NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3818 8.3044 120.3494 54.8100 33.4147 174.8908 2 I 3.5842 8.4122 125.9610 61.3794 38.7207 173.2138 3 Q 4.8272 8.4196 125.1561 54.1272 33.4358 173.8485 4 S 5.1728 8.6914 116.6959 56.7644 66.3586 173.0934 5 Q 4.8474 8.9674 120.4754 54.5164 30.4262 175.8111 6 I 4.3643 8.4401 112.3824 60.1890 39.1020 174.7235 7 N 4.8563 7.8232 120.2023 51.1110 40.5333 174.6753 8 R 3.9609 8.5881 123.9660 59.2387 29.3347 178.2758 9 N 4.3608 8.5771 117.3185 55.8309 38.4189 177.3945 10 I 3.6877 7.4567 121.7823 64.5969 37.2621 178.6476 11 R 4.0332 7.8937 118.2190 58.9232 29.9806 178.9346 12 L 4.0296 8.1880 119.2570 57.6589 41.5731 179.1100 13 D 4.3440 8.3336 119.1422 57.2829 40.7750 178.5196 14 L 3.9385 7.9444 120.5445 58.0364 41.9937 178.7975 15 A 4.1426 8.0917 120.7325 55.3615 18.3055 179.3219 16 D 4.2898 8.1555 117.0998 57.4897 40.9192 178.9302 17 A 4.0041 8.0080 121.2265 55.2283 18.3059 179.7059 18 I 3.6923 8.2810 118.7358 64.6091 37.1795 178.7253 19 L 4.0385 8.2466 119.9676 57.3999 41.3143 179.3540 20 L 3.9312 7.9460 120.5423 58.0812 42.0034 178.8658 21 S 4.0306 8.0578 113.0896 61.3167 62.2662 175.8545 22 K 3.7519 8.3518 122.4070 59.5681 31.8597 178.5494 23 A 3.9211 8.0828 120.8172 55.1139 18.1043 179.7327 24 K 3.9336 8.0583 116.1266 59.3453 32.2523 178.9723 25 K 4.1599 8.1602 115.9425 55.6718 32.7138 176.0477 26 D 4.2969 7.7329 117.9556 55.0536 40.1287 173.1476 27 L 4.7644 7.8586 116.5370 53.7151 43.6525 177.2747 28 S 4.6268 8.7347 116.2532 56.7261 66.4789 175.4401 29 F 4.1966 8.2338 121.2005 60.6109 38.4476 177.7070 30 A 4.0644 8.0857 119.3461 55.2804 18.5831 179.0866 31 E 4.0839 8.4151 116.1567 59.4574 29.5053 179.2423 32 I 3.6872 7.6449 119.8647 64.1693 37.6048 177.7026 33 A 4.3019 8.1518 120.1492 52.4397 18.4886 176.7570 34 D 4.5091 7.2234 117.8842 55.3779 41.6158 176.5713 35 G 4.0289 9.0283 115.2815 45.5553 0.0000 174.0529 36 T 3.9886 7.6699 108.8912 62.2010 69.2233 176.0972 37 G 3.9158 8.2782 109.0193 45.6366 0.0000 172.9486 38 L 4.7077 7.5867 118.3889 51.9704 44.5936 176.9377 39 A 4.1167 8.3312 123.1016 52.0374 20.0880 178.1762 40 E 3.9011 9.0163 123.9662 59.7510 29.6284 179.4931 41 A 3.9193 7.9985 119.8756 55.0309 18.4573 179.2857 42 F 3.9056 8.1387 118.6463 61.4430 39.6939 177.4393 43 V 3.6299 8.0728 117.9185 66.1892 31.3012 178.0643 44 T 3.7447 8.1793 115.4855 66.6408 68.2690 176.2749 45 A 3.8260 7.8839 122.3074 55.0973 18.2362 179.6016 46 A 4.2066 7.5451 120.3786 54.8368 18.2527 179.7700 47 L 3.9834 7.6829 116.1934 57.8087 41.7593 178.9084 48 L 4.4408 7.7035 115.9901 54.5893 41.5757 177.6219 49 G 3.8987 8.0934 107.0510 45.7188 0.0000 174.3981 50 Q 4.5169 8.2163 116.3371 55.4519 30.0281 175.1660 51 Q 4.4129 7.3968 115.8607 54.2739 32.9606 172.7030 52 A 4.9206 8.2941 121.0476 50.5987 20.7670 176.6772 53 L 4.6051 8.7698 122.8156 53.1584 43.4814 175.0910 54 P 4.5585 0.0000 0.0000 62.5141 32.4477 177.1054 55 A 3.9781 8.9543 124.1691 55.8403 18.1832 180.1029 56 D 4.2977 8.0948 116.3434 57.3954 40.9022 178.6396 57 A 3.9981 8.0396 120.5944 55.1374 18.4078 179.2882 58 A 3.9582 8.2741 119.4087 55.4537 18.4183 180.1747 59 R 3.8702 8.1671 116.5439 59.0959 30.1807 178.8903 60 L 3.9380 7.8895 120.1173 58.4905 42.1762 179.5402 61 V 3.7790 8.2260 112.6736 64.2669 31.4259 178.7585 62 G 3.6724 8.3729 105.4849 47.7407 0.0000 175.6610 63 A 3.9978 8.2006 123.0446 54.9888 18.2653 179.9020 64 K 3.9774 7.8712 115.6275 58.7322 32.1542 178.5150 65 L 4.4750 7.6596 116.1233 53.1080 42.6712 175.5491 66 D 4.3573 7.7301 116.9618 55.1177 39.9776 173.6291 67 L 4.3361 8.1669 117.9406 53.7827 42.9797 177.7844 68 D 4.6653 8.3165 122.3962 53.1914 41.7600 177.2191 69 E 4.0864 8.5691 118.3054 59.2350 