NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.7501 8.3501 109.7348 44.2784 0.0000 174.2224 2 A 3.9717 7.7312 127.2406 52.6335 16.8088 176.8228 3 L 4.4522 7.6501 115.0481 56.0850 39.3513 172.7057 4 T 4.2507 8.9331 112.9750 60.8973 71.2317 175.5119 5 E 3.9251 8.6145 121.8391 59.2116 29.5100 178.9092 6 S 4.2368 7.9958 113.9957 61.1199 63.3760 176.3331 7 Q 3.9674 8.2136 121.7320 58.7418 28.4194 178.4346 8 A 3.9821 8.2629 121.7255 54.8755 18.2863 179.5753 9 A 4.0279 7.7595 119.0138 55.1230 18.5379 179.8828 10 L 3.9936 7.6918 117.5164 58.0433 41.7099 179.8882 11 V 3.7872 7.7654 119.5662 65.1861 31.3625 178.0648 12 K 4.2315 8.2078 119.6106 59.5123 32.1476 178.7627 13 S 4.1922 8.0595 113.4114 61.5740 62.1598 176.3931 14 S 4.3780 8.3034 116.4339 61.1207 62.7701 176.1704 15 W 4.4629 9.1655 132.6901 60.1863 30.1246 177.9870 16 E 3.3593 8.1977 118.1265 59.2096 28.6793 178.5914 17 E 4.0093 8.1202 118.5587 59.3027 29.4045 179.2417 18 F 3.8885 8.1115 120.5732 61.2973 39.2445 176.5763 19 N 4.0423 7.4333 113.8058 55.2298 38.7276 176.0102 20 A 4.0123 7.0919 121.0413 53.9691 19.8991 177.2961 21 N 4.6986 7.7957 115.9660 50.7538 39.9940 174.3943 22 I 3.2597 7.5886 125.3366 64.3507 37.6307 176.3916 23 P 4.1785 0.0000 0.0000 65.0819 31.1361 178.6728 24 K 3.9115 7.6498 118.2160 59.9612 32.2980 178.6139 25 H 4.2825 8.0738 117.0195 58.8280 28.5165 178.0462 26 T 4.2110 8.0559 112.1048 65.0548 68.7254 176.2907 27 H 4.4471 8.1932 121.2060 58.6060 29.8724 177.2921 28 R 3.8464 8.1856 120.8142 59.3078 29.9728 177.8672 29 F 4.1350 8.6831 120.9036 61.7846 39.4340 177.1520 30 F 3.8446 8.0400 116.7629 60.4949 38.6128 177.8667 31 I 3.6785 7.7897 119.4593 64.3629 37.0523 178.5144 32 L 3.9569 7.9174 119.7657 57.2358 41.2639 179.6223 33 V 3.3851 7.4490 118.5656 66.1362 31.2760 178.2108 34 L 4.2055 7.5750 116.6817 57.3734 41.4779 179.0076 35 E 4.1264 8.0566 118.3985 59.1800 29.4709 178.8656 36 I 4.1450 7.5096 118.6088 63.0112 38.3749 176.5040 37 A 4.5803 8.2796 123.7224 48.7879 20.1879 174.1005 38 P 4.2553 0.0000 0.0000 66.1206 31.5752 177.8220 39 A 4.0992 8.0808 118.2874 54.6033 18.4313 178.8536 40 A 4.2348 8.1212 119.0708 54.2001 18.3481 179.4763 41 K 4.0558 8.0602 118.8100 59.4720 32.0868 178.4362 42 D 4.4646 7.6067 116.7269 56.9346 40.7163 178.3831 43 L 4.0674 7.6952 118.7217 55.3799 41.7962 176.8143 44 F 4.3266 7.5419 118.9101 55.1060 39.7974 176.5633 45 S 4.0664 8.4648 121.5874 61.2415 62.6591 176.0103 46 F 4.5040 7.4832 112.8708 57.4151 38.5969 175.7151 47 L 4.4331 8.1089 121.9604 55.8156 42.8644 176.9572 48 K 4.0002 7.0741 115.3666 58.3925 32.1464 176.6488 49 G 4.0068 9.0411 112.7746 45.5793 0.0000 173.4703 50 T 4.2710 7.2510 109.0268 61.3828 70.0279 173.8102 51 S 4.5102 8.6278 113.7240 59.3876 63.9266 173.6479 52 E 4.6316 7.7096 117.0083 54.0102 31.4876 175.7967 53 V 3.6865 8.1999 121.4410 61.8955 31.7643 174.2149 54 P 4.3295 0.0000 0.0000 63.7180 31.2960 176.0141 55 Q 4.3583 8.5493 118.3611 56.7381 30.3673 175.5630 56 N 5.1174 7.7578 113.6203 51.5589 39.4476 174.5684 57 N 4.8150 7.6700 116.9587 51.3479 41.5193 172.3408 58 P 4.3262 0.0000 0.0000 65.3716 31.6464 178.5290 59 E 3.8467 8.0456 118.6025 59.1828 29.4925 178.4143 60 L 2.6468 7.3946 120.2392 58.0042 41.9749 179.1726 61 Q 4.0197 7.9247 117.5684 58.8072 28.3022 178.5759 62 A 4.0391 7.9839 121.8831 55.4760 18.5578 178.6946 63 H 4.1721 8.4472 116.4991 59.8496 29.8536 177.1407 64 A 4.2792 8.8720 122.4675 55.2832 18.4017 179.8642 65 G 3.8743 8.5588 104.3249 47.9686 0.0000 176.1705 66 K 4.1681 8.0606 120.5736 59.1094 32.1689 179.2749 67 V 3.5925 7.7804 118.2183 66.5074 31.3911 178.2456 68 F 4.1346 8.3670 116.7056 60.0533 38.6837 177.8098 69 K 3.9571 8.4028 119.3217 59.3511 32.1342 