NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4184 8.3349 115.4135 58.0029 64.3493 172.5918 2 L 4.4662 8.1847 121.5303 51.9056 42.6798 176.3203 3 S 4.5376 9.7542 120.7012 57.5483 66.4535 174.7218 4 D 4.3327 8.5479 121.3326 57.2755 40.4102 178.9598 5 K 3.8827 8.0264 119.6367 59.6974 32.1834 178.3624 6 D 4.7471 8.0604 120.3146 56.9065 40.6831 179.0266 7 K 3.9218 8.4450 119.0877 59.3422 32.0376 179.3117 8 A 3.9458 8.2882 121.0402 55.0194 18.2769 179.5610 9 A 3.9595 8.1593 119.3992 55.2015 18.3557 180.1010 10 V 3.4204 7.9442 116.9046 66.1252 31.4907 178.3995 11 R 3.8936 8.0929 117.7385 59.3320 29.9590 178.9617 12 A 3.9659 8.4867 120.9041 54.9010 18.3710 179.5120 13 L 3.8605 8.0676 118.9310 58.1190 42.2199 179.0633 14 W 4.0639 8.5192 128.6976 60.2983 30.3400 177.6763 15 S 4.0014 8.1869 112.8100 61.4470 61.8090 176.1640 16 K 4.0160 7.5715 119.7885 58.4377 32.1109 178.4568 17 I 3.4842 7.2152 111.2349 60.6623 38.4224 177.8315 18 G 2.0000 7.1644 108.3315 46.8013 0.0000 175.7219 19 K 4.0036 7.5499 119.5693 59.1908 32.8087 178.1829 20 S 4.6226 7.7746 115.4935 58.1458 62.9364 175.3359 21 A 4.0543 7.5276 126.2813 55.7013 18.0925 180.0443 22 D 4.3512 8.1947 116.1329 57.6408 40.9045 178.9602 23 A 4.0112 7.9676 120.5084 55.1636 18.4245 179.2576 24 I 3.7752 8.4311 118.8939 64.6555 37.1870 178.8552 25 G 3.5912 8.2712 106.1641 47.9170 0.0000 175.2758 26 N 4.3181 8.2313 120.1992 56.1973 38.8915 176.3674 27 D 4.2914 8.3968 119.3844 57.3023 41.3347 178.2064 28 A 4.0047 8.4474 121.6474 55.2622 18.4838 179.6779 29 L 4.0174 8.1759 117.6112 57.8531 41.5681 179.8610 30 S 4.1656 8.3019 115.3435 61.8259 62.7216 177.0410 31 R 4.0080 8.2701 120.7665 59.2737 29.6891 178.7791 32 M 4.3036 8.3370 118.3871 58.8077 32.2046 178.3868 33 I 3.8736 8.0062 112.9237 63.4182 37.5632 178.3138 34 V 3.6600 7.4653 119.3249 65.6713 31.6461 177.6762 35 V 3.8057 8.0343 116.6576 63.9689 32.9981 175.5689 36 Y 4.8496 8.2278 116.2129 54.9038 38.0658 174.2910 37 P 4.7936 0.0000 0.0000 64.7317 31.7323 178.4143 38 Q 4.1122 8.2364 117.5637 59.0278 28.3669 178.0006 39 T 4.2629 8.3677 111.7294 63.9456 68.7863 176.3473 40 K 4.3839 8.3368 121.9877 59.0354 31.8018 178.7818 41 T 3.7073 7.4572 109.8761 65.0688 68.3797 175.3147 42 Y 3.9368 7.3587 117.4410 58.8935 38.1079 176.0730 43 F 4.3388 7.8629 119.7251 56.8196 39.5558 177.7083 44 S 4.2518 7.9942 117.6264 60.9888 62.9569 174.6746 45 H 4.5034 8.2003 115.1247 56.4502 28.9431 174.9536 46 W 4.9592 7.7541 121.0325 54.6602 30.4066 174.5292 47 P 4.5590 0.0000 0.0000 63.9407 32.1003 176.1489 48 D 4.8645 7.8799 119.8405 52.3921 39.0155 178.3965 49 V 4.2077 7.3878 121.6932 62.3992 30.8921 174.6919 50 T 4.7254 7.2690 111.8299 58.5482 72.2740 172.5555 51 P 4.3682 0.0000 0.0000 64.5804 31.6131 176.9207 52 G 3.9396 8.7973 111.7507 45.6353 0.0000 174.2670 53 S 4.3958 7.8133 115.3635 57.2066 65.3080 173.2854 54 P 4.2701 0.0000 0.0000 66.0839 31.0090 178.7835 55 H 3.6922 7.7920 115.1383 58.3915 28.3870 177.9261 56 I 3.8024 7.2620 121.5687 64.2652 37.0803 178.6545 57 K 3.9533 8.5161 119.4821 59.2936 31.3628 179.1527 58 A 3.9765 7.9128 120.9979 55.6830 18.3539 179.2723 59 H 4.5613 8.5003 116.6153 59.0871 29.9612 177.7136 60 G 3.6274 8.2352 107.9728 47.4236 0.0000 175.6639 61 K 3.9747 7.9808 120.4304 59.5856 32.1054 179.5030 62 K 4.0498 7.7253 117.4753 59.2314 31.9747 179.7060 63 V 3.5835 7.8449 118.5601 66.4541 31.5750 178.1049 64 M 4.3270 8.3329 118.0834 57.7981 31.7148 178.8676 65 G 3.9827 8.5513 106.7448 47.6490 0.0000 176.0578 66 G 3.5731 8.0680 108.0091 47.6173 0.0000 175.9670 67 I 3.5489 7.7883 122.0901 63.9995 37.1290 178.2165 68 A 3.3149 8.1450 121.9227 54.8536 18.1604 179.2397 69 L 3.8398 8.2106 118.8434 58.4249 41.9195 179.1696 70 A 3.9573 7.9148 119.5123 55.0486 18.4492 179.3772 71 V 3.5460 8.0033 117.3756 66.1849 31.3535 178.5017 72 S 4.2536 8.0063 112.3598 60.2810 62.8779 175.4647 73 K 4.5783 7.6325 121.6789 56.0365 32.7772 177.9916 74 I 3.8309 7.4715 121.8610 63.7476 38.0421 176.7133 75 D 4.5850 8.0146 118.3221 56.3282 41.2945 176.5920 76 D 4.7597 7.9854 118.2787 52.2381 42.8825 175.2410 77 L 3.9640 8.0193 124.0315 56.7711 41.7884 178.4112 78 K 3.8575 