29.4367 179.1567 70 D 4.3974 8.1197 118.8343 57.3351 40.9013 178.8041 71 S 4.1206 8.7858 116.0985 61.7261 62.6655 176.7741 72 I 3.7438 7.5507 121.2612 64.1710 37.2061 177.9620 73 L 4.2357 8.0559 121.2309 58.1676 41.9607 178.9853 74 L 4.0151 8.0098 118.9682 57.8761 41.5019 179.5237 75 L 4.0997 8.0817 118.4856 57.2423 41.2865 178.7981 76 Q 4.6642 7.5430 117.3282 55.7833 29.3876 175.9713 77 M 4.5201 7.2538 120.0671 54.8570 33.1841 176.3827 78 I 4.0462 8.8594 124.5352 60.6874 38.1323 174.3144 79 P 4.6553 0.0000 0.0000 62.3656 32.7595 176.3755 80 L 4.3346 8.3056 123.2644 54.0886 41.3618 176.4114 81 R 4.1623 8.2699 124.6407 55.5846 30.8887 175.1915 82 G 3.0659 8.2751 109.3327 44.9014 0.0000 173.1158 83 C 4.2790 8.0654 122.7349 58.9827 30.6033 174.4052 84 I 4.0625 7.5068 121.9154 60.3801 37.6468 174.8732 85 D 4.4740 8.8798 125.5516 57.1116 41.5112 176.6467 86 D 4.6336 7.3248 115.2710 53.2320 41.5412 173.7881 87 R 4.2181 8.1851 127.1184 56.6002 29.1856 176.9289 88 I 4.0360 7.1594 115.9928 58.2903 39.0519 174.0193 89 P 4.4302 0.0000 0.0000 62.9518 31.8256 176.3983 90 T 4.2054 8.3146 111.1659 63.3287 69.9733 175.6179 91 D 4.4479 7.9759 122.2276 53.3590 42.5146 174.5919 92 P 4.2949 0.0000 0.0000 66.1180 31.2108 178.7666 93 T 3.8951 7.9774 112.7555 67.0671 68.6670 176.1571 94 M 4.4860 8.2081 120.3895 58.6022 32.0180 178.0163 95 Y 4.0297 8.8933 120.2200 60.9757 38.8986 178.4785 96 R 3.9888 8.0392 118.6393 59.3599 29.9495 179.0791 97 F 4.1669 7.6931 117.7046 60.4725 38.8897 177.0572 98 Y 3.9587 7.9438 118.8081 60.6367 38.5096 177.5358 99 E 3.6908 8.2282 120.4464 59.4632 29.6626 178.5088 100 M 4.1388 8.0677 118.6640 58.6616 32.0557 178.8123 101 L 4.0167 7.5692 118.9891 57.8569 41.5385 179.5981 102 Q 3.8065 7.4986 117.1413 58.5178 28.6049 178.6717 103 V 3.5830 7.8116 118.8832 65.2892 32.0356 176.8833 104 Y 4.6386 8.1691 114.0041 57.3485 38.4724 177.6440 105 G 3.7012 8.1570 109.2504 48.2968 0.0000 176.1055 106 T 4.0605 7.8173 111.6727 64.3965 68.9570 176.9270 107 T 3.9223 7.8520 118.4371 66.3258 68.5477 176.3672 108 L 3.9852 8.5826 121.3204 57.6884 41.6970 179.3328 109 K 3.7534 8.0185 119.1083 59.5556 32.1481 178.4229 110 A 4.0380 8.2101 121.0236 55.4219 18.2475 179.6799 111 L 4.0117 8.1982 117.5198 57.6122 41.6059 179.7690 112 V 3.8332 8.0144 118.4326 66.5551 31.0328 177.8663 113 H 4.9681 8.1633 117.1770 58.3744 28.2923 177.4959 114 E 3.9691 8.1589 120.2169 59.2800 29.6189 178.6309 115 K 3.9630 8.2317 117.3357 57.7284 32.2642 177.2682 116 F 4.0763 9.2784 115.2658 59.7300 40.9985 175.8791 117 G 4.2083 7.7864 104.4292 43.9503 0.0000 171.6850 118 D 4.6123 8.4761 119.5987 54.5905 42.1879 176.0790 119 G 4.2398 7.8827 111.2813 45.2926 0.0000 172.2480 120 I 4.8175 8.3560 113.9934 59.4076 41.8384 174.3337 121 I 4.7169 8.0980 123.4150 59.6486 38.2730 175.8793 122 S 4.2687 9.0260 123.0230 58.4000 62.7390 173.8045 123 A 3.8739 8.5611 127.5933 52.1069 19.4828 177.0580 124 I 4.2535 7.7731 115.6411 63.0685 38.9617 176.9479 125 N 4.7796 7.7861 123.2322 52.2013 37.8150 171.9264 126 F 5.5017 8.0391 123.0212 56.4790 42.8017 172.5360 127 K 4.5875 8.3881 124.1160 55.0604 36.3442 174.8164 128 L 5.6754 8.2137 119.6754 53.6103 43.7478 174.8090 129 D 4.8200 8.3866 118.1219 52.0024 43.3704 173.8136 130 V 4.7773 8.3419 119.1116 61.1548 33.8747 174.6601 131 K 4.7188 9.0928 127.1976 54.4364 35.4707 174.8430 132 K 5.1009 8.6461 125.1550 54.9185 33.8532 175.7514 133 V 4.6639 8.7059 125.6497 59.5491 35.1164 174.6707 134 A 4.3617 8.6652 124.6043 52.1577 19.4123 176.3528 135 D 4.6352 8.9073 121.5238 52.2919 42.1799 175.7064 136 P 4.4495 0.0000 0.0000 65.6962 31.4087 176.8926 137 E 4.1846 8.5890 115.5021 56.2318 29.7880 177.2252 138 G 3.9257 8.3883 107.3751 