178.9297 70 L 3.9103 7.8527 119.2422 57.7410 41.6297 179.4642 71 V 3.5602 7.6723 117.7488 66.2659 31.3333 177.5124 72 Y 3.6748 8.0134 119.1461 60.5304 38.5920 177.6398 73 E 3.0525 7.6624 119.2421 58.6987 29.3343 179.0603 74 A 3.7847 7.5450 120.4288 55.1634 18.5055 179.5816 75 A 3.7255 7.4260 118.5868 55.1431 18.2364 179.9761 76 I 3.5865 7.1163 118.1347 64.2987 37.1929 178.3048 77 Q 3.8234 7.8503 120.4314 59.0894 28.8092 178.3528 78 L 3.9986 7.9530 120.3199 57.6609 41.3703 179.0550 79 E 4.0654 7.8194 118.3613 58.8110 29.6327 178.7814 80 V 3.6792 7.9200 118.2466 65.8519 31.7856 177.2362 81 T 4.3268 7.9163 107.1928 61.5914 69.9582 175.6667 82 G 3.9469 8.6566 108.5091 44.7727 0.0000 172.7303 83 V 4.3736 7.1924 110.6907 59.4645 35.5704 174.8079 84 V 3.9827 7.9576 120.4067 61.0742 31.7283 175.3766 85 V 3.6259 8.1360 128.1367 62.7513 31.6405 175.4370 86 T 4.1319 8.4430 125.2127 63.1240 68.6629 173.3242 87 D 5.1190 8.1556 127.8545 51.1916 42.4507 176.0863 88 A 4.0158 8.5388 118.9914 56.0756 18.0951 180.0409 89 T 3.8497 7.8125 113.8338 66.8199 68.7344 176.7827 90 L 4.0522 7.8248 120.8158 57.4729 41.4841 179.6336 91 K 4.1377 8.0408 118.7557 59.4664 32.0046 178.8183 92 N 4.3969 8.4710 117.2121 56.1504 38.7048 177.0356 93 L 4.1884 8.4040 121.4098 57.7369 41.8416 179.5867 94 G 3.6881 8.0138 105.3572 47.6767 0.0000 175.6831 95 S 4.1344 7.8137 115.7950 61.3001 62.3596 176.7464 96 V 3.6766 7.8993 121.7571 65.0888 31.0094 178.0624 97 H 4.1150 8.0550 117.0606 58.5897 28.4626 177.8498 98 V 3.6300 7.7892 119.7180 66.2127 31.1496 178.1945 99 S 4.1247 7.9855 113.7349 61.1187 62.7006 175.8845 100 K 4.3660 7.5889 118.5772 55.7008 31.9921 177.1696 101 G 3.8083 8.0232 107.5107 46.0062 0.0000 173.7739 102 V 3.8182 7.7819 119.1450 61.7114 32.3090 175.2891 103 A 4.9409 8.7072 128.6111 49.8927 22.2196 176.4771 104 D 4.6596 8.8993 118.5561 57.8361 40.8475 179.0350 105 A 4.4099 7.9309 118.8905 53.7780 19.1136 178.5016 106 H 4.4471 8.3263 114.1345 58.5667 28.5682 177.5661 107 F 4.2964 8.3961 119.4284 60.3042 38.7189 175.9051 108 P 4.3592 0.0000 0.0000 64.9398 31.0800 178.7695 109 V 3.5163 7.6667 117.2895 66.1762 31.4744 178.3513 110 V 3.6711 7.7268 117.2932 65.3420 31.3250 177.8740 111 K 2.7389 8.0327 119.8572 59.2110 32.0598 178.6550 112 E 3.8641 8.0234 118.6215 59.3713 29.3258 179.3215 113 A 4.1415 7.7939 120.4747 55.0179 18.2986 179.7563 114 I 3.9098 7.9300 118.7894 64.2146 37.1274 178.6479 115 L 3.8971 8.1086 120.2747 57.7142 41.5375 179.6572 116 K 3.9369 8.5140 118.8421 59.5381 31.9209 179.5767 117 T 3.8972 7.9369 116.0052 66.9583 68.4786 176.9194 118 I 3.7635 8.3528 121.8014 63.8351 36.8007 178.4414 119 K 4.0014 8.1853 120.9545 59.1484 31.7031 178.8536 120 E 3.9123 7.8995 118.4186 59.2300 29.5094 178.9900 121 V 3.6507 7.9048 117.5669 65.7786 31.6015 177.7922 122 V 4.3364 7.7800 112.2941 59.2106 32.3750 177.7934 123 G 3.8564 8.3988 107.4377 46.5706 0.0000 176.7800 124 A 4.2714 8.7940 127.4339 53.6590 18.1998 178.6776 125 K 4.2914 7.6835 113.9849 56.7460 32.4497 177.4031 126 W 4.3081 8.0301 130.3900 57.3810 31.3785 175.5096 127 S 4.5410 7.2686 118.3033 55.5399 67.0612 175.0227 128 E 3.4960 8.2859 121.4219 59.4821 29.2437 179.0378 129 E 3.8974 7.9906 120.0837 58.5238 29.5199 178.6062 130 L 3.9814 7.5266 120.2266 57.9712 42.1920 178.3364 131 N 4.4827 7.5708 117.2978 56.5620 38.6645 177.0551 132 S 4.1034 8.2212 115.6523 61.3915 63.1896 176.2888 133 A 4.0405 7.9331 124.7068 54.7208 18.1500 179.7046 134 W 4.0814 8.5228 117.1677 59.7455 29.1233 179.1653 135 T 4.0740 8.1674 116.2142 66.5630 67.9290 176.7337 136 I 3.7002 7.9191 121.4480 64.5203 37.1447 178.3243 137 A 3.9294 8.0558 121.4451 55.2031 18.1108 179.1705 138 Y 3.8899 8.3337 117.9681 