7.8919 118.6154 59.8856 32.3314 178.5340 79 T 4.1144 8.2409 116.0490 66.6247 68.1662 177.0572 80 G 3.6539 8.1613 106.5985 46.9499 0.0000 174.7694 81 L 4.6119 7.7804 119.3794 54.6264 42.0246 178.1281 82 M 4.0191 7.6797 122.0287 58.8677 32.0902 178.2209 83 E 3.9705 8.0842 118.2408 59.4328 29.7719 179.1716 84 L 4.0717 7.8692 118.5908 57.5774 41.6500 179.3171 85 S 4.3681 8.2993 115.0200 60.9161 62.3050 175.8504 86 E 3.8878 8.4931 122.3029 59.0951 29.4608 178.4024 87 Q 3.9498 8.2505 119.6601 59.8287 29.1925 178.3554 88 H 4.1824 8.4831 116.5970 58.3283 28.3168 177.7877 89 A 2.6230 7.9839 123.0893 54.5301 18.0133 178.6309 90 Y 3.9724 7.7339 116.1099 59.9232 39.4882 177.3611 91 K 3.6855 7.8596 118.5862 58.8264 32.5617 177.8140 92 L 4.2179 7.5548 116.7083 53.6938 42.8321 176.5999 93 R 3.7778 7.1696 116.1792 56.8715 28.1962 176.6888 94 V 3.2667 7.6630 117.0127 61.5167 32.2903 174.9857 95 D 4.3353 8.7005 127.5834 53.9245 41.5997 175.4058 96 P 3.3462 0.0000 0.0000 64.6050 30.7219 178.2282 97 A 3.9377 8.3850 120.5179 55.2841 18.1422 179.2050 98 N 4.2973 7.9727 114.3696 55.7790 38.4387 177.5400 99 F 4.4421 7.3388 119.8068 60.4197 38.9072 177.6851 100 K 3.9953 7.7964 117.5196 59.3440 31.8192 179.4361 101 I 3.3462 7.5090 119.5306 64.2500 37.0305 178.0849 102 L 3.9606 7.9781 121.1107 58.1845 41.8936 178.6581 103 N 4.3362 8.5091 116.8073 56.5976 38.5030 176.7131 104 H 4.1945 8.2982 119.5369 59.6186 29.8297 177.1046 105 C 4.1785 8.1509 118.4493 62.8257 27.8940 176.0406 106 I 3.7035 8.1705 121.8402 64.4635 36.5958 178.4970 107 L 3.7240 7.9475 119.7882 57.5541 41.4380 179.7103 108 V 3.5263 7.7300 118.2470 65.9170 31.5276 178.2911 109 V 3.5562 7.9827 118.1831 66.1626 31.3956 178.1010 110 I 3.7971 7.7897 119.6740 64.3224 36.6069 178.3336 111 S 4.2427 7.8286 113.7677 61.6244 62.2892 176.0968 112 T 4.0184 7.7644 111.5974 64.4308 68.6303 175.7442 113 M 4.0637 7.6191 119.7362 55.3567 34.1408 176.3479 114 F 5.0433 8.4212 117.1178 55.5123 39.7429 174.1545 115 P 4.4070 0.0000 0.0000 65.8601 31.8156 178.6628 116 K 4.2057 8.0947 117.3225 59.0449 32.2534 178.0186 117 E 4.1797 8.2784 117.3374 58.6818 30.2147 177.3044 118 F 4.7573 8.1799 123.1759 57.0654 37.8531 175.0238 119 T 4.1336 7.3264 115.6235 60.4711 71.2894 173.5124 120 P 4.0650 0.0000 0.0000 65.8476 31.0471 178.8391 121 E 3.8908 8.0803 116.5800 59.2565 29.3421 179.0068 122 A 3.9981 8.0450 120.8777 55.3282 18.3909 179.2241 123 H 4.0273 8.0418 117.2088 59.3303 29.9041 177.9092 124 V 3.6771 7.9230 121.2083 65.0156 31.2719 178.5703 125 S 4.2752 7.8651 115.7403 61.2276 62.7002 176.4079 126 L 4.1677 8.4635 123.5322 58.0081 41.7521 178.4688 127 D 4.4661 8.8160 118.6896 57.2493 41.2038 178.3204 128 K 3.9633 8.3155 119.0672 59.4028 32.0521 178.9561 129 F 4.1588 8.5183 120.9597 61.5357 39.2700 177.2869 130 L 3.8103 8.5955 118.7932 57.5769 41.2962 179.6685 131 S 4.2005 8.4624 115.8968 61.4299 62.6467 176.9227 132 G 3.4538 8.0277 108.5045 47.5778 0.0000 175.8999 133 V 3.2329 7.7000 120.8504 65.5945 31.3453 177.9538 134 A 3.5845 8.0549 120.8304 54.9648 17.9634 179.4086 135 L 3.8337 7.7863 117.7149 58.1994 42.4640 178.7641 136 A 4.0724 8.1045 120.9605 55.0582 18.2426 179.6249 137 L 3.9152 8.1068 117.5836 57.2664 41.5670 178.5760 138 A 4.3109 7.5831 118.9519 52.5309 18.3988 178.5129 139 E 3.9453 7.9013 118.5819 58.8994 29.7557 177.6061 140 R 4.4986 8.0724 114.8260 56.3490 30.5766 176.9590 141 Y 4.1522 8.3584 118.0617 60.7443 38.1691 176.0038 142 R 4.2260 7.8314 119.4911 56.6774 29.0390 174.4329 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 S 8.33 4.42 0.00 4.00 3.94 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 2 L 8.18 4.47 0.00 1.77 1.69 1.09 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.75 4.54 0.00 4.05 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 4 D 8.55 4.33 0.00 2.71 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 5 K 8.03 3.88 0.00 1.82 1.81 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.53 7.81 6 D 8.06 4.75 0.00 2.97 2.73 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 7 K 8.45 3.92 0.00 1.77 1.84 0.00 1.67 0.00 0.00 1.77 0.00 0.00 2.98 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.48 