46.4688 0.0000 175.3844 139 G 3.8404 9.1509 107.6731 44.0274 0.0000 171.7742 140 E 5.1959 8.3231 116.6776 54.7317 33.7829 175.4451 141 R 4.7970 9.3470 120.1770 54.3940 34.2412 174.3022 142 A 4.9614 8.5859 123.7373 50.6839 20.7406 176.6668 143 V 4.1979 8.9618 123.5890 61.4116 33.4487 174.3809 144 I 4.7903 8.3700 129.3635 60.0178 39.0004 175.3772 145 T 4.4653 8.7139 124.8578 62.0313 70.1811 173.7218 146 L 4.7026 8.5006 127.0439 53.3768 43.3821 175.9426 147 D 4.6555 8.8278 124.0450 52.2541 43.1478 174.0287 148 G 4.6257 8.4292 111.6018 43.5766 0.0000 170.5435 149 K 4.2625 8.7895 124.8673 56.2136 33.3042 175.3055 150 Y 4.5710 8.8009 128.7764 57.6410 40.0803 174.3425 151 G 3.8618 8.9619 116.2403 43.7718 0.0000 170.9608 152 P 4.4901 0.0000 0.0000 62.3474 32.7077 176.6841 153 T 4.3344 8.6624 119.2430 62.6896 69.2309 173.9928 154 K 4.6157 8.4115 126.6773 53.2401 34.0794 174.8259 155 P 4.2370 0.0000 0.0000 63.3103 31.4386 176.1284 156 F 4.5610 8.0382 115.1302 56.9807 37.9245 174.9380 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 1 M 8.30 4.38 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.41 3.58 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.42 4.83 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.52 2.27 0.00 4 S 8.69 5.17 0.00 3.81 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 5 Q 8.97 4.85 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 6 I 8.44 4.36 1.87 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 1.30 0.67 0.91 0.00 0.00 7 N 7.82 4.86 0.00 2.76 2.68 0.00 0.00 6.93 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 R 8.59 3.96 0.00 2.06 2.28 0.00 3.11 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.58 4.36 0.00 2.88 2.91 0.00 0.00 6.84 6.70 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 10 I 7.46 3.69 1.87 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 1.65 1.10 0.91 0.00 0.00 11 R 7.89 4.03 0.00 1.81 1.95 0.00 3.28 0.00 0.00 3.48 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.64 0.00 12 L 8.19 4.03 0.00 1.68 1.71 0.91 0.94 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 13 D 8.33 4.34 0.00 2.93 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 14 L 7.94 3.94 0.00 1.78 1.83 0.93 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.09 4.14 1.44 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 0.00 0.00 16 D 8.16 4.29 0.00 2.91 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 17 A 8.01 4.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 I 8.28 3.69 2.05 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 1.54 0.81 0.96 0.00 0.00 19 L 8.25 4.04 0.00 1.85 1.75 0.99 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.95 3.93 0.00 1.78 1.80 0.92 0.87 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 21 S 8.06 4.03 0.00 3.94 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 22 K 8.35 3.75 0.00 1.81 1.93 0.00 1.20 0.00 0.00 1.25 0.00 0.00 2.31 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.23 1.25 7.81 23 A 8.08 3.92 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 24 K 8.06 3.93 0.00 1.91 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.61 7.81 25 K 8.16 4.16 0.00 1.68 1.82 0.00 1.87 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.57 7.81 26 D 7.73 4.30 0.00 2.76 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 L 7.86 4.76 0.00 1.53 1.45 0.97 0.99 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 28 S 8.73 4.63 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 29 F 8.23 4.20 0.00 3.21 3.13 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 30 A 8.09 4.06 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 31 E 8.42 4.08 0.00 2.21 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 