60.9458 38.9458 177.4529 139 D 4.5025 8.3827 119.8318 57.6560 41.0680 178.8233 140 E 3.9072 8.2426 118.7954 59.3542 29.4677 179.2689 141 L 3.8500 8.0490 120.2749 58.0262 42.1132 178.9001 142 A 3.7160 8.1056 121.0744 54.7571 17.8277 179.6387 143 I 3.4824 7.3619 118.2314 64.5035 37.2220 178.8009 144 V 3.5249 7.1168 118.2526 65.9585 31.3289 178.2569 145 I 3.7056 7.6174 119.6164 64.2903 36.8269 178.6057 146 K 3.7321 7.7933 119.3467 58.8743 31.7963 179.3842 147 K 3.8552 7.4669 119.7450 59.6632 32.2222 178.8472 148 E 4.0759 7.9630 118.1590 59.1470 29.1448 179.2973 149 M 4.1269 8.2071 119.4406 58.3149 31.8554 178.3029 150 D 4.3780 7.6455 118.1564 57.5843 41.0905 178.4285 151 D 4.4585 7.8786 117.4552 56.7670 40.8637 177.8995 152 A 4.2846 7.7061 119.2677 53.0112 18.9810 177.0503 153 A 4.1551 7.5651 125.1866 52.3086 18.6804 177.2128 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 G 8.35 3.75 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 0.00 0.00 0.00 2 A 7.73 3.97 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 3 L 7.65 4.45 0.00 1.65 1.97 0.84 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 4 T 8.93 4.25 4.22 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 1.29 0.00 0.00 5 E 8.61 3.93 0.00 2.04 1.98 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 2.37 2.36 0.00 6 S 8.00 4.24 0.00 4.08 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 8.21 3.97 0.00 2.30 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.84 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 8 A 8.26 3.98 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 9 A 7.76 4.03 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 L 7.69 3.99 0.00 1.90 1.78 0.90 1.25 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 11 V 7.77 3.79 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 0.66 0.00 0.00 0.54 0.00 0.00 12 K 8.21 4.23 0.00 2.12 1.93 0.00 1.88 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.60 1.75 7.81 13 S 8.06 4.19 0.00 4.06 4.07 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 14 S 8.30 4.38 0.00 4.49 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 0.00 15 W 9.17 4.46 0.00 3.65 2.95 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 16 E 8.20 3.36 0.00 2.15 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.69 0.00 17 E 8.12 4.01 0.00 2.26 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 2.34 2.56 0.00 18 F 8.11 3.89 0.00 2.88 2.86 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 19 N 7.43 4.04 0.00 1.50 2.22 0.00 0.00 7.28 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 A 7.09 4.01 1.24 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 21 N 7.80 4.70 0.00 2.44 2.03 0.00 0.00 7.01 7.82 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 22 I 7.59 3.26 1.73 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.64 0.86 0.00 0.00 23 P 0.00 4.18 0.00 2.06 2.16 0.00 3.44 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.06 0.00 24 K 7.65 3.91 0.00 1.67 1.64 0.00 1.65 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.45 7.81 25 H 8.07 4.28 0.00 2.14 2.84 0.00 5.67 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 26 T 8.06 4.21 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 27 H 8.19 4.45 0.00 3.30 3.50 0.00 5.78 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 28 R 8.19 3.85 0.00 2.15 2.19 0.00 3.23 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 29 F 8.68 4.14 0.00 3.51 3.51 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.04 3.84 0.00 3.19 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 31 I 7.79 3.68 1.99 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 1.56 0.82 0.90 0.00 0.00 32 L 7.92 3.96 0.00 1.71 1.61 0.98 