NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9972 8.3549 109.7418 45.7641 0.0000 172.7846 5 S 4.4295 8.6926 113.6333 60.1002 63.7830 174.9811 6 R 3.7784 8.2471 120.5887 59.4129 31.0836 177.2964 7 R 3.6436 7.9909 116.5629 59.2737 29.7718 176.2038 8 Y 4.4689 8.1419 112.4602 57.5546 38.0614 174.7662 9 D 4.6266 7.8882 121.2372 53.4147 41.1222 176.6432 10 S 4.1307 8.7175 123.6363 59.6675 63.9646 174.1243 11 R 3.7926 8.4851 119.9124 57.1707 26.7224 177.0056 12 T 4.2284 7.7956 106.5436 63.2532 69.6084 175.5465 13 T 4.5482 7.3265 112.2790 61.5300 69.0329 173.4199 14 I 4.3773 7.5923 113.8383 60.0195 40.5945 174.1376 15 F 4.9662 8.3406 119.3282 56.5218 40.1192 176.1888 16 S 4.5699 8.4497 118.8731 56.4813 64.1327 173.5902 17 P 4.4005 0.0000 0.0000 65.2534 31.0197 177.4831 18 E 4.1603 8.0893 115.4624 56.2155 29.8192 176.1498 19 G 3.4684 8.2311 107.2808 46.8269 0.0000 173.7024 20 R 4.6146 7.7764 116.6534 53.7433 33.5564 175.7313 21 L 4.6843 8.0323 119.9579 54.3425 42.2573 176.9532 22 Y 3.4848 7.3413 121.0048 61.3514 37.7378 178.6491 23 Q 3.9501 8.0542 117.8099 59.4151 29.0494 179.8213 24 V 3.5648 7.6152 118.2038 66.0803 31.6659 177.6100 25 E 3.9751 8.0736 118.2203 59.9186 29.3425 179.1700 26 Y 4.4791 8.1941 116.6652 60.8637 37.8590 178.2352 27 A 4.0721 8.4204 122.3964 55.1037 18.6240 179.5946 28 L 3.9362 8.3587 117.9820 57.9359 41.4557 179.3140 29 E 3.9518 7.9772 118.3336 59.3186 29.9276 178.5216 30 S 4.3059 8.1130 113.1561 61.5728 62.4901 176.2668 31 I 3.7849 7.9332 122.7321 64.0742 36.5975 177.9922 32 S 4.3177 7.7856 112.8589 60.1280 62.8989 174.3476 33 H 4.7374 7.6525 117.9030 55.5115 29.2123 174.4347 34 A 4.4170 7.7677 123.2263 50.7103 19.5439 177.7142 35 G 4.1085 8.4856 107.1184 46.3732 0.0000 173.4684 36 T 4.3989 8.5641 119.0706 63.2097 69.9747 173.3361 37 A 5.1637 8.4767 125.7668 50.2494 22.1323 175.3013 38 I 4.5706 9.4998 123.3633 59.3430 41.0002 175.0584 39 G 4.3998 8.6319 111.5100 44.6223 0.0000 171.8367 40 I 4.6936 8.9336 126.6525 59.6302 40.7959 174.1038 41 M 4.7240 8.8356 126.9664 54.1601 33.3368 175.3024 42 A 4.7236 8.7152 130.3117 50.2657 21.6508 176.3839 43 S 4.3446 8.5987 112.6717 60.6374 63.3166 174.8423 44 D 4.8867 8.9572 118.7867 50.7365 39.6525 176.0708 45 G 4.0328 6.9204 108.0110 46.4101 0.0000 171.3449 46 I 5.1240 7.6815 118.6142 59.4367 41.1789 175.3681 47 V 4.4646 8.9586 125.4534 61.0350 34.2857 174.1001 48 L 5.3114 8.6464 126.6817 52.9398 44.3100 175.6908 49 A 4.8758 9.0796 124.5169 50.2575 22.7197 174.5596 50 A 4.9422 8.4495 120.9592 50.4006 22.8370 174.9277 51 E 4.4896 9.1628 121.8098 54.3327 31.5635 175.6333 52 R 4.0870 8.5597 126.7502 55.8407 30.4879 176.1852 53 K 4.0298 8.5818 125.0220 56.7312 33.0077 173.0985 54 V 3.1998 8.5014 130.7264 62.8265 32.3076 171.5033 55 T 4.6285 7.9833 114.1048 60.8364 71.4887 171.9804 56 S 4.7175 8.0936 115.3649 56.7038 65.9176 174.8273 57 T 4.0495 8.4273 119.1512 66.3571 68.2524 176.2161 58 L 4.1897 7.5867 119.3195 55.9050 42.0860 177.1772 59 L 3.8904 7.1137 120.1319 54.9252 42.3209 175.8973 60 E 4.1949 8.6553 127.1114 55.6686 29.8178 175.5655 61 Q 4.2356 8.5669 128.1399 58.1227 29.8943 177.3525 62 D 4.3518 8.1959 116.9880 57.2807 40.8878 177.0966 63 T 4.3357 7.7572 112.2100 63.3512 68.9448 174.3364 63A S 4.5891 7.3522 116.4329 57.5355 63.7134 174.0671 64 T 4.0909 7.7778 118.9239 63.3459 70.6809 173.0045 65 E 4.8302 8.6905 122.7175 55.5488 31.2149 176.2209 66 K 4.6659 7.7013 116.2771 56.0092 36.3018 175.4968 67 L 5.1325 7.7128 119.3106 53.0967 43.5128 175.6958 68 Y 4.7906 8.8078 121.5196 55.8690 41.8528 174.9036 69 K 4.5583 8.8122 124.1843 55.6130 33.3417 176.0033 70 L 4.4043 8.6890 126.2234 55.9933 42.7050 175.5398 71 N 5.0228 7.5019 114.5012 52.1429 42.1994 173.6409 72 D 4.5433 8.6053 117.4417 55.3880 41.3207 177.1181 73 K 4.7581 7.7691 117.4631 55.8000 34.7175 175.6428 74 I 5.2718 7.5132 120.7059 59.7789 41.6628 173.8905 75 A 5.2319 9.2888 126.9520 50.5475 23.3579 175.0555 76 V 4.9861 8.8548 110.9707 59.5802 36.5166 174.6211 77 A 5.2884 8.9865 124.9727 50.3274 21.3564 175.7064 78 V 4.7306 