NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.5102 8.3049 120.3772 55.0937 33.4086 174.9769 2 L 3.9110 8.3959 128.1600 53.4218 40.3733 174.6227 3 M 2.8656 8.4838 118.6454 53.8628 33.3434 177.9085 4 P 5.0121 0.0000 0.0000 62.6970 31.1931 177.8750 5 R 4.8106 8.3983 119.0601 57.8412 35.6150 174.2277 6 R 4.4558 7.5134 120.6537 54.6000 35.7320 176.0169 7 M 3.4163 9.2828 132.7438 55.8542 31.2001 177.3879 8 K 3.5450 8.4759 122.2110 59.1797 32.7802 176.4320 9 Y 4.7172 7.3205 116.0425 56.4918 40.3050 175.1633 10 R 4.3275 9.6039 125.0270 57.1873 30.7398 173.2326 11 K 3.5983 7.7636 121.2453 54.8985 33.0326 174.1574 12 Q 4.6385 7.8238 124.5897 53.5519 31.7155 175.2171 13 Q 4.0149 8.6369 117.7141 56.5656 29.3448 177.3562 14 R 3.9681 9.0143 121.3065 58.2025 30.3387 173.9680 15 G 3.8542 8.1153 111.6177 44.7065 0.0000 173.3797 16 R 4.3633 8.4653 123.1431 55.8420 31.7476 176.2435 17 L 4.8411 7.9289 117.3280 53.3685 40.7595 176.4675 18 K 4.0404 7.5045 120.7379 59.0211 33.1521 179.2360 19 G 3.6744 7.7132 108.1604 45.3745 0.0000 172.8480 20 A 4.1890 8.1634 122.5591 51.5355 18.0989 177.4354 21 T 3.4223 8.7507 110.1550 63.9085 64.9141 170.7753 22 K 4.2981 7.5404 124.6859 53.8352 34.3962 175.6097 23 G 3.9852 8.2749 113.0773 45.8543 0.0000 173.2672 24 G 4.6260 7.4804 125.2611 43.7685 0.0000 171.1781 25 D 4.9970 6.0500 127.8629 54.6325 43.7464 174.6032 26 Y 4.8617 7.4652 123.7969 56.3559 42.0644 174.7015 27 V 3.5700 8.4595 112.1123 62.5468 32.5600 175.5329 28 A 4.4341 8.0072 129.2527 50.8769 19.5744 174.4288 29 F 4.3087 7.5647 116.0011 58.9285 39.3352 175.0695 30 G 4.3217 9.0667 111.8401 45.6710 0.0000 172.7143 31 D 4.1600 9.1622 121.0469 56.4117 40.5912 178.0324 32 Y 4.8614 8.7212 119.5847 57.4544 41.0807 175.4418 33 G 4.4633 8.7186 108.0811 44.7734 0.0000 171.4845 34 L 5.4383 8.3405 119.7136 52.5839 43.0593 176.2465 35 V 4.4601 8.2450 124.0048 61.2207 33.4437 174.6608 36 A 4.8348 8.8100 123.0201 50.6654 21.0766 177.2144 37 L 4.2057 8.5926 121.6169 56.3868 42.9312 177.0271 38 E 4.8408 7.9183 116.5941 53.5107 31.4792 174.5245 39 P 5.2757 0.0000 0.0000 63.2362 32.7131 174.9552 40 A 4.2312 7.9304 120.7330 51.0950 22.5863 175.5587 41 W 5.5236 7.9733 114.5515 54.7920 28.2114 177.1964 42 I 3.9996 7.7600 120.3895 62.1846 38.0938 177.3919 43 T 4.4976 9.4954 118.0855 60.6359 70.1224 175.4752 44 A 3.9593 8.7268 126.4818 55.9051 18.2727 180.4172 45 Q 4.0511 7.7326 115.9689 59.9958 28.6204 177.8274 46 Q 4.1898 9.0919 121.2296 57.3011 28.6156 178.5652 47 I 3.7296 7.4231 120.0249 64.7516 37.6566 177.3642 48 E 3.9635 8.3591 120.0379 59.1197 29.0845 178.4619 49 A 4.0736 8.2203 120.6425 54.5497 18.5063 178.9357 50 A 4.2231 7.9637 118.9467 54.7264 19.8181 178.7427 51 R 4.1592 8.6062 117.9301 58.9982 29.8026 178.6724 52 V 3.6406 8.3856 119.5679 64.9100 31.1413 178.2336 53 A 3.9572 7.3231 118.5221 55.3128 18.1041 179.0266 54 M 3.5679 7.8615 116.2164 58.5923 31.9285 179.4272 55 V 3.4953 7.2208 117.5935 65.1945 31.4363 177.9528 56 R 4.0017 7.2804 116.7732 59.5416 30.0636 177.0601 57 H 3.6519 7.7483 115.8114 58.2535 31.0809 175.3890 58 F 4.7978 6.7535 119.5253 54.1406 36.7397 175.3376 59 R 3.9739 7.7156 120.9018 58.6175 29.9738 177.0603 60 R 3.9400 8.4178 117.2193 57.8287 27.3033 176.6830 61 G 5.0246 8.1181 103.8140 44.3178 0.0000 171.7294 62 G 4.2346 8.7382 111.0876 46.1763 0.0000 175.7032 63 K 4.6382 6.9688 124.7038 54.2149 35.4987 173.6411 64 I 4.7534 8.0562 126.5799 59.5688 40.2032 174.8391 65 F 5.0757 8.9923 126.8363 