 77 H 7.95 4.61 0.00 3.24 3.19 0.00 5.94 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 7.29 4.53 0.00 2.19 2.11 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.81 0.00 79 K 8.64 4.53 0.00 1.73 1.67 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.38 1.52 7.81 80 H 7.58 4.42 0.00 1.40 2.32 0.00 5.68 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 E 8.42 3.92 0.00 1.81 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 2.24 2.19 0.00 82 N 8.10 5.39 0.00 2.71 2.66 0.00 0.00 6.98 7.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 V 7.45 4.82 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 0.76 0.00 0.00 0.84 0.00 0.00 84 I 8.59 3.82 1.88 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 1.16 0.81 0.95 0.00 0.00 85 G 8.53 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 86 L 8.40 4.64 0.00 1.75 1.73 0.84 0.70 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 87 L 8.70 4.45 0.00 1.72 1.77 0.78 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 88 D 7.57 4.68 0.00 2.96 2.59 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 89 V 7.66 4.84 1.73 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 0.35 0.00 0.00 0.86 0.00 0.00 90 F 8.63 5.25 0.00 3.34 3.23 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 91 T 8.77 5.47 4.82 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 1.45 0.00 0.00 92 P 0.00 3.36 0.00 2.05 1.79 0.00 4.13 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.14 0.00 93 A 7.66 4.11 1.54 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 94 R 8.82 4.30 0.00 1.97 2.01 0.00 3.17 0.00 0.00 3.28 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.54 0.00 95 S 7.47 4.65 0.00 3.87 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 96 L 8.08 3.08 0.00 1.05 1.41 0.65 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 97 E 7.99 3.89 0.00 1.92 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 2.27 2.33 0.00 98 E 7.67 4.12 0.00 2.01 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 2.31 2.23 0.00 99 F 7.93 4.68 0.00 2.71 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 0.00 100 N 8.57 4.89 0.00 2.65 2.72 0.00 0.00 6.94 8.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 7.86 4.76 0.00 2.63 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 V 7.60 4.61 1.87 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 0.97 0.00 0.00 1.05 0.00 0.00 103 Y 8.57 4.91 0.00 1.43 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 0.00 0.00 0.00 104 L 8.66 4.85 0.00 1.40 1.39 0.79 0.75 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 0.00 105 V 8.64 4.91 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 0.99 0.00 0.00 0.76 0.00 0.00 106 T 8.72 5.11 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 1.22 0.00 0.00 107 H 8.83 4.39 0.00 3.08 3.30 0.00 5.69 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.53 4.38 0.00 1.78 1.71 0.96 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 109 M 8.63 4.57 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.59 0.00 110 G 8.71 3.69 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 0.00 0.00 0.00 111 A 7.81 4.70 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 0.00 112 D 8.06 5.76 0.00 2.91 2.61 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 0.00 113 L 8.21 4.12 0.00 1.70 1.69 0.87 0.89 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 0.00 114 N 7.76 4.41 0.00 2.64 2.81 0.00 0.00 7.04 7.01 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 *120 Q 8.01 4.09 0.00 2.09 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.73 0.00 0.00 0.00 0.00 0.00 2.25 2.34 0.00 121 K 8.39 4.36 0.00 1.81 1.74 0.00 1.82 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.58 1.47 7.81 122 L 8.26 4.27 0.00 1.71 1.72 0.98 0.97 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 0.00 123 T 8.28 4.17 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 124 D 8.76 4.45 0.00 2.89 2.79 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 0.00 125 D 8.18 4.45 0.00 2.79 2.79 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 0.00 126 H 8.13 4.46 0.00 3.25 3.52 0.00 5.79 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 V 8.26 3.64 2.25 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 1.12 0.00 0.00 1.07 0.00 0.00 128 Q 8.51 4.00 0.00 2.47 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.58 0.00 0.00 0.00 0.00 0.00 1.16 1.83 0.00 129 F 8.11 3.60 0.00 2.83 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 0.00 130 L 7.89 3.66 