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.45 3.39 1.59 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 1.11 0.00 0.00 0.14 0.00 0.00 34 L 7.58 4.21 0.00 1.74 1.71 1.00 0.99 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 35 E 8.06 4.13 0.00 2.05 1.98 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 2.32 2.64 0.00 36 I 7.51 4.15 1.94 0.00 0.00 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 1.42 0.49 0.90 0.00 0.00 37 A 8.28 4.58 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 38 P 0.00 4.26 0.00 2.17 2.15 0.00 3.61 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.18 0.00 39 A 8.08 4.10 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 40 A 8.12 4.23 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.06 4.06 0.00 1.91 1.90 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.49 7.81 42 D 7.61 4.46 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 43 L 7.70 4.07 0.00 1.19 1.10 0.60 0.64 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 44 F 7.54 4.33 0.00 2.57 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 S 8.46 4.07 0.00 4.01 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 F 7.48 4.50 0.00 3.02 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 47 L 8.11 4.43 0.00 1.88 1.70 0.55 0.66 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 48 K 7.07 4.00 0.00 1.92 1.77 0.00 1.63 0.00 0.00 1.80 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.55 7.81 49 G 9.04 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 T 7.25 4.27 4.36 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 1.28 0.00 0.00 51 S 8.63 4.51 0.00 3.82 3.88 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 52 E 7.71 4.63 0.00 1.99 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 53 V 8.20 3.69 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 0.80 0.00 0.00 0.91 0.00 0.00 54 P 0.00 4.33 0.00 2.20 2.07 0.00 3.82 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 2.00 2.06 0.00 55 Q 8.55 4.36 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.50 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 56 N 7.76 5.12 0.00 2.59 2.68 0.00 0.00 6.73 8.00 0.00 0.00 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 N 7.67 4.82 0.00 2.67 2.50 0.00 0.00 6.81 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 58 P 0.00 4.33 0.00 2.28 2.26 0.00 3.71 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 59 E 8.05 3.85 0.00 2.21 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 60 L 7.39 2.65 0.00 0.68 1.47 0.70 1.01 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 61 Q 7.92 4.02 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.46 0.00 62 A 7.98 4.04 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 H 8.45 4.17 0.00 3.54 3.65 0.00 5.80 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 64 A 8.87 4.28 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.56 3.87 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 0.00 0.00 0.00 66 K 8.06 4.17 0.00 2.07 1.95 0.00 1.77 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.55 1.67 7.81 67 V 7.78 3.59 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 0.74 0.00 0.00 1.03 0.00 0.00 68 F 8.37 4.13 0.00 2.94 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 69 K 8.40 3.96 0.00 2.32 1.94 0.00 1.73 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.37 1.61 7.81 70 L 7.85 3.91 0.00 1.88 1.67 0.98 1.21 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 71 V 7.67 3.56 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 1.28 0.00 0.00 0.97 0.00 0.00 72 Y 8.01 3.67 0.00 2.85 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 73 E 7.66 3.05 0.00 1.94 1.68 