0.00 2.46 2.32 0.00 32 I 7.64 3.69 1.93 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 1.43 0.61 0.96 0.00 0.00 33 A 8.15 4.30 1.39 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 0.00 0.00 0.00 34 D 7.22 4.51 0.00 2.81 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 35 G 9.03 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 36 T 7.67 3.99 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 1.28 0.00 0.00 37 G 8.28 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 38 L 7.59 4.71 0.00 1.72 1.62 1.03 0.44 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 39 A 8.33 4.12 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 40 E 9.02 3.90 0.00 2.08 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 2.44 2.49 0.00 41 A 8.00 3.92 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.14 3.91 0.00 3.20 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.07 3.63 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 1.08 0.00 0.00 44 T 8.18 3.74 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 0.00 0.00 45 A 7.88 3.83 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 46 A 7.55 4.21 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 47 L 7.68 3.98 0.00 1.84 1.83 1.15 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.70 4.44 0.00 1.65 1.63 0.72 0.90 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 49 G 8.09 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 0.00 0.00 0.00 50 Q 8.22 4.52 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.42 6.64 0.00 0.00 0.00 0.00 0.00 2.21 2.36 0.00 51 Q 7.40 4.41 0.00 1.39 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.90 0.00 0.00 0.00 0.00 0.00 2.03 1.47 0.00 52 A 8.29 4.92 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 53 L 8.77 4.61 0.00 1.64 1.65 0.95 1.23 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 54 P 0.00 4.56 0.00 2.10 1.99 0.00 3.72 0.00 0.00 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.14 0.00 55 A 8.95 3.98 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 56 D 8.09 4.30 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 57 A 8.04 4.00 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 58 A 8.27 3.96 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 59 R 8.17 3.87 0.00 1.98 1.99 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 60 L 7.89 3.94 0.00 1.93 1.83 0.93 1.08 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 61 V 8.23 3.78 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 0.86 0.00 0.00 1.01 0.00 0.00 62 G 8.37 3.67 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 0.00 0.00 0.00 63 A 8.20 4.00 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 64 K 7.87 3.98 0.00 1.94 1.89 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.66 7.81 65 L 7.66 4.48 0.00 1.61 1.67 0.97 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.73 4.36 0.00 2.75 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 L 8.17 4.34 0.00 1.64 1.58 0.93 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.32 4.67 0.00 2.95 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.57 4.09 0.00 2.00 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 2.40 2.34 0.00 70 D 8.12 4.40 0.00 2.84 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.79 4.12 0.00 4.02 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 I 7.55 3.74 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 1.42 0.61 0.97 0.00 0.00 73 L 8.06 4.24 0.00 1.88 1.87 0.93 0.42 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 74 L 8.01 4.02 0.00 1.91 1.70 0.92 0.50 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 75 L 8.08 4.10 0.00 1.87 1.73 0.93 