8.9770 122.6675 61.2334 33.8459 175.4526 79 A 4.3198 9.2612 128.1747 53.0940 21.4260 174.6403 80 G 3.7143 8.4807 112.5224 45.5785 0.0000 171.9264 81 L 4.1081 8.4764 125.2424 54.8466 41.9789 177.6829 82 T 3.8579 8.9038 121.2837 66.8746 68.3480 176.0582 83 A 4.0337 8.0778 121.7941 55.5187 18.4277 179.2829 84 D 4.4453 8.1032 116.4982 57.3338 41.0110 178.6160 85 A 3.9774 8.0844 121.3833 55.3479 18.4410 179.4372 86 E 3.7714 8.4592 117.4274 59.5124 29.3154 179.7731 87 I 3.7078 7.5681 119.5458 64.5018 37.1820 178.5398 88 L 3.8299 7.6513 119.2447 57.5788 41.3058 179.6301 89 I 3.4927 8.2415 120.1662 64.3036 37.0473 177.8678 90 N 4.2670 8.0901 118.0650 57.0063 38.7199 176.9995 91 T 3.9155 7.7134 110.9992 64.6084 68.8653 176.4181 92 A 3.9565 8.0842 123.7897 55.0181 18.4621 179.7951 93 R 3.8727 8.3279 116.9408 59.4444 30.0798 179.3697 94 I 3.7340 7.8125 119.5947 64.6806 37.1252 177.9469 95 H 4.2312 8.5278 118.9638 59.1133 29.6486 177.1021 96 A 3.9293 7.9636 122.5200 55.4303 18.2028 179.7229 97 Q 4.0271 8.0096 116.0171 59.0427 28.7450 178.6820 98 N 4.3482 8.4790 117.8255 56.3686 38.4925 176.7710 99 Y 3.9525 8.1106 120.8863 60.5093 38.9025 177.6690 100 L 4.5420 8.1304 122.5621 57.7672 42.0173 178.9480 101 K 3.9209 8.1907 118.2464 59.6272 32.0994 178.6774 102 T 3.7657 7.5429 115.3483 66.1164 68.5511 175.7161 103 Y 4.4550 7.5943 115.0683 56.4397 39.4526 175.1740 104 N 4.3630 8.7638 116.7385 53.4545 36.8241 173.9885 105 E 4.8404 7.6803 114.6212 54.9516 34.0465 175.1724 106 D 4.6863 8.5763 122.2727 53.9457 41.6053 176.2569 107 I 2.7511 8.0997 123.2020 59.7388 38.5234 174.5931 108 P 4.1483 0.0000 0.0000 62.4618 32.9446 177.2006 109 V 3.4687 8.1725 121.5842 66.3813 31.4294 178.2369 110 E 3.7797 7.9398 118.1502 59.2025 29.6437 178.4248 111 I 3.6201 7.5740 119.4062 64.3844 37.1299 177.9817 112 L 3.9085 7.4255 121.0150 58.0010 41.8446 179.1690 113 V 2.9307 7.3493 118.0951 65.7763 31.3040 177.9839 114 R 3.8004 8.3625 118.8002 59.1986 29.8350 178.5410 115 R 3.8204 7.8336 118.2771 59.4653 30.2476 178.5089 116 L 3.9929 7.8232 118.7902 58.0077 41.5392 179.8017 117 S 4.2612 8.3583 115.2574 61.5933 62.8107 176.4656 118 D 4.4405 8.3447 122.0156 57.2424 40.2803 178.8410 119 I 3.8330 7.6177 119.7005 64.2706 37.2928 178.3009 120 K 4.2797 8.0419 119.1206 59.6988 31.9777 179.0116 121 Q 4.1142 8.6661 120.3336 59.1764 28.7512 178.8601 122 G 3.6148 8.0615 106.4639 48.0827 0.0000 175.0461 123 Y 3.9591 7.9073 117.2222 59.6785 37.8947 177.8161 124 T 4.2769 7.7361 116.0114 64.2198 69.1455 174.9687 125 Q 4.4349 7.7369 119.6339 56.0876 31.0255 174.2785 126 H 4.6451 7.6979 110.4793 55.1971 29.7159 173.0206 127 G 3.8451 8.9311 108.1270 44.2161 0.0000 175.0162 128 G 3.8381 7.9250 105.7129 46.3109 0.0000 173.0763 129 L 4.8020 6.9312 116.0269 51.9168 44.2399 176.9145 130 R 4.0686 8.2041 117.1343 55.5949 30.0013 174.8284 131 P 4.5276 0.0000 0.0000 61.8295 32.4701 175.6050 132 F 4.3436 8.4677 118.3710 57.2387 40.1322 177.5379 133 G 4.0317 8.7753 115.6716 45.0338 0.0000 172.7444 134 V 4.9068 7.2618 117.9640 61.5009 35.8624 175.0398 135 S 4.6282 8.4880 121.0967 56.7334 66.6954 173.0442 136 F 5.3055 8.7573 121.9178 55.6682 42.0159 174.7527 137 I 4.4750 8.3952 122.3260 59.8658 39.7075 174.0282 138 Y 5.1040 8.8544 124.8216 56.2861 39.6911 174.9579 139 A 4.7281 9.2492 126.8479 50.3435 21.4782 175.2960 140 G 4.5664 8.4918 108.1022 45.9607 0.0000 170.6220 141 Y 4.9806 8.7656 120.3703 55.9426 41.8676 173.8480 142 D 4.6404 7.3326 123.7331 51.9382 42.5871 174.3401 143 D 4.5489 8.4370 117.1234 53.3547 39.6106 176.4549 144 R 4.0929 8.6482 126.3193 56.7182 30.0527 175.4576 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 G 8.35 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 8.69 4.43 0.00 4.04 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 6 R 8.25 3.78 0.00 1.84 1.92 0.00 3.17 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 7 R 7.99 3.64 0.00 1.51 1.18 0.00 2.27 0.00 0.00 2.92 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 1.36 0.00 8 Y 8.14 4.47 0.00 2.95 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 