55.6377 40.0513 176.4241 66 I 3.5193 8.7187 118.9578 62.5652 37.3458 178.6317 67 R 3.9525 8.2735 114.8156 56.5556 28.8508 175.7690 68 I 4.7424 7.9442 109.7268 58.8238 40.5374 174.5932 69 F 4.8632 8.3972 122.9519 56.0028 42.1453 172.9880 70 P 5.0005 0.0000 0.0000 61.6108 29.8890 174.8228 71 D 4.6341 8.0638 123.7967 53.3447 41.6742 176.1732 72 K 4.2269 7.8349 122.0999 54.9277 32.9156 174.3401 73 P 4.2232 0.0000 0.0000 62.9505 32.0680 175.6275 74 Y 4.8133 7.9288 122.9942 56.1319 41.0968 174.8918 75 T 4.0066 8.0417 116.9716 61.0329 70.8861 174.4181 76 K 3.9728 7.9122 118.3973 55.5696 34.9395 174.9014 77 K 4.0117 8.4838 127.7819 55.9111 32.6765 176.1731 78 P 4.1604 0.0000 0.0000 65.7513 31.6084 175.0241 79 L 4.2028 6.0918 116.2268 55.0370 43.6801 173.1143 80 E 4.7003 7.4075 126.4804 56.0863 30.9570 177.0145 81 V 3.9332 8.5841 127.9575 63.9670 31.4603 176.4772 82 R 4.6028 8.2681 117.2853 55.3197 32.0942 176.2918 83 M 4.3088 7.8465 118.0564 51.3875 31.0266 175.3864 84 G 3.8945 8.0656 107.6445 43.7929 0.0000 171.0855 85 K 4.0902 8.2867 119.9814 55.2680 32.8364 176.6244 86 G 3.7973 8.5662 112.1917 45.8374 0.0000 173.2902 87 K 3.7011 8.9987 125.1438 57.6429 32.6050 175.9142 88 G 3.5154 8.9514 107.4821 46.8484 0.0000 173.5952 89 N 4.6350 9.2960 116.5274 53.0218 37.5055 177.3050 90 V 3.5253 6.7584 116.4827 65.4546 31.7928 176.2113 91 E 4.6999 8.7992 113.0747 55.3837 32.2570 175.6013 92 G 3.7940 7.0638 107.1557 45.1315 0.0000 171.3595 93 Y 4.8741 8.5849 118.5096 56.4326 42.6080 174.7159 94 V 4.9715 8.5662 112.6507 59.9324 36.6545 174.2309 95 A 4.6941 8.7177 122.1790 50.0484 21.7342 175.7066 96 V 3.8946 8.6468 122.9504 63.6331 31.8471 175.6494 97 V 4.2322 8.7807 129.8105 61.1974 32.3140 175.3672 98 K 4.7788 8.3559 128.2446 54.2518 34.6245 174.1942 99 P 4.6114 0.0000 0.0000 65.4432 30.7862 175.1477 100 G 3.6232 9.0015 117.5652 45.6027 0.0000 173.4606 101 R 4.0410 7.6070 120.4081 56.7379 31.5665 175.7138 102 V 4.8202 8.2291 120.7297 61.6687 34.2950 174.4294 103 M 4.1700 8.8611 126.9777 55.2448 34.7409 175.4438 104 F 3.8362 8.2972 118.4132 54.4246 38.6810 174.6965 105 E 4.5655 8.7199 126.6334 56.8203 28.8805 175.3157 106 V 4.8602 8.0634 116.7804 60.4500 34.3653 174.6070 107 A 5.2127 7.7342 120.7275 54.3746 21.1371 176.5621 108 G 3.9005 10.2123 105.0039 46.0541 0.0000 173.5523 109 V 4.2877 7.3401 116.7350 59.7578 34.5532 174.1803 110 T 3.9009 8.4000 114.2526 62.0205 69.2962 174.6030 111 E 3.5428 9.0885 124.5604 59.9447 29.2630 178.2539 112 E 3.8454 8.3392 117.9775 60.1839 29.3914 179.0925 113 Q 4.0013 8.6864 116.8421 59.1727 29.0384 178.7281 114 A 4.0494 8.0026 121.8881 55.8036 18.1515 179.2370 115 M 3.7877 8.3440 116.6435 58.8371 32.3995 177.8895 116 E 4.0091 8.0476 117.8222 58.0596 29.7266 178.4971 117 A 3.9277 7.8107 121.1173 55.1729 18.7940 179.5359 118 L 3.8938 7.8644 115.6759 57.1225 41.8393 179.6297 119 R 3.8884 7.5997 119.3482 59.3919 30.0709 177.9311 120 I 3.6159 7.2254 118.4171 64.7987 37.2096 177.8701 121 A 3.8469 7.7092 120.7539 55.5041 17.9430 179.9872 122 G 3.4640 7.8372 103.8900 48.1405 0.0000 175.3686 123 H 4.4786 7.9944 116.6313 57.2698 28.7760 176.8232 124 K 4.3046 7.7074 119.2152 55.7917 32.9887 176.2660 125 L 4.6935 7.5288 120.7665 52.3967 43.1669 175.4709 126 P 4.5514 0.0000 0.0000 63.8801 31.2396 175.0951 127 I 4.7264 7.2224 119.4292 59.7236 41.4436 174.2593 128 K 4.5175 8.4178 121.7352 55.9093 33.5388 177.1427 129 T 4.7456 8.0696 116.8594 62.5688 71.7280 174.0742 130 K 4.9017 