1.69 7.81 8 A 8.29 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.16 3.96 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 10 V 7.94 3.42 1.77 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 0.19 0.00 0.00 0.75 0.00 0.00 11 R 8.09 3.89 0.00 1.99 1.97 0.00 3.16 0.00 0.00 3.16 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.76 0.00 12 A 8.49 3.97 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 13 L 8.07 3.86 0.00 1.89 1.85 0.99 1.00 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 14 W 8.52 4.06 0.00 3.35 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.19 4.00 0.00 3.95 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 16 K 7.57 4.02 0.00 1.78 1.69 0.00 1.68 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.41 1.59 7.81 17 I 7.22 3.48 0.84 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 1.30 0.35 -0.11 0.00 0.00 18 G 7.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 K 7.55 4.00 0.00 1.85 1.86 0.00 1.54 0.00 0.00 1.65 0.00 0.00 3.12 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.23 1.47 7.81 20 S 7.77 4.62 0.00 4.15 4.04 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 0.00 0.00 0.00 21 A 7.53 4.05 1.56 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 22 D 8.19 4.35 0.00 2.71 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 23 A 7.97 4.01 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 24 I 8.43 3.78 2.12 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 1.58 0.81 1.01 0.00 0.00 25 G 8.27 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 26 N 8.23 4.32 0.00 2.79 2.84 0.00 0.00 6.92 7.78 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 27 D 8.40 4.29 0.00 2.90 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 28 A 8.45 4.00 1.40 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 29 L 8.18 4.02 0.00 1.73 1.74 0.93 0.85 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 30 S 8.30 4.17 0.00 4.12 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 31 R 8.27 4.01 0.00 2.05 2.07 0.00 3.15 0.00 0.00 3.12 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.86 0.00 32 M 8.34 4.30 0.00 2.33 2.13 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.67 0.00 33 I 8.01 3.87 1.93 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 1.69 0.79 0.94 0.00 0.00 34 V 7.47 3.66 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 0.82 0.00 0.00 0.98 0.00 0.00 35 V 8.03 3.81 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 0.27 0.00 0.00 0.92 0.00 0.00 36 Y 8.23 4.85 0.00 3.15 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 37 P 0.00 4.79 0.00 2.29 2.34 0.00 3.88 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.89 0.00 38 Q 8.24 4.11 0.00 2.29 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.96 0.00 0.00 0.00 0.00 0.00 2.50 2.42 0.00 39 T 8.37 4.26 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 1.37 0.00 0.00 40 K 8.34 4.38 0.00 2.00 2.00 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.11 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.57 1.67 7.81 41 T 7.46 3.71 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 1.16 0.00 0.00 42 Y 7.36 3.94 0.00 2.30 2.37 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 43 F 7.86 4.34 0.00 2.86 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 0.00 0.00 0.00 44 S 7.99 4.25 0.00 3.94 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 45 H 8.20 4.50 0.00 3.33 3.40 0.00 5.53 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 W 7.75 4.96 0.00 3.48 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 47 P 0.00 4.56 0.00 2.22 2.23 0.00 3.84 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.99 0.00 48 D 7.88 4.86 0.00 2.79 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 49 V 7.39 4.21 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 0.94 0.00 0.00 1.25 0.00 0.00 50 T 7.27 4.73 4.26 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 1.24 0.00 0.00 51 P 0.00 4.37 0.00 2.07 2.07 0.00 3.71 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 2.04 2.11 0.00 52 G 8.80 3.94 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 0.00 