9 D 7.89 4.63 0.00 2.68 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 10 S 8.72 4.13 0.00 3.91 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 11 R 8.49 3.79 0.00 2.02 1.97 0.00 3.12 0.00 0.00 3.20 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 12 T 7.80 4.23 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 1.22 0.00 0.00 13 T 7.33 4.55 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 1.21 0.00 0.00 14 I 7.59 4.38 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.11 0.97 0.00 0.00 15 F 8.34 4.97 0.00 3.09 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 16 S 8.45 4.57 0.00 3.77 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 17 P 0.00 4.40 0.00 2.09 2.18 0.00 3.75 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 2.10 2.18 0.00 18 E 8.09 4.16 0.00 1.87 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 2.27 2.34 0.00 19 G 8.23 3.47 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 0.00 20 R 7.78 4.61 0.00 1.67 1.67 0.00 3.05 0.00 0.00 3.11 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.49 0.00 21 L 8.03 4.68 0.00 1.60 1.52 0.85 0.31 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 22 Y 7.34 3.48 0.00 2.87 2.43 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 23 Q 8.05 3.95 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.91 0.00 0.00 0.00 0.00 0.00 2.48 2.46 0.00 24 V 7.62 3.56 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 1.15 0.00 0.00 0.92 0.00 0.00 25 E 8.07 3.98 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 2.39 2.38 0.00 26 Y 8.19 4.48 0.00 2.98 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 27 A 8.42 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.36 3.94 0.00 1.90 1.75 0.93 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 29 E 7.98 3.95 0.00 2.05 2.32 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 2.36 2.43 0.00 30 S 8.11 4.31 0.00 3.99 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 31 I 7.93 3.78 1.98 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.77 0.93 0.00 0.00 32 S 7.79 4.32 0.00 3.97 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 33 H 7.65 4.74 0.00 3.19 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.77 4.42 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 35 G 8.49 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 8.56 4.40 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 37 A 8.48 5.16 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 I 9.50 4.57 1.88 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.99 0.92 0.00 0.00 39 G 8.63 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 0.00 0.00 0.00 0.00 40 I 8.93 4.69 1.88 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 1.12 0.78 0.92 0.00 0.00 41 M 8.84 4.72 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.56 0.00 42 A 8.72 4.72 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 43 S 8.60 4.34 0.00 4.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 D 8.96 4.89 0.00 2.77 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 45 G 6.92 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 0.00 0.00 0.00 46 I 7.68 5.12 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 1.28 0.77 0.94 0.00 0.00 47 V 8.96 4.46 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 1.08 0.00 0.00 0.94 0.00 0.00 48 L 8.65 5.31 0.00 1.53 1.54 0.94 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 49 A 9.08 4.88 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 50 A 8.45 4.94 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 E 9.16 4.49 0.00 2.00 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 0.00 2.22 2.27 0.00 52 R 8.56 4.09 0.00 1.83 1.87 0.00 3.24 0.00 0.00 3.14 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.60 0.00 53 K 8.58 4.03 0.00 1.72 1.71 0.00 2.03 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.43 7.81 54 V 8.50 3.20 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 7.98 4.63 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 56 S 8.09 4.72 0.00 3.80 