8.3854 117.5505 56.1498 32.8771 174.2862 131 I 3.8751 7.9557 120.9742 61.9003 37.9040 175.9224 132 V 4.1021 8.6787 127.0422 61.7658 32.8206 176.4532 133 R 4.1754 8.6495 125.9577 59.1978 30.6114 176.5844 134 R 3.5127 7.4646 118.5082 55.1315 33.0724 174.7385 135 D 4.3379 8.2121 116.7211 54.9259 41.8538 178.8294 136 A 4.3641 8.4475 129.2420 52.3018 17.0038 176.6030 137 Y 3.7858 7.9093 121.5432 60.3261 39.6166 178.5083 138 D 4.2185 7.6782 114.8519 53.2215 39.6772 173.5731 139 E 3.9928 9.2393 128.9688 57.5663 28.5387 179.3412 140 A 4.3138 8.9710 125.9514 50.6206 16.8903 178.6100 141 Q 4.3693 8.1813 122.3851 55.3041 29.6725 173.0040 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 4.51 0.00 2.57 2.23 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.70 0.00 2 L 8.40 3.91 0.00 1.75 1.66 0.99 0.72 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 3 M 8.48 2.87 0.00 2.06 1.04 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.42 0.00 4 P 0.00 5.01 0.00 1.98 2.05 0.00 2.75 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.01 0.00 5 R 8.40 4.81 0.00 1.74 1.88 0.00 3.22 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.66 0.00 6 R 7.51 4.46 0.00 1.74 0.89 0.00 3.22 0.00 0.00 3.20 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 7 M 9.28 3.42 0.00 2.28 2.25 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.52 0.00 8 K 8.48 3.54 0.00 1.08 1.66 0.00 1.39 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.20 0.86 7.81 9 Y 7.32 4.72 0.00 2.86 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 R 9.60 4.33 0.00 1.82 1.94 0.00 3.52 0.00 0.00 3.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.62 0.00 11 K 7.76 3.60 0.00 1.80 1.96 0.00 1.69 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.17 1.12 7.81 12 Q 7.82 4.64 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.61 0.00 0.00 0.00 0.00 0.00 2.16 2.26 0.00 13 Q 8.64 4.01 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.99 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 14 R 9.01 3.97 0.00 1.93 2.30 0.00 3.52 0.00 0.00 3.46 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.33 1.90 0.00 15 G 8.12 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 16 R 8.47 4.36 0.00 1.82 1.92 0.00 3.24 0.00 0.00 3.25 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.75 0.00 17 L 7.93 4.84 0.00 1.65 1.62 0.82 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 18 K 7.50 4.04 0.00 1.77 1.80 0.00 1.77 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.46 7.81 19 G 7.71 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 20 A 8.16 4.19 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 21 T 8.75 3.42 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 1.26 0.00 0.00 22 K 7.54 4.30 0.00 1.92 1.76 0.00 1.66 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.38 1.44 7.81 23 G 8.27 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 24 G 7.48 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 25 D 6.05 5.00 0.00 2.53 2.42 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 26 Y 7.47 4.86 0.00 2.98 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 27 V 8.46 3.57 2.12 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 0.82 0.00 0.00 1.09 0.00 0.00 28 A 8.01 4.43 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.56 4.31 0.00 1.78 2.54 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 30 G 9.07 4.32 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 0.00 31 D 9.16 4.16 0.00 