0.00 1.69 1.58 0.82 0.76 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 0.00 131 I 8.00 3.78 2.30 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 1.76 1.13 1.11 0.00 0.00 132 Y 8.12 3.15 0.00 2.98 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 0.00 133 Q 7.58 3.58 0.00 1.94 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.53 0.00 0.00 0.00 0.00 0.00 2.07 1.92 0.00 134 I 7.46 3.53 1.89 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 1.40 0.65 0.81 0.00 0.00 135 L 7.80 3.90 0.00 1.36 1.48 0.83 1.10 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 0.00 136 R 7.76 3.70 0.00 1.29 1.85 0.00 2.95 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.52 0.00 137 G 7.88 3.48 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 0.00 0.00 0.00 0.00 138 L 8.20 3.88 0.00 1.81 1.56 0.87 0.57 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 0.00 139 K 8.19 3.83 0.00 1.84 1.96 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.47 7.81 140 Y 7.42 3.98 0.00 2.76 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 0.00 141 I 7.90 3.79 1.84 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 1.59 1.21 0.97 0.00 0.00 142 H 8.83 4.58 0.00 3.21 3.51 0.00 5.65 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 0.00 143 S 8.07 4.21 0.00 3.98 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 A 7.62 4.29 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 0.00 145 D 7.81 4.52 0.00 2.85 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 I 7.07 4.51 2.02 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.48 0.92 0.00 0.00 147 I 8.04 4.46 1.91 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 1.29 0.59 1.00 0.00 0.00 148 H 9.27 4.10 0.00 3.14 3.58 0.00 5.79 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 9.66 4.23 0.00 1.97 2.12 0.00 3.18 0.00 0.00 3.08 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.53 0.00 150 D 7.72 4.82 0.00 2.59 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 0.00 151 L 8.07 3.92 0.00 1.64 1.51 0.87 0.68 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 0.00 152 K 7.92 3.76 0.00 1.31 1.63 0.00 1.45 0.00 0.00 1.79 0.00 0.00 2.81 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.33 1.16 7.81 153 P 0.00 4.05 0.00 2.05 2.05 0.00 2.80 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.81 0.00 154 S 7.69 4.19 0.00 3.56 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 0.00 155 N 7.99 4.64 0.00 2.78 2.97 0.00 0.00 6.59 6.26 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 0.00 156 L 7.67 5.03 0.00 1.60 1.47 0.80 0.70 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 0.00 157 A 8.74 4.83 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 0.00 158 V 8.72 5.52 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 0.64 0.00 0.00 0.93 0.00 0.00 159 N 8.40 5.08 0.00 2.82 2.86 0.00 0.00 6.13 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 0.00 160 E 8.73 4.12 0.00 2.08 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 2.42 2.35 0.00 161 D 8.13 4.56 0.00 2.90 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 0.00 162 C 7.99 3.94 0.00 3.57 3.35 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 0.00 163 E 8.59 4.43 0.00 2.13 1.87 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 2.45 2.42 0.00 164 L 9.12 5.20 0.00 1.45 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0.00 0.00 0.00 0.00 2.54 2.56 0.00 195 L 7.59 4.48 0.00 2.13 1.86 1.14 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 196 N 8.32 4.34 0.00 2.91 2.87 0.00 0.00 7.04 7.85 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 0.00 197 W 8.75 3.85 0.00 3.80 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 0.00 198 M 7.77 2.55 0.00 2.08 2.00 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 2.42 2.56 0.00 199 H 8.61 3.91 0.00 3.22 3.36 0.00 5.71 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 200 Y 7.21 4.30 0.00 3.17 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 0.00 201 N 8.52 4.75 0.00 2.75 2.73 0.00 0.00 7.09 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 0.00 202 Q 8.62 4.02 0.00 1.95 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 203 T 7.79 4.24 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 1.31 0.00 0.00 204 V 7.73 3.66 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 0.92 0.00 0.00 0.99 0.00 0.00 205 D 8.40 4.49 0.00 2.97 2.77 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 0.00 206 I 7.78 3.87 2.12 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 1.62 1.07 1.06 0.00 0.00 207 W 8.16 4.11 0.00 3.49 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 0.00 208 S 8.06 4.62 0.00 4.18 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 V 8.06 3.70 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.95 0.00 0.00 210 G 8.24 3.51 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 0.00 0.00 0.00 211 C 7.96 4.02 0.00 3.42 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 0.00 212 I 7.96 3.89 2.