0.00 0.00 53 S 7.81 4.40 0.00 4.05 4.17 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 54 P 0.00 4.27 0.00 1.96 2.02 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.10 0.00 55 H 7.79 3.69 0.00 2.62 1.31 0.00 5.81 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 I 7.26 3.80 2.06 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.24 0.93 0.00 0.00 57 K 8.52 3.95 0.00 1.83 1.82 0.00 1.65 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.45 1.57 7.81 58 A 7.91 3.98 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 H 8.50 4.56 0.00 3.61 3.70 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 60 G 8.24 3.63 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 61 K 7.98 3.97 0.00 2.11 1.93 0.00 1.68 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.82 1.71 7.81 62 K 7.73 4.05 0.00 1.94 1.94 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.19 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.54 1.57 7.81 63 V 7.84 3.58 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 1.06 0.00 0.00 0.96 0.00 0.00 64 M 8.33 4.33 0.00 2.38 2.24 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.90 0.00 65 G 8.55 3.98 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 0.00 0.00 0.00 66 G 8.07 3.57 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 67 I 7.79 3.55 1.81 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.95 0.52 0.00 0.00 68 A 8.14 3.31 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 69 L 8.21 3.84 0.00 1.79 1.84 0.91 1.09 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 70 A 7.91 3.96 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 71 V 8.00 3.55 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.19 0.00 0.00 72 S 8.01 4.25 0.00 4.08 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 73 K 7.63 4.58 0.00 1.77 1.80 0.00 1.68 0.00 0.00 1.57 0.00 0.00 2.89 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.52 1.53 7.81 74 I 7.47 3.83 2.15 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 1.38 1.05 0.95 0.00 0.00 75 D 8.01 4.58 0.00 2.71 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 76 D 7.99 4.76 0.00 2.69 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 77 L 8.02 3.96 0.00 1.65 1.59 0.78 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 78 K 7.89 3.86 0.00 1.72 1.97 0.00 1.89 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.41 1.52 7.81 79 T 8.24 4.11 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 1.20 0.00 0.00 80 G 8.16 3.65 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 0.00 0.00 0.00 81 L 7.78 4.61 0.00 1.68 1.56 0.73 0.57 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 82 M 7.68 4.02 0.00 2.10 2.26 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 2.60 2.62 0.00 83 E 8.08 3.97 0.00 2.06 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 2.40 2.40 0.00 84 L 7.87 4.07 0.00 1.83 1.73 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.30 4.37 0.00 4.08 4.04 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 0.00 0.00 0.00 86 E 8.49 3.89 0.00 2.19 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 2.30 2.37 0.00 87 Q 8.25 3.95 0.00 2.23 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 88 H 8.48 4.18 0.00 3.54 3.70 0.00 5.86 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 89 A 7.98 2.62 0.80 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 90 Y 7.73 3.97 0.00 2.88 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 K 7.86 3.69 0.00 1.77 1.87 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.19 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.47 7.81 92 L 7.55 4.22 0.00 1.73 1.53 0.63 0.60 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 93 R 7.17 3.78 0.00 1.93 1.98 0.00 3.26 0.00 0.00 3.16 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.55 0.00 94 V 7.66 3.27 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 -0.08 0.00 0.00 0.43 0.00 0.00 95 D 8.70 4.34 0.00 2.78 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 96 P 0.00 3.35 0.00 1.98 1.93 0.00 3.44 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 1.59 1.08 0.00 97 A 8.38 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 