NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2946 8.3149 119.9994 56.7406 32.8384 174.6998 2 K 4.3551 8.1488 123.7651 52.0378 33.8435 174.4609 3 P 4.7257 0.0000 0.0000 63.3596 33.7039 174.7578 4 K 4.8451 8.9745 119.1620 54.8321 36.8860 176.0910 5 L 4.7814 8.4985 123.4609 54.0242 43.4427 176.1393 6 L 5.1522 8.7559 121.2601 53.4655 44.7472 174.8464 7 Y 4.8929 9.0150 127.0575 55.9981 40.5950 174.0701 8 C 4.1708 8.9679 129.2140 57.8679 32.1506 174.4662 9 S 4.0332 8.4698 120.7035 59.7218 63.4235 174.7344 10 N 4.1853 8.0109 119.9562 56.3835 38.4630 175.4217 11 G 3.8218 7.7417 102.1171 44.5178 0.0000 171.9561 12 G 3.1691 7.7743 106.5320 43.9304 0.0000 173.4033 13 H 4.8794 6.6342 114.3282 53.6948 33.7318 174.7982 14 F 4.9984 9.1943 121.6914 56.9195 40.3617 174.9065 15 L 4.5909 9.2412 126.2508 55.4044 43.2701 175.6380 16 R 4.9283 9.2922 125.9023 54.6132 33.7720 174.0310 17 I 4.5096 8.3520 126.3068 59.5250 39.0278 175.5431 18 L 4.2414 9.0883 128.0627 53.1291 42.4873 176.9089 19 P 4.2386 0.0000 0.0000 65.6281 31.3163 177.4951 20 D 4.4283 7.9604 115.4694 54.2891 39.8597 177.0124 21 G 4.0529 8.5392 109.8552 45.4199 0.0000 173.3671 22 T 4.2717 8.6907 118.4526 63.2223 68.9289 173.5296 23 V 4.8426 8.2274 126.0769 61.1639 33.9839 174.3471 24 D 4.5734 8.5276 125.9283 52.9372 42.6410 174.0577 25 G 4.6042 8.6821 104.8894 45.4060 0.0000 172.1802 26 T 4.9761 8.7507 114.0629 60.5375 71.1810 174.5211 27 R 4.4445 8.8545 123.9513 56.2968 30.9249 176.3659 28 D 4.6939 8.0937 119.6217 52.8717 40.1490 176.9809 29 R 3.7547 8.4768 126.4432 58.6589 30.2325 178.3795 30 S 4.2904 7.8761 112.1096 59.5047 63.1642 174.2181 31 D 4.5048 7.6779 120.4216 54.3974 41.3887 175.9685 32 Q 4.2197 8.4323 122.0952 57.0681 29.5764 176.2714 33 H 4.8958 8.6032 115.5010 55.4189 28.9848 175.3437 34 I 4.7112 7.4238 112.6800 60.1365 39.8249 174.8562 35 Q 4.3093 7.9392 123.6684 55.6565 29.8405 174.7818 36 L 5.0981 8.8316 124.0972 52.8051 45.7095 175.1873 37 Q 4.7854 9.2056 124.8465 54.4061 31.0183 174.1042 38 L 5.6441 8.7817 126.4199 52.9021 43.7768 176.2210 39 S 4.7541 8.4549 115.8834 56.7905 66.7243 172.8580 40 A 4.7518 8.7076 126.7735 51.1430 18.6302 176.5504 41 E 4.0570 8.6042 125.0613 59.0747 30.0473 177.1268 42 S 4.8528 7.4428 111.8671 56.0532 66.8438 175.0511 43 V 3.5401 8.6143 120.1477 66.2798 31.2606 176.9089 44 G 3.9921 8.0241 105.8899 45.4624 0.0000 172.0973 45 E 5.2301 8.1518 119.9001 54.5051 32.9574 175.2674 46 V 4.9959 8.9256 117.4210 59.7904 36.0860 174.7385 47 Y 4.8139 8.8158 121.7032 57.5364 40.1105 174.9108 48 I 4.5184 8.6200 122.0592 59.6208 40.4198 174.1294 49 K 4.6116 8.6620 128.9995 53.8250 35.2452 175.2162 50 S 4.4707 9.0631 123.4349 58.7566 62.6517 175.0247 51 T 3.8714 8.5002 118.1321 64.3656 68.6892 175.6886 52 E 4.1069 8.3355 122.7859 58.6172 29.9987 176.9764 53 T 4.2219 7.6573 105.8046 60.8391 69.8079 175.3721 54 G 3.7770 7.9489 109.6196 46.2897 0.0000 173.3451 55 Q 4.5742 7.6349 118.1662 54.9636 30.7493 174.3975 56 Y 4.8976 8.9940 120.1082 56.1375 40.5279 175.0947 57 L 4.4762 8.8827 126.3197 55.5084 43.3567 175.6312 58 A 5.2687 8.7549 126.1120 51.0126 23.3648 174.3931 59 M 5.5260 8.5855 118.5637 54.0115 35.1516 175.3903 60 D 4.9513 9.3258 126.4280 52.4033 41.0749 177.0455 61 T 4.1824 8.5035 108.4006 63.9195 68.6538 174.4976 62 D 4.6641 8.4623 121.2051 54.2079 41.4612 177.2690 63 G 3.2954 8.6981 108.7732 44.6436 0.0000 172.5856 64 L 4.6224 7.7602 122.1743 54.0954 43.5208 175.7946 65 L 5.0712 8.6049 126.4493 55.0912 42.5823 175.6952 66 Y 5.0924 9.2717 120.6149 55.7468 42.2203 173.8327 67 G 4.3059 8.7535 108.2248 44.7933 0.0000 173.1006 68 S 4.9262 9.1934 122.3717 57.2540 63.4927 175.3264 69 Q 4.4882 9.0279 125.6536 58.0721 29.0498 176.2440 70 T 4.7809 7.5380 106.3250 58.6426 71.8723 171.8873 71 P 3.7162 0.0000 0.0000 62.8723 32.1141 174.9920 72 N 