3.68 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 57 T 8.43 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 1.21 0.00 0.00 58 L 7.59 4.19 0.00 1.62 1.72 0.92 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 59 L 7.11 3.89 0.00 1.63 1.71 0.92 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.66 4.19 0.00 1.95 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 2.28 2.35 0.00 61 Q 8.57 4.24 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.27 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 62 D 8.20 4.35 0.00 2.68 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 63 T 7.76 4.34 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 63A S 7.35 4.59 0.00 4.06 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 64 T 7.78 4.09 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 0.64 0.00 0.00 65 E 8.69 4.83 0.00 2.06 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 2.14 2.28 0.00 66 K 7.70 4.67 0.00 1.64 1.81 0.00 1.68 0.00 0.00 1.81 0.00 0.00 2.85 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.44 1.45 7.81 67 L 7.71 5.13 0.00 1.35 1.48 0.91 0.72 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 68 Y 8.81 4.79 0.00 2.88 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 69 K 8.81 4.56 0.00 1.74 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.48 7.81 70 L 8.69 4.40 0.00 1.81 1.68 0.90 0.71 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 71 N 7.50 5.02 0.00 2.68 2.78 0.00 0.00 7.21 8.49 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 72 D 8.61 4.54 0.00 2.73 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 73 K 7.77 4.76 0.00 1.70 2.01 0.00 1.69 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.42 7.81 74 I 7.51 5.27 1.88 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 1.28 0.66 0.96 0.00 0.00 75 A 9.29 5.23 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 V 8.85 4.99 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 0.44 0.00 0.00 0.97 0.00 0.00 77 A 8.99 5.29 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 V 8.98 4.73 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 0.70 0.00 0.00 1.23 0.00 0.00 79 A 9.26 4.32 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 G 8.48 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 81 L 8.48 4.11 0.00 1.65 1.64 0.92 0.81 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 82 T 8.90 3.86 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 1.32 0.00 0.00 83 A 8.08 4.03 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 84 D 8.10 4.45 0.00 2.95 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 85 A 8.08 3.98 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 E 8.46 3.77 0.00 2.09 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 2.01 2.44 0.00 87 I 7.57 3.71 2.16 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 1.79 1.06 1.02 0.00 0.00 88 L 7.65 3.83 0.00 1.94 1.68 0.63 -0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.24 3.49 1.78 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.80 0.78 0.00 0.00 90 N 8.09 4.27 0.00 2.82 2.93 0.00 0.00 7.03 6.82 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 91 T 7.71 3.92 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 92 A 8.08 3.96 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 93 R 8.33 3.87 0.00 2.02 2.00 0.00 3.12 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.82 0.00 94 I 7.81 3.73 2.02 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 0.47 0.94 0.00 0.00 95 H 8.53 4.23 0.00 3.23 3.46 0.00 5.79 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 96 A 7.96 3.93 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 97 Q 8.01 4.03 0.00 2.27 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.75 0.00 0.00 0.00 0.00 0.00 2.60 2.56 0.00 98 N 8.48 4.35 0.00 2.98 2.91 0.00 0.00 6.61 7.24 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 99 Y 8.11 3.95 0.00 3.20 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 0.00 100 L 8.13 4.54 0.00 1.91 1.90 1.03 0.28 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 