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.72 0.87 0.00 0.00 213 M 8.38 3.97 0.00 1.98 2.06 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.40 0.00 214 A 7.95 3.70 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 0.00 215 E 7.91 4.28 0.00 2.22 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.30 0.00 216 L 7.96 4.08 0.00 1.84 1.75 0.93 0.88 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 0.00 217 L 7.80 4.23 0.00 1.78 1.74 0.66 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 218 T 7.84 4.50 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 1.41 0.00 0.00 219 G 8.11 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 0.00 220 R 7.75 4.64 0.00 1.86 1.93 0.00 2.65 0.00 0.00 3.05 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.44 0.00 221 T 8.38 3.91 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 0.67 0.00 0.00 222 L 8.39 3.70 0.00 1.22 1.06 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 223 F 7.15 4.99 0.00 3.00 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 0.00 224 P 0.00 2.97 0.00 1.55 1.18 0.00 3.59 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.64 0.00 225 G 7.44 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 0.00 226 T 8.78 4.40 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 1.27 0.00 0.00 227 D 7.59 4.82 0.00 2.91 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 0.00 228 H 8.89 4.28 0.00 3.18 3.40 0.00 5.64 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 I 7.84 3.76 2.01 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 1.51 0.81 0.92 0.00 0.00 230 D 9.14 4.32 0.00 2.77 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 0.00 231 Q 8.33 3.99 0.00 2.27 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 232 L 8.08 3.95 0.00 1.89 1.71 0.96 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 233 K 8.29 3.95 0.00 1.92 2.04 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.51 7.81 234 L 7.96 4.07 0.00 1.96 1.89 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 235 I 7.54 3.01 1.79 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.14 0.05 0.87 0.00 0.00 236 L 8.09 4.07 0.00 1.84 1.75 0.97 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 237 R 7.75 4.02 0.00 1.94 2.17 0.00 3.27 0.00 0.00 3.15 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 238 L 7.85 4.14 0.00 1.96 2.03 0.45 0.79 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 0.00 239 V 8.07 4.36 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 1.26 0.00 0.00 1.13 0.00 0.00 240 G 8.08 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 0.00 241 T 7.81 4.17 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 242 P 0.00 4.20 0.00 2.10 2.11 0.00 3.69 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 2.09 2.15 0.00 243 G 8.52 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 244 A 8.43 4.05 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 0.00 245 E 8.09 3.90 0.00 1.99 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 2.31 2.38 0.00 246 L 7.88 4.15 0.00 1.82 1.82 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 247 L 8.00 4.10 0.00 1.93 1.73 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 248 K 7.89 4.11 0.00 1.95 1.90 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.64 7.81 249 K 7.78 4.40 0.00 1.94 1.91 0.00 1.72 0.00 0.00 1.73 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.43 7.81 250 I 7.53 4.40 2.04 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.90 0.86 0.00 0.00 251 S 8.42 4.15 0.00 3.90 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 252 S 7.64 4.06 0.00 3.63 3.51 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 0.00 253 E 8.69 3.89 0.00 2.04 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 2.36 2.36 0.00 254 S 8.00 4.12 0.00 4.07 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 0.00 255 A 7.94 3.96 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 0.00 256 R 8.16 3.91 0.00 2.02 2.01 0.00 3.14 0.00 0.00 3.36 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 257 