4.5537 7.8480 115.4725 52.3430 39.4180 174.7554 73 E 3.9982 8.8072 115.5171 59.2308 29.8558 177.6465 74 E 4.1631 8.1410 117.6869 57.6517 29.9350 177.1846 75 C 5.1574 7.7876 115.0711 59.2370 29.0288 173.2786 76 L 4.5667 7.2120 120.6595 53.3579 43.4167 175.5435 77 F 5.1037 8.4310 120.1634 55.7878 43.9540 173.5294 78 L 4.9485 9.2638 123.0151 53.5972 43.1779 175.0462 79 E 4.9769 9.3279 126.0648 54.7773 31.0938 175.3150 80 R 4.7301 8.4558 124.8292 54.1891 34.4424 174.0850 81 L 4.7107 8.5512 124.7654 54.6623 42.9657 175.8664 82 E 4.2517 8.9647 126.5191 54.6530 31.8040 174.8385 83 E 3.4628 9.2164 117.7419 61.0652 30.2989 176.0826 84 N 4.8115 8.1926 114.6264 54.2097 39.5521 176.6639 85 H 4.3424 8.4364 113.5594 55.8728 26.9881 175.3324 86 Y 4.3816 7.6312 117.0923 58.1296 38.9587 174.8336 87 N 5.4996 9.8816 121.2644 51.9957 42.0293 173.8124 88 T 5.2161 8.5293 110.4063 60.3578 72.8538 173.0062 89 Y 5.2230 8.6825 118.6006 56.8131 41.7749 173.8691 90 I 4.9876 8.6350 125.4284 58.7362 40.8515 174.6721 91 S 4.0279 8.7950 124.3288 58.3064 62.3171 173.6306 92 K 3.9005 8.5958 129.4276 59.4902 32.0945 178.7325 93 K 3.7699 7.8172 117.6905 58.9094 32.2008 176.2073 94 H 4.9144 8.2175 115.5416 53.9755 29.7794 175.7120 95 A 3.9356 8.1955 125.6671 54.9070 18.4210 180.7523 96 E 3.9613 8.0102 113.6837 58.7356 29.7908 178.6521 97 K 4.0519 7.3349 117.4887 56.0562 32.6737 176.0088 98 N 4.0480 7.5660 115.0011 53.9535 36.0928 174.2015 99 W 4.9015 7.9840 117.6925 56.3929 30.6046 176.1194 100 F 5.6394 8.8531 123.0429 55.3146 41.4791 175.8060 101 V 3.8680 8.8497 122.1680 63.6189 32.3874 175.1913 102 G 5.1046 8.6823 112.6905 45.2462 0.0000 171.5571 103 L 5.3924 8.2414 120.5144 52.3300 45.8760 177.0018 104 K 4.1345 9.3195 123.3495 55.9288 32.7775 178.1507 105 K 4.0789 8.3496 118.7333 59.0267 31.9822 178.0871 106 N 4.5068 8.0594 114.2719 53.0393 37.8298 175.9615 107 G 3.5869 7.8596 108.4489 45.0765 0.0000 173.8628 108 S 4.6417 8.1124 116.3471 58.4570 64.1297 173.4127 109 C 4.7647 8.5244 117.3253 58.0177 30.6689 172.5930 110 K 4.4470 8.4188 123.6288 55.1701 33.0928 176.6454 111 R 4.2882 8.5982 126.1797 55.3765 31.4204 177.4553 112 G 3.4823 8.5116 111.0291 48.2556 0.0000 174.3342 113 P 4.3063 0.0000 0.0000 64.2115 31.5500 176.9541 114 R 4.3288 7.5516 116.9640 56.3223 30.2218 176.1299 115 T 4.8605 7.3100 108.0737 60.0320 70.9059 173.4299 116 H 4.9104 8.2727 119.1260 55.1047 32.6070 172.4155 117 Y 3.7138 8.5223 126.2583 58.9712 38.8857 176.1981 118 G 3.7177 7.5847 114.2703 45.5535 0.0000 174.0686 119 Q 4.0955 7.4242 118.9642 55.5600 29.5848 177.0905 120 K 3.8313 8.2158 118.6663 57.9936 32.9867 179.1309 121 A 4.0273 8.1188 121.4058 53.6218 18.2432 178.4091 122 I 4.8385 7.2205 105.4633 59.9273 38.4873 175.0353 123 L 4.6687 7.3814 123.1614 53.8635 43.0851 175.5392 124 F 5.2383 9.4665 123.1701 55.5795 42.4601 174.3227 125 L 4.2960 9.0512 127.8925 53.2818 42.7464 174.0772 126 P 4.7819 0.0000 0.0000 63.0860 32.2708 176.3167 127 L 4.6724 9.2706 126.9952 51.4995 42.5935 173.0609 128 P 4.6921 0.0000 0.0000 63.1789 31.7281 176.2964 129 V 3.8069 8.0039 125.3099 61.8245 32.1655 176.6412 130 S 4.2921 8.6844 120.8813 58.7391 62.2486 169.4459 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 K 8.31 4.29 0.00 1.88 1.97 0.00 1.42 0.00 0.00 1.93 0.00 0.00 3.04 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.54 7.81 2 K 8.15 4.36 0.00 1.84 1.76 0.00 1.75 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.36 1.49 7.81 3 P 0.00 4.73 0.00 2.08 2.15 0.00 3.64 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.98 0.00 4 K 8.97 4.85 0.00 1.66 1.70 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.43 7.81 5 L 8.50 4.78 0.00 1.77 1.70 0.29 0.27 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 6 L 8.76 5.15 0.00 1.61 1.74 0.49 0.86 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 