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.54 4.66 0.00 2.25 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.88 0.00 0.00 0.00 0.00 0.00 2.55 2.38 0.00 77 M 7.25 4.52 0.00 1.92 2.10 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 2.90 2.52 0.00 78 I 8.86 4.05 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 1.30 0.74 0.92 0.00 0.00 79 P 0.00 4.66 0.00 2.09 2.05 0.00 3.75 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 1.95 1.93 0.00 80 L 8.31 4.33 0.00 1.82 1.64 0.91 0.93 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 81 R 8.27 4.16 0.00 1.82 1.88 0.00 3.25 0.00 0.00 3.20 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 82 G 8.28 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 0.00 0.00 0.00 83 C 8.07 4.28 0.00 3.06 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 84 I 7.51 4.06 1.85 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 1.30 0.54 0.89 0.00 0.00 85 D 8.88 4.47 0.00 2.63 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 86 D 7.32 4.63 0.00 2.60 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 87 R 8.19 4.22 0.00 1.98 2.04 0.00 3.21 0.00 0.00 3.22 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.16 4.04 1.75 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.72 0.64 0.00 0.00 89 P 0.00 4.43 0.00 2.17 2.04 0.00 3.30 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.09 0.00 90 T 8.31 4.21 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 91 D 7.98 4.45 0.00 2.85 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 92 P 0.00 4.29 0.00 2.23 2.12 0.00 3.69 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.18 0.00 93 T 7.98 3.90 4.49 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 1.34 0.00 0.00 94 M 8.21 4.49 0.00 2.12 2.22 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.62 0.00 95 Y 8.89 4.03 0.00 3.20 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 96 R 8.04 3.99 0.00 1.46 1.72 0.00 3.34 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.74 0.00 97 F 7.69 4.17 0.00 3.30 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 7.94 3.96 0.00 2.93 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 99 E 8.23 3.69 0.00 1.91 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 2.31 2.39 0.00 100 M 8.07 4.14 0.00 2.18 2.36 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.63 0.00 101 L 7.57 4.02 0.00 1.49 1.55 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.50 3.81 0.00 1.94 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.97 0.00 0.00 0.00 0.00 0.00 1.67 2.36 0.00 103 V 7.81 3.58 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 0.06 0.00 0.00 0.89 0.00 0.00 104 Y 8.17 4.64 0.00 3.20 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 0.00 105 G 8.16 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 0.00 0.00 0.00 106 T 7.82 4.06 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 1.20 0.00 0.00 107 T 7.85 3.92 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 1.33 0.00 0.00 108 L 8.58 3.99 0.00 1.84 1.74 0.95 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.02 3.75 0.00 1.84 2.01 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.47 7.81 110 A 8.21 4.04 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 L 8.20 4.01 0.00 1.79 1.76 0.95 0.80 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 0.00 112 V 8.01 3.83 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 1.07 0.00 0.00 0.95 0.00 0.00 113 H 8.16 4.97 0.00 3.38 3.37 0.00 5.68 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.16 3.97 0.00 1.98 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 115 K 8.23 3.96 0.00 1.57 1.19 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.48 7.81 116 F 9.28 4.08 0.00 2.46 