N 8.03 4.34 0.00 2.89 2.91 0.00 0.00 7.03 6.80 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 0.00 258 Y 8.02 4.17 0.00 3.13 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 0.00 259 I 7.98 3.62 2.11 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 1.69 1.22 0.93 0.00 0.00 260 Q 7.76 4.19 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.99 0.00 0.00 0.00 0.00 0.00 2.65 2.32 0.00 261 S 7.47 4.18 0.00 3.98 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 0.00 262 L 6.63 4.03 0.00 1.66 1.55 0.90 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 263 T 8.26 3.80 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 0.00 264 Q 8.70 3.99 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.70 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 265 M 8.47 4.88 0.00 2.04 1.95 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 2.64 2.45 0.00 266 P 0.00 4.82 0.00 2.10 2.06 0.00 3.79 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 2.00 1.97 0.00 267 K 8.56 4.09 0.00 1.96 1.83 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.63 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.57 1.73 7.81 268 M 8.64 4.30 0.00 2.01 2.21 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 269 N 8.73 4.71 0.00 2.80 2.75 0.00 0.00 7.05 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 0.00 270 F 9.00 4.41 0.00 3.36 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 0.00 271 A 8.27 4.14 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 0.00 272 N 7.89 4.66 0.00 2.85 2.84 0.00 0.00 6.78 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 273 V 7.40 3.86 1.49 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 -0.06 0.00 0.00 0.71 0.00 0.00 274 F 7.76 4.69 0.00 3.10 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 0.00 275 I 7.39 3.96 1.86 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 1.29 0.70 0.91 0.00 0.00 276 G 9.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 277 A 7.44 4.12 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 0.00 278 N 8.83 4.14 0.00 2.83 2.81 0.00 0.00 7.03 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 0.00 279 P 0.00 4.29 0.00 2.19 2.10 0.00 3.66 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 280 L 8.55 4.00 0.00 1.92 1.80 0.96 0.77 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 0.00 281 A 7.47 2.73 0.72 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 0.00 282 V 7.45 3.35 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 1.00 0.00 0.00 283 D 7.81 4.25 0.00 2.76 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 0.00 284 L 7.74 3.87 0.00 1.31 1.43 0.86 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 285 L 7.93 3.91 0.00 1.79 1.67 -0.14 0.93 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 0.00 286 E 7.97 3.30 0.00 1.92 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.33 0.00 287 K 7.84 4.16 0.00 1.96 1.84 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.42 1.52 7.81 288 M 7.77 4.16 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.64 0.00 289 L 7.77 4.04 0.00 1.90 1.45 0.74 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 290 V 7.37 4.57 2.19 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 0.85 0.00 0.00 0.98 0.00 0.00 291 L 8.86 3.96 0.00 1.71 1.70 0.81 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 292 D 8.03 4.39 0.00 2.72 2.57 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 0.00 293 S 8.51 4.19 0.00 4.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 294 D 8.05 4.41 0.00 2.83 2.79 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 0.00 295 K 7.79 4.42 0.00 1.77 1.86 0.00 1.72 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.41 1.55 7.81 296 R 7.46 4.39 0.00 1.79 1.94 0.00 3.30 0.00 0.00 3.47 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.84 0.00 297 I 8.34 3.93 1.90 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 1.34 0.79 0.99 0.00 0.00 298 T 8.48 4.45 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 299 A 8.78 3.95 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 0.00 300 A 7.90 3.97 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 0.00 301 Q 8.19 4.12 0.00 2.32 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.42 2.42 0.00 302 A 8.44 4.20 1.48 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 0.00 0.00 0.00 303 L 7.93 4.00 0.00 1.83 1.84 0.86 0.34 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 0.00 304 A 7.50 4.12 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 