2.88 2.20 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 32 Y 8.72 4.86 0.00 3.02 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 33 G 8.72 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 0.00 0.00 0.00 0.00 34 L 8.34 5.44 0.00 1.89 1.85 0.95 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.25 4.46 2.12 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 0.80 0.00 0.00 1.07 0.00 0.00 36 A 8.81 4.83 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 37 L 8.59 4.21 0.00 1.64 1.73 0.98 0.88 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 38 E 7.92 4.84 0.00 1.80 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 2.21 2.33 0.00 39 P 0.00 5.28 0.00 2.09 2.07 0.00 3.40 0.00 0.00 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.82 0.00 40 A 7.93 4.23 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 41 W 7.97 5.52 0.00 3.06 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 42 I 7.76 4.00 1.90 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 1.46 0.50 1.02 0.00 0.00 43 T 9.50 4.50 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 1.25 0.00 0.00 44 A 8.73 3.96 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 45 Q 7.73 4.05 0.00 2.39 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.57 0.00 46 Q 9.09 4.19 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.59 0.00 0.00 0.00 0.00 0.00 2.40 2.51 0.00 47 I 7.42 3.73 1.87 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 1.44 0.65 0.85 0.00 0.00 48 E 8.36 3.96 0.00 2.22 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 2.34 2.41 0.00 49 A 8.22 4.07 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 50 A 7.96 4.22 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 R 8.61 4.16 0.00 2.06 2.11 0.00 3.19 0.00 0.00 3.28 7.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.76 0.00 52 V 8.39 3.64 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 0.87 0.00 0.00 0.93 0.00 0.00 53 A 7.32 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 54 M 7.86 3.57 0.00 1.83 2.02 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.85 2.33 0.00 55 V 7.22 3.50 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 0.70 0.00 0.00 0.97 0.00 0.00 56 R 7.28 4.00 0.00 1.88 2.08 0.00 3.33 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.62 0.00 57 H 7.75 3.65 0.00 2.90 2.70 0.00 5.79 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 6.75 4.80 0.00 3.06 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 59 R 7.72 3.97 0.00 1.97 2.05 0.00 3.13 0.00 0.00 3.24 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 60 R 8.42 3.94 0.00 2.06 2.17 0.00 3.43 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.59 0.00 61 G 8.12 5.02 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 0.00 0.00 0.00 62 G 8.74 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 0.00 0.00 0.00 0.00 63 K 6.97 4.64 0.00 1.73 1.41 0.00 1.37 0.00 0.00 1.33 0.00 0.00 2.87 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.30 0.40 7.81 64 I 8.06 4.75 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.91 1.05 0.00 0.00 65 F 8.99 5.08 0.00 3.31 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 66 I 8.72 3.52 1.81 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 1.48 0.97 0.93 0.00 0.00 67 R 8.27 3.95 0.00 2.02 1.97 0.00 3.05 0.00 0.00 3.11 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.71 0.00 68 I 7.94 4.74 1.86 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 1.26 0.60 0.87 0.00 0.00 69 F 8.40 4.86 0.00 2.83 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 70 P 0.00 5.00 0.00 2.03 1.92 0.00 2.59 0.00 0.00 4.