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 1.91 2.19 0.00 74 A 7.54 3.78 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 75 A 7.43 3.73 1.03 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 76 I 7.12 3.59 1.62 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 1.01 0.44 0.77 0.00 0.00 77 Q 7.85 3.82 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 78 L 7.95 4.00 0.00 1.80 1.62 0.86 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 79 E 7.82 4.07 0.00 1.93 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 2.39 2.61 0.00 80 V 7.92 3.68 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 0.87 0.00 0.00 0.92 0.00 0.00 81 T 7.92 4.33 4.19 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 1.15 0.00 0.00 82 G 8.66 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 0.00 0.00 0.00 83 V 7.19 4.37 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 0.66 0.00 0.00 0.88 0.00 0.00 84 V 7.96 3.98 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 0.68 0.00 0.00 0.83 0.00 0.00 85 V 8.14 3.63 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.90 0.00 0.00 86 T 8.44 4.13 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 87 D 8.16 5.12 0.00 2.76 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 88 A 8.54 4.02 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 89 T 7.81 3.85 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 1.23 0.00 0.00 90 L 7.82 4.05 0.00 1.65 1.69 0.91 0.60 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 91 K 8.04 4.14 0.00 2.01 1.86 0.00 1.65 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.63 1.71 7.81 92 N 8.47 4.40 0.00 2.85 2.83 0.00 0.00 7.21 6.20 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 93 L 8.40 4.19 0.00 1.95 1.84 0.98 0.92 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 94 G 8.01 3.69 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 0.00 0.00 0.00 95 S 7.81 4.13 0.00 3.88 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 0.00 96 V 7.90 3.68 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 0.93 0.00 0.00 0.89 0.00 0.00 97 H 8.06 4.12 0.00 3.42 3.47 0.00 5.82 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.79 3.63 2.29 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 1.13 0.00 0.00 1.07 0.00 0.00 99 S 7.99 4.12 0.00 4.01 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 0.00 100 K 7.59 4.37 0.00 1.74 1.65 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.49 7.81 101 G 8.02 3.81 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 0.00 0.00 0.00 102 V 7.78 3.82 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 0.75 0.00 0.00 0.81 0.00 0.00 103 A 8.71 4.94 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 0.00 104 D 8.90 4.66 0.00 2.81 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 0.00 105 A 7.93 4.41 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 0.00 106 H 8.33 4.45 0.00 3.33 3.22 0.00 5.65 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 F 8.40 4.30 0.00 3.35 3.41 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 0.00 108 P 0.00 4.36 0.00 2.20 2.15 0.00 3.94 0.00 0.00 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.24 0.00 109 V 7.67 3.52 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 0.99 0.00 0.00 0.97 0.00 0.00 110 V 7.73 3.67 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 1.34 0.00 0.00 0.99 0.00 0.00 111 K 8.03 2.74 0.00 1.28 1.74 0.00 1.78 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.27 1.10 7.81 112 E 8.02 3.86 0.00 1.99 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.45 0.00 113 A 7.79 4.14 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 0.00 114 I 7.93 3.91 1.72 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.92 