0.00 101 K 8.19 3.92 0.00 1.75 1.92 0.00 1.83 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.45 7.81 102 T 7.54 3.77 3.62 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 0.14 0.00 0.00 103 Y 7.59 4.46 0.00 2.59 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 0.00 104 N 8.76 4.36 0.00 2.84 2.91 0.00 0.00 6.74 8.16 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 0.00 105 E 7.68 4.84 0.00 2.16 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 2.36 2.54 0.00 106 D 8.58 4.69 0.00 2.70 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 0.00 107 I 8.10 2.75 1.55 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.36 0.74 0.00 0.00 108 P 0.00 4.15 0.00 1.97 1.81 0.00 2.81 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.99 0.00 109 V 8.17 3.47 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 0.91 0.00 0.00 0.87 0.00 0.00 110 E 7.94 3.78 0.00 1.97 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 0.00 2.28 2.31 0.00 111 I 7.57 3.62 1.76 0.00 0.00 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 1.47 0.88 0.83 0.00 0.00 112 L 7.43 3.91 0.00 1.51 1.63 0.85 0.73 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 0.00 113 V 7.35 2.93 1.85 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 0.56 0.00 0.00 -0.14 0.00 0.00 114 R 8.36 3.80 0.00 1.80 1.85 0.00 3.14 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 115 R 7.83 3.82 0.00 2.06 2.08 0.00 3.15 0.00 0.00 3.06 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.61 0.00 116 L 7.82 3.99 0.00 1.85 1.76 0.75 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 117 S 8.36 4.26 0.00 3.99 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 0.00 118 D 8.34 4.44 0.00 2.95 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 I 7.62 3.83 2.06 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 1.56 0.69 1.02 0.00 0.00 120 K 8.04 4.28 0.00 2.11 1.95 0.00 1.79 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.47 1.60 7.81 121 Q 8.67 4.11 0.00 2.21 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.39 2.57 0.00 122 G 8.06 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 0.00 123 Y 7.91 3.96 0.00 3.13 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 T 7.74 4.28 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 1.15 0.00 0.00 125 Q 7.74 4.43 0.00 1.91 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.63 0.00 0.00 0.00 0.00 0.00 2.25 2.20 0.00 126 H 7.70 4.65 0.00 3.17 3.20 0.00 5.74 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.93 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 0.00 0.00 0.00 128 G 7.92 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 0.00 0.00 0.00 129 L 6.93 4.80 0.00 1.68 1.63 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 130 R 8.20 4.07 0.00 1.90 1.92 0.00 2.99 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.50 0.00 131 P 0.00 4.53 0.00 2.08 2.11 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 132 F 8.47 4.34 0.00 2.88 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 0.00 133 G 8.78 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 0.00 0.00 0.00 134 V 7.26 4.91 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 -0.15 0.00 0.00 0.86 0.00 0.00 135 S 8.49 4.63 0.00 3.80 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 0.00 136 F 8.76 5.31 0.00 2.39 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 0.00 0.00 0.00 137 I 8.40 4.48 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.81 0.94 0.00 0.00 138 Y 8.85 5.10 0.00 2.78 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 A 9.25 4.73 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 0.00 140 G 8.49 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 Y 8.77 4.98 0.00 2.98 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 0.00 142 D 7.33 4.64 0.00 2.60 2.43 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 0.00 143 D 8.44 4.55 0.00 2.82 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 0.00 144 R 8.65 4.09 0.00 1.65 1.83 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00