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.67 0.00 71 D 8.06 4.63 0.00 2.73 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 72 K 7.83 4.23 0.00 1.69 1.48 0.00 1.31 0.00 0.00 0.88 0.00 0.00 2.57 0.00 0.00 2.56 0.00 0.00 0.00 0.00 1.19 1.28 7.81 73 P 0.00 4.22 0.00 1.87 1.76 0.00 3.63 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 2.23 0.00 74 Y 7.93 4.81 0.00 2.86 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 75 T 8.04 4.01 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 1.15 0.00 0.00 76 K 7.91 3.97 0.00 1.37 1.49 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.16 1.29 7.81 77 K 8.48 4.01 0.00 1.82 1.69 0.00 1.74 0.00 0.00 1.80 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.43 7.81 78 P 0.00 4.16 0.00 2.01 2.14 0.00 3.64 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 2.02 2.12 0.00 79 L 6.09 4.20 0.00 1.84 1.93 0.92 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 80 E 7.41 4.70 0.00 1.87 1.12 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 2.19 2.20 0.00 81 V 8.58 3.93 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 0.82 0.00 0.00 0.93 0.00 0.00 82 R 8.27 4.60 0.00 1.79 1.85 0.00 3.39 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 83 M 7.85 4.31 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.56 0.00 84 G 8.07 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 K 8.29 4.09 0.00 1.70 1.69 0.00 1.80 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.39 7.81 86 G 8.57 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 0.00 0.00 0.00 87 K 9.00 3.70 0.00 1.66 1.84 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.11 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.40 1.50 7.81 88 G 8.95 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 9.30 4.63 0.00 2.89 2.90 0.00 0.00 6.81 7.56 0.00 0.00 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 V 6.76 3.53 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 0.76 0.00 0.00 0.91 0.00 0.00 91 E 8.80 4.70 0.00 2.11 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 2.32 2.43 0.00 92 G 7.06 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Y 8.58 4.87 0.00 2.73 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 94 V 8.57 4.97 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 0.68 0.00 0.00 0.64 0.00 0.00 95 A 8.72 4.69 1.19 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 0.00 0.00 96 V 8.65 3.89 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 0.83 0.00 0.00 0.91 0.00 0.00 97 V 8.78 4.23 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 1.03 0.00 0.00 1.04 0.00 0.00 98 K 8.36 4.78 0.00 1.80 1.91 0.00 1.74 0.00 0.00 2.15 0.00 0.00 2.94 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.55 1.47 7.81 99 P 0.00 4.61 0.00 2.08 2.28 0.00 3.90 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 2.00 1.98 0.00 100 G 9.00 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 0.00 0.00 0.00 0.00 101 R 7.61 4.04 0.00 2.04 1.84 0.00 2.99 0.00 0.00 3.04 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.60 0.00 102 V 8.23 4.82 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.98 0.00 0.00 103 M 8.86 4.17 0.00 1.62 2.22 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.53 0.00 104 F 8.30 3.84 0.00 3.46 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 0.00 105 E 8.72 