98 N 7.97 4.30 0.00 2.42 2.73 0.00 0.00 6.93 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 99 F 7.34 4.44 0.00 3.06 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 K 7.80 4.00 0.00 1.84 1.84 0.00 1.65 0.00 0.00 1.63 0.00 0.00 3.00 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.46 7.81 101 I 7.51 3.35 1.80 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 1.09 0.48 -0.03 0.00 0.00 102 L 7.98 3.96 0.00 1.81 1.73 0.97 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.51 4.34 0.00 2.91 2.88 0.00 0.00 6.65 8.52 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 0.00 104 H 8.30 4.19 0.00 3.28 3.47 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 C 8.15 4.18 0.00 3.22 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 0.00 106 I 8.17 3.70 2.04 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 1.56 0.77 0.95 0.00 0.00 107 L 7.95 3.72 0.00 1.85 1.74 1.14 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.73 3.53 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.87 0.00 0.00 109 V 7.98 3.56 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.95 0.00 0.00 110 I 7.79 3.80 1.29 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.48 0.62 0.00 0.00 111 S 7.83 4.24 0.00 4.03 4.04 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 0.00 0.00 0.00 112 T 7.76 4.02 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 1.27 0.00 0.00 113 M 7.62 4.06 0.00 1.29 2.02 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.37 0.00 114 F 8.42 5.04 0.00 3.17 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 0.00 115 P 0.00 4.41 0.00 2.22 2.24 0.00 3.80 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 2.01 1.99 0.00 116 K 8.09 4.21 0.00 1.84 1.97 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.48 1.49 7.81 117 E 8.28 4.18 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 118 F 8.18 4.76 0.00 3.04 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 0.00 119 T 7.33 4.13 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 1.26 0.00 0.00 120 P 0.00 4.06 0.00 2.12 2.08 0.00 3.55 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.13 0.00 121 E 8.08 3.89 0.00 2.02 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 2.38 2.40 0.00 122 A 8.04 4.00 1.31 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 0.00 123 H 8.04 4.03 0.00 2.27 3.19 0.00 5.61 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 0.00 124 V 7.92 3.68 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 0.84 0.00 0.00 0.92 0.00 0.00 125 S 7.87 4.28 0.00 3.89 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 0.00 126 L 8.46 4.17 0.00 2.01 1.95 1.03 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 127 D 8.82 4.47 0.00 3.07 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 0.00 128 K 8.32 3.96 0.00 2.09 1.90 0.00 1.75 0.00 0.00 1.86 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.66 7.81 129 F 8.52 4.16 0.00 3.07 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.60 3.81 0.00 1.71 1.82 1.00 0.90 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 0.00 131 S 8.46 4.20 0.00 4.00 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 0.00 132 G 8.03 3.45 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 0.00 0.00 0.00 133 V 7.70 3.23 1.77 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 0.75 0.00 0.00 0.03 0.00 0.00 134 A 8.05 3.58 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 0.00 135 L 7.79 3.83 0.00 1.65 1.76 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 136 A 8.10 4.07 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 0.00 137 L 8.11 3.92 0.00 1.10 1.15 -0.07 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.58 4.31 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 0.00 139 E 7.90 3.95 0.00 2.04 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 0.00 2.34 2.43 0.00 140 R 8.07 4.50 0.00 1.86 2.05 0.00 3.39 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 141 Y 8.36 4.15 0.00 3.08 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 0.00 142 R 7.83 4.23 0.00 1.92 1.93 0.00 3.10 0.00 0.00 3.31 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00