0.00 305 H 8.01 4.41 0.00 3.31 3.48 0.00 5.60 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 306 A 8.25 4.10 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 0.00 307 Y 8.23 4.16 0.00 2.67 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 0.00 308 F 8.15 4.87 0.00 3.36 3.17 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 0.00 309 A 7.86 4.04 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 0.00 310 Q 7.80 3.92 0.00 1.75 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.84 0.00 0.00 0.00 0.00 0.00 1.76 1.16 0.00 311 Y 7.48 4.36 0.00 2.17 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 0.00 0.00 0.00 312 H 8.10 4.51 0.00 3.38 3.33 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 313 D 9.07 4.48 0.00 2.66 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 0.00 314 P 0.00 4.32 0.00 2.24 2.21 0.00 3.71 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.97 0.00 315 D 8.21 4.82 0.00 2.71 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 0.00 316 D 8.16 4.95 0.00 2.58 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 0.00 317 E 8.05 4.74 0.00 2.00 1.87 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 2.24 2.47 0.00 318 P 0.00 4.55 0.00 2.30 2.11 0.00 3.75 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 2.02 1.96 0.00 319 V 8.15 4.51 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 0.79 0.00 0.00 0.96 0.00 0.00 320 A 8.02 4.55 0.47 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 0.00 321 D 8.46 4.59 0.00 2.75 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 0.00 322 P 0.00 4.35 0.00 2.20 2.08 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.99 0.00 323 Y 8.33 4.49 0.00 2.59 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 0.00 324 D 8.23 4.42 0.00 2.63 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 0.00 325 Q 8.00 4.34 0.00 2.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 6.66 0.00 0.00 0.00 0.00 0.00 2.28 2.13 0.00 326 S 8.26 4.17 0.00 4.08 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 327 F 8.42 4.53 0.00 3.78 3.69 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 0.00 328 E 7.07 3.66 0.00 1.76 1.83 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 1.47 2.04 0.00 329 S 7.74 4.41 0.00 4.06 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 0.00 330 R 7.63 4.49 0.00 2.22 1.89 0.00 3.16 0.00 0.00 3.19 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 331 D 8.61 5.01 0.00 2.67 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 0.00 332 L 8.35 4.64 0.00 0.27 1.09 -0.45 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 333 L 8.44 4.36 0.00 1.60 1.55 0.87 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 334 I 8.45 3.92 1.92 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 1.76 0.73 1.00 0.00 0.00 335 D 8.04 4.38 0.00 2.71 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 336 E 7.84 3.81 0.00 1.77 1.62 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 2.25 2.26 0.00 337 W 7.95 4.30 0.00 3.55 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 0.00 338 K 8.59 3.72 0.00 1.36 1.81 0.00 1.31 0.00 0.00 1.31 0.00 0.00 2.13 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.20 0.21 7.81 339 S 8.16 4.12 0.00 3.96 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 340 L 7.98 3.99 0.00 1.63 1.30 0.39 0.46 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 0.00 341 T 8.24 4.24 4.92 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 1.68 0.00 0.00 342 Y 8.44 3.61 0.00 2.77 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 343 D 8.39 4.30 0.00 3.03 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 344 E 8.04 4.06 0.00 2.22 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 0.00 2.76 2.55 0.00 345 V 7.93 3.74 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 1.04 0.00 0.00 1.08 0.00 0.00 346 I 7.33 3.60 1.65 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.35 0.81 0.00 0.00 347 S 7.70 4.46 0.00 4.07 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 0.00 348 F 7.46 4.16 0.00 2.95 3.17 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 0.00 349 V 7.05 4.01 1.82 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 0.78 0.00 0.00 0.87 0.00 0.00 350 P 0.00 4.25 0.00 2.25 2.21 0.00 3.66 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 1.94 1.97 0.00 351 P 0.00 4.36 0.00 2.22 2.09 0.00 3.99 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 2.04 2.16 0.00 * Residues marked with a * may have inaccurate shift predictions.