4.57 0.00 2.39 2.15 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 2.37 2.61 0.00 106 V 8.06 4.86 2.15 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 1.17 0.00 0.00 1.10 0.00 0.00 107 A 7.73 5.21 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 0.00 108 G 10.21 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 0.00 109 V 7.34 4.29 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 0.61 0.00 0.00 0.42 0.00 0.00 110 T 8.40 3.90 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 1.19 0.00 0.00 111 E 9.09 3.54 0.00 1.36 2.36 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 2.36 2.30 0.00 112 E 8.34 3.85 0.00 1.98 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 2.39 2.37 0.00 113 Q 8.69 4.00 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.66 0.00 0.00 0.00 0.00 0.00 2.51 2.69 0.00 114 A 8.00 4.05 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 0.00 115 M 8.34 3.79 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 116 E 8.05 4.01 0.00 2.17 2.15 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 2.40 2.61 0.00 117 A 7.81 3.93 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 0.00 118 L 7.86 3.89 0.00 1.58 1.70 1.05 1.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.60 3.89 0.00 1.98 2.01 0.00 3.13 0.00 0.00 3.16 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 120 I 7.23 3.62 1.95 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 1.63 0.66 0.86 0.00 0.00 121 A 7.71 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 7.84 3.46 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 0.00 0.00 0.00 123 H 7.99 4.48 0.00 3.28 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 0.00 124 K 7.71 4.30 0.00 1.92 1.86 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.61 1.56 7.81 125 L 7.53 4.69 0.00 1.80 1.62 1.14 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.55 0.00 2.16 2.16 0.00 3.75 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.17 0.00 127 I 7.22 4.73 1.89 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 1.23 0.70 1.07 0.00 0.00 128 K 8.42 4.52 0.00 1.82 1.72 0.00 1.66 0.00 0.00 1.87 0.00 0.00 2.91 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.80 7.81 129 T 8.07 4.75 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 0.00 130 K 8.39 4.90 0.00 1.80 1.77 0.00 1.83 0.00 0.00 1.73 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.20 1.27 7.81 131 I 7.96 3.88 1.89 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 1.24 0.64 0.97 0.00 0.00 132 V 8.68 4.10 2.15 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 1.00 0.00 0.00 1.03 0.00 0.00 133 R 8.65 4.18 0.00 1.94 1.90 0.00 3.37 0.00 0.00 3.12 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.63 0.00 134 R 7.46 3.51 0.00 1.84 1.89 0.00 3.39 0.00 0.00 3.07 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.32 0.00 135 D 8.21 4.34 0.00 2.92 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 0.00 136 A 8.45 4.36 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 0.00 137 Y 7.91 3.79 0.00 2.97 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 0.00 138 D 7.68 4.22 0.00 2.90 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 0.00 139 E 9.24 3.99 0.00 2.04 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 2.44 2.38 0.00 140 A 8.97 4.31 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 0.00 141 Q 8.18 4.37 0.00 2.14 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.60 0.00 0.00 0.00 0.00 0.00 2.13 2.03 0.00