0.61 0.00 0.00 115 L 8.11 3.90 0.00 1.66 1.76 0.97 1.30 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 0.00 116 K 8.51 3.94 0.00 1.77 1.81 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.59 7.81 117 T 7.94 3.90 4.65 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 1.37 0.00 0.00 118 I 8.35 3.76 1.51 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 -0.36 0.68 0.00 0.00 119 K 8.19 4.00 0.00 1.75 1.76 0.00 1.22 0.00 0.00 0.87 0.00 0.00 2.13 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.00 0.35 7.81 120 E 7.90 3.91 0.00 2.07 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 2.29 2.49 0.00 121 V 7.90 3.65 1.88 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 0.82 0.00 0.00 0.69 0.00 0.00 122 V 7.78 4.34 2.21 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 1.17 0.00 0.00 1.23 0.00 0.00 123 G 8.40 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 0.00 124 A 8.79 4.27 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 0.00 125 K 7.68 4.29 0.00 1.96 1.93 0.00 1.76 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.52 1.43 7.81 126 W 8.03 4.31 0.00 3.49 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 0.00 127 S 7.27 4.54 0.00 3.88 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 0.00 128 E 8.29 3.50 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 2.38 2.32 0.00 129 E 7.99 3.90 0.00 2.01 1.88 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 2.35 2.26 0.00 130 L 7.53 3.98 0.00 1.73 1.48 1.20 0.67 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 0.00 131 N 7.57 4.48 0.00 2.60 2.77 0.00 0.00 6.99 7.61 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 0.00 132 S 8.22 4.10 0.00 4.08 4.16 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 0.00 133 A 7.93 4.04 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 0.00 134 W 8.52 4.08 0.00 3.52 3.42 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 0.00 135 T 8.17 4.07 4.54 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 1.34 0.00 0.00 136 I 7.92 3.70 1.97 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 1.46 1.05 0.88 0.00 0.00 137 A 8.06 3.93 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 0.00 138 Y 8.33 3.89 0.00 3.18 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 0.00 139 D 8.38 4.50 0.00 3.08 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 0.00 140 E 8.24 3.91 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.42 0.00 141 L 8.05 3.85 0.00 1.68 1.54 0.82 1.12 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 0.00 142 A 8.11 3.72 0.96 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 0.00 0.00 143 I 7.36 3.48 1.96 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 1.34 0.99 0.84 0.00 0.00 144 V 7.12 3.52 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 0.96 0.00 0.00 0.92 0.00 0.00 145 I 7.62 3.71 1.75 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 1.51 0.49 0.99 0.00 0.00 146 K 7.79 3.73 0.00 1.64 1.60 0.00 0.68 0.00 0.00 0.73 0.00 0.00 2.64 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.21 0.21 7.81 147 K 7.47 3.86 0.00 1.91 1.94 0.00 1.59 0.00 0.00 1.59 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.43 7.81 148 E 7.96 4.08 0.00 2.17 1.98 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 2.56 2.47 0.00 149 M 8.21 4.13 0.00 2.12 2.29 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.83 0.00 150 D 7.65 4.38 0.00 2.71 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 0.00 151 D 7.88 4.46 0.00 2.78 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 0.00 152 A 7.71 4.28 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 0.00 153 A 7.57 4.16 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