7 Y 9.01 4.89 0.00 3.24 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 8 C 8.97 4.17 0.00 2.28 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.47 4.03 0.00 3.93 4.06 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 10 N 8.01 4.19 0.00 2.60 2.72 0.00 0.00 6.77 7.98 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 11 G 7.74 3.82 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 0.00 0.00 0.00 12 G 7.77 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 0.00 0.00 0.00 13 H 6.63 4.88 0.00 2.97 3.10 0.00 5.81 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 F 9.19 5.00 0.00 3.06 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 15 L 9.24 4.59 0.00 1.85 1.55 0.99 0.46 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 16 R 9.29 4.93 0.00 1.94 2.05 0.00 3.23 0.00 0.00 3.25 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.78 0.00 17 I 8.35 4.51 1.85 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.76 0.90 0.00 0.00 18 L 9.09 4.24 0.00 1.87 1.57 0.91 0.82 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 19 P 0.00 4.24 0.00 2.02 2.12 0.00 3.54 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.05 0.00 20 D 7.96 4.43 0.00 2.80 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 21 G 8.54 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 T 8.69 4.27 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 23 V 8.23 4.84 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 0.86 0.00 0.00 0.94 0.00 0.00 24 D 8.53 4.57 0.00 2.86 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 25 G 8.68 4.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 T 8.75 4.98 4.34 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 1.47 0.00 0.00 27 R 8.85 4.44 0.00 1.90 2.01 0.00 3.23 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 28 D 8.09 4.69 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 29 R 8.48 3.75 0.00 1.79 1.86 0.00 3.73 0.00 0.00 3.55 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.17 0.00 30 S 7.88 4.29 0.00 4.14 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 31 D 7.68 4.50 0.00 2.77 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 32 Q 8.43 4.22 0.00 1.68 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.19 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 33 H 8.60 4.90 0.00 3.25 3.49 0.00 5.77 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.42 4.71 1.96 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.25 1.01 0.00 0.00 35 Q 7.94 4.31 0.00 2.03 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.89 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 36 L 8.83 5.10 0.00 1.64 1.42 0.82 0.56 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 37 Q 9.21 4.79 0.00 2.06 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.35 0.00 38 L 8.78 5.64 0.00 1.57 1.62 0.87 0.92 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 39 S 8.45 4.75 0.00 3.95 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 40 A 8.71 4.75 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 41 E 8.60 4.06 0.00 1.80 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 2.27 2.33 0.00 42 S 7.44 4.85 0.00 3.85 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 43 V 8.61 3.54 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 0.78 0.00 0.00 0.94 0.00 0.00 44 G 8.02 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 45 E 8.15 5.23 0.00 1.79 1.72 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 2.17 2.23 0.00 46 V 8.93 5.00 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 0.88 0.00 0.00 1.14 0.00 0.00 47 Y 8.82 4.81 0.00 3.11 3.21 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 48 I 8.62 4.52 1.69 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 0.89 0.72 0.66 0.00 0.00 49 K 8.66 4.61 0.00 1.25 1.51 0.00 1.33 0.00 