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 0.00 0.00 0.00 0.00 117 G 7.79 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 D 8.48 4.61 0.00 2.74 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 0.00 119 G 7.88 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 I 8.36 4.82 1.86 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 1.20 1.14 0.93 0.00 0.00 121 I 8.10 4.72 1.81 0.00 0.00 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.67 0.93 0.00 0.00 122 S 9.03 4.27 0.00 3.90 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.56 3.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.77 4.25 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.94 0.93 0.00 0.00 125 N 7.79 4.78 0.00 2.80 2.75 0.00 0.00 6.48 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 0.00 126 F 8.04 5.50 0.00 3.12 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 0.00 127 K 8.39 4.59 0.00 1.61 1.67 0.00 1.22 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.12 1.16 7.81 128 L 8.21 5.68 0.00 1.64 1.35 0.98 0.81 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 0.00 129 D 8.39 4.82 0.00 2.65 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 8.34 4.78 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 0.88 0.00 0.00 0.91 0.00 0.00 131 K 9.09 4.72 0.00 1.84 1.65 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.52 7.81 132 K 8.65 5.10 0.00 1.78 1.71 0.00 1.74 0.00 0.00 1.78 0.00 0.00 3.12 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.43 7.81 133 V 8.71 4.66 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 0.73 0.00 0.00 0.94 0.00 0.00 134 A 8.67 4.36 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 0.00 135 D 8.91 4.64 0.00 2.72 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 0.00 136 P 0.00 4.45 0.00 2.08 2.13 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 137 E 8.59 4.18 0.00 2.07 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 2.32 2.40 0.00 138 G 8.39 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 0.00 139 G 9.15 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 0.00 140 E 8.32 5.20 0.00 1.81 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 2.21 2.32 0.00 141 R 9.35 4.80 0.00 1.67 1.78 0.00 3.20 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 142 A 8.59 4.96 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 0.00 143 V 8.96 4.20 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 1.05 0.00 0.00 0.94 0.00 0.00 144 I 8.37 4.79 1.96 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.82 0.95 0.00 0.00 145 T 8.71 4.47 4.42 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 1.18 0.00 0.00 146 L 8.50 4.70 0.00 1.63 1.93 0.99 1.16 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 0.00 147 D 8.83 4.66 0.00 2.58 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 0.00 148 G 8.43 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 0.00 0.00 0.00 0.00 149 K 8.79 4.26 0.00 1.94 1.71 0.00 1.57 0.00 0.00 1.60 0.00 0.00 2.95 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.44 1.46 7.81 150 Y 8.80 4.57 0.00 2.75 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 0.00 151 G 8.96 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.49 0.00 1.96 1.90 0.00 3.22 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.82 0.00 153 T 8.66 4.33 4.20 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 1.28 0.00 0.00 154 K 8.41 4.62 0.00 1.73 1.75 0.00 1.80 0.00 0.00 1.79 0.00 0.00 3.09 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.39 7.81 155 P 0.00 4.24 0.00 2.14 2.03 0.00 3.79 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 156 F 8.04 4.56 0.00 3.13 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