0.00 1.22 0.00 0.00 2.73 0.00 0.00 2.78 0.00 0.00 0.00 0.00 0.97 0.47 7.81 50 S 9.06 4.47 0.00 3.85 3.73 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 0.00 0.00 0.00 0.00 51 T 8.50 3.87 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 1.16 0.00 0.00 52 E 8.34 4.11 0.00 1.94 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 2.19 2.33 0.00 53 T 7.66 4.22 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 1.26 0.00 0.00 54 G 7.95 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 0.00 0.00 0.00 55 Q 7.63 4.57 0.00 2.02 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.14 6.75 0.00 0.00 0.00 0.00 0.00 2.37 2.33 0.00 56 Y 8.99 4.90 0.00 2.93 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 57 L 8.88 4.48 0.00 1.62 1.47 0.82 0.37 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 58 A 8.75 5.27 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 M 8.59 5.53 0.00 2.27 2.23 0.00 0.00 0.00 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.77 0.00 60 D 9.33 4.95 0.00 2.94 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 T 8.50 4.18 4.35 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 1.31 0.00 0.00 62 D 8.46 4.66 0.00 2.85 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 63 G 8.70 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 L 7.76 4.62 0.00 1.89 1.69 0.91 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 65 L 8.60 5.07 0.00 1.65 1.65 0.96 0.94 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 66 Y 9.27 5.09 0.00 3.07 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 67 G 8.75 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 S 9.19 4.93 0.00 3.70 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 69 Q 9.03 4.49 0.00 2.16 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.40 2.40 0.00 70 T 7.54 4.78 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 1.24 0.00 0.00 71 P 0.00 3.72 0.00 1.60 0.57 0.00 3.65 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.54 0.00 72 N 7.85 4.55 0.00 2.87 2.93 0.00 0.00 5.77 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 73 E 8.81 4.00 0.00 2.04 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 0.00 2.27 2.32 0.00 74 E 8.14 4.16 0.00 2.19 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 0.00 2.44 2.39 0.00 75 C 7.79 5.16 0.00 3.31 3.29 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 76 L 7.21 4.57 0.00 1.32 1.32 0.06 0.89 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 77 F 8.43 5.10 0.00 2.97 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 78 L 9.26 4.95 0.00 1.58 1.60 0.87 0.73 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 79 E 9.33 4.98 0.00 2.17 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 2.23 2.08 0.00 80 R 8.46 4.73 0.00 1.78 1.76 0.00 3.32 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 81 L 8.55 4.71 0.00 1.66 1.58 0.91 0.91 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 82 E 8.96 4.25 0.00 2.10 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 2.36 2.48 0.00 83 E 9.22 3.46 0.00 1.96 1.90 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 2.34 2.35 0.00 84 N 8.19 4.81 0.00 3.09 3.03 0.00 0.00 6.97 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 85 H 8.44 4.34 0.00 3.24 3.51 0.00 5.89 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.63 4.38 0.00 3.03 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 87 N 9.88 5.50 0.00 2.70 2.19 0.00 0.00 6.50 5.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 T 8.53 5.22 4.59 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 1.37 0.00 0.00 89 Y 8.68 5.22 0.00 2.93 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 I 8.63 4.99 1.27 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 1.00 1.30 0.88 0.00 0.00 91 S 8.79 4.03 0.00 3.94 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 92 K 8.60 3.90 0.00 1.69 1.66 0.00 1.58 0.00 0.00 1.44 0.00 0.00 2.76 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.33 1.29 7.81 93 K 7.82 3.77 0.00 1.74 1.58 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.09 1.42 7.81 94 H 8.22 4.91 0.00 2.96 2.31 0.00 5.68 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 95 A 8.20 3.94 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 96 E 8.01 3.96 0.00 2.04 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 2.20 2.17 0.00 97 K 7.33 4.05 0.00 1.09 1.50 0.00 0.61 0.00 0.00 0.83 0.00 0.00 2.39 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.16 1.03 7.81 98 N 7.57 4.05 0.00 3.02 3.01 0.00 0.00 6.98 7.73 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 99 W 7.98 4.90 0.00 3.29 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.85 5.64 0.00 3.01 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 V 8.85 3.87 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 0.62 0.00 0.00 0.63 0.00 0.00 102 G 8.68 5.10 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 0.00 0.00 0.00 103 L 8.24 5.39 0.00 1.50 1.48 1.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 104 K 9.32 4.13 0.00 1.91 1.72 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.90 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.43 1.51 7.81 105 K 8.35 4.08 0.00 1.71 1.83 0.00 1.69 0.00 0.00 1.98 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.38 1.38 7.81 106 N 8.06 4.51 0.00 2.79 2.91 0.00 0.00 6.24 7.00 0.00 0.00 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 G 7.86 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 S 8.11 4.64 0.00 4.08 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 0.00 109 C 8.52 4.76 0.00 3.02 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 0.00 110 K 8.42 4.45 0.00 1.80 1.76 0.00 1.78 0.00 0.00 1.82 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.37 1.38 7.81 111 R 8.60 4.29 0.00 1.76 1.65 0.00 3.13 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.57 0.00 112 G 8.51 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 0.00 113 P 0.00 4.31 0.00 2.15 2.27 0.00 3.07 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 1.73 1.62 0.00 114 R 7.55 4.33 0.00 1.92 1.97 0.00 3.27 0.00 0.00 3.24 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.64 0.00 115 T 7.31 4.86 4.44 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 1.47 0.00 0.00 116 H 8.27 4.91 0.00 3.21 3.17 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 0.00 117 Y 8.52 3.71 0.00 3.04 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 0.00 118 G 7.58 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 Q 7.42 4.10 0.00 1.94 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.69 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 120 K 8.22 3.83 0.00 1.80 1.67 0.00 1.55 0.00 0.00 1.68 0.00 0.00 2.68 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.25 7.81 121 A 8.12 4.03 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 I 7.22 4.84 1.65 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.47 0.74 0.00 0.00 123 L 7.38 4.67 0.00 1.41 1.33 0.51 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 124 F 9.47 5.24 0.00 3.31 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 0.00 125 L 9.05 4.30 0.00 0.92 1.67 0.51 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.78 0.00 2.18 2.19 0.00 3.91 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.09 0.00 127 L 9.27 4.67 0.00 1.76 1.66 0.88 0.96 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 0.00 128 P 0.00 4.69 0.00 2.06 2.10 0.00 3.81 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 129 V 8.00 3.81 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 0.74 0.00 0.00 0.88 0.00 0.00 130 S 8.68 4.29 0.00 4.05 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