NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.6796 8.2649 122.4697 52.2469 20.0391 175.9524 2 T 4.6388 8.8861 118.1509 61.3717 73.3793 171.4692 3 K 5.3515 9.0070 123.9917 54.8908 37.1582 174.6344 4 A 5.3546 8.9630 123.2371 50.8018 23.3175 175.2877 5 V 4.9760 8.7954 117.4976 60.5344 35.6108 173.8536 6 C 4.9582 9.3030 122.1595 57.9487 35.3291 172.6316 7 V 4.7115 8.4639 125.9417 61.4027 33.1396 174.1029 8 L 4.7378 8.7314 129.3474 53.8788 43.1435 176.3014 9 K 4.8389 9.0172 122.2885 55.2326 36.9774 176.3044 10 G 4.4201 8.0680 109.1205 44.5261 0.0000 171.8271 11 D 4.6926 8.8432 118.1284 54.7252 42.3402 177.3475 12 G 4.2971 7.5912 109.2121 44.7254 0.0000 172.3265 13 P 4.3680 0.0000 0.0000 64.0779 32.1494 176.0381 14 V 4.3801 7.5683 120.1960 62.8125 31.9239 174.8793 15 Q 4.7742 8.9040 128.5396 54.8972 33.0621 173.4188 16 G 4.2761 8.2826 110.0282 45.9922 0.0000 172.0987 17 I 5.0882 8.4102 120.5234 59.3696 40.7990 174.8585 18 I 4.6375 8.9247 128.0599 59.4349 40.1812 174.2655 19 N 4.9581 8.5684 125.1778 51.3344 40.9404 173.9291 20 F 5.3400 8.9121 121.0894 55.7178 42.7553 174.0019 21 E 5.3187 9.6550 123.1747 54.6870 33.5862 173.7012 22 Q 4.8059 9.0351 127.1815 54.3469 31.4613 175.8865 23 K 4.1108 9.0429 128.0502 58.6543 33.0065 176.2224 24 E 4.7623 7.7905 117.9210 54.0731 32.6354 175.4301 25 S 4.2183 8.8574 119.2009 61.0399 62.7929 174.8826 26 N 4.7790 8.1756 115.2455 52.5868 38.9638 174.8353 27 G 3.9110 8.1100 108.7389 44.0817 0.0000 171.7671 28 P 4.5846 0.0000 0.0000 62.8067 32.2469 176.2217 29 V 4.5883 9.1536 122.7428 61.2289 33.8375 174.3465 30 K 4.8281 9.4723 130.0707 55.5226 33.8205 175.1371 31 V 4.7160 9.0111 128.4337 60.8408 33.6950 174.2596 32 W 5.5284 8.5563 124.4660 54.7943 31.9533 175.5255 33 G 3.7946 7.4582 106.6114 46.3667 0.0000 170.8453 34 S 5.0983 7.8104 114.1749 56.8559 66.6166 174.3647 35 I 5.0217 8.6945 126.5401 59.3453 40.6141 174.7375 36 K 4.8356 9.4623 125.4547 55.4041 36.3401 176.7892 37 G 3.9764 8.7196 104.8246 46.8395 0.0000 173.2524 38 L 4.5091 7.4798 119.1733 52.8476 43.1263 176.3616 39 T 4.2849 8.2232 112.1337 60.9466 69.5673 174.0446 40 E 4.0656 8.7833 125.2654 57.5464 30.3758 175.1118 41 G 3.7748 8.3544 110.9966 44.0063 0.0000 171.9990 42 L 4.8630 8.2533 119.4507 54.5981 42.9454 176.4570 43 H 5.0349 9.4218 120.1680 53.5417 32.8605 173.2303 44 G 4.1229 9.1799 111.1164 47.0629 0.0000 172.2755 45 F 5.6243 9.2912 126.2826 56.8966 42.6705 173.3716 46 R 4.5343 8.5055 121.3972 55.3060 33.7402 173.6501 47 V 4.6053 8.4325 119.8974 61.4941 33.2907 174.9721 48 Q 4.6610 9.2484 127.5228 55.1351 29.9554 176.4863 49 E 3.6891 8.9426 124.2285 58.8765 29.9250 177.3158 50 F 4.8907 7.9800 116.8011 55.8568 41.1592 176.1955 51 G 4.1965 8.3901 112.5474 44.5073 0.0000 174.3585 52 D 4.8354 7.9431 117.6520 52.6763 42.8937 174.5651 53 N 5.4689 8.6711 124.5414 52.1638 39.7492 177.1414 54 T 3.8698 8.3798 111.5727 63.9690 68.8883 174.7958 55 A 4.6424 8.0720 124.8253 51.4265 19.9361 177.4720 56 G 3.8521 7.8046 110.3846 46.5567 0.0000 174.4320 57 C 4.4055 8.6192 114.6030 59.8374 39.7193 176.0283 58 T 3.8420 8.0971 116.7616 66.8160 67.7918 176.3250 59 S 4.2327 8.1438 114.8219 61.1342 63.0333 175.9864 60 A 4.4002 7.9936 123.1288 54.6463 18.2795 178.5246 61 G 3.9640 8.3753 105.7206 44.2840 0.0000 171.3628 62 P 4.5610 0.0000 0.0000 62.5158 32.9745 175.6423 63 H 4.6830 8.5439 117.2805 55.8835 29.5857 175.3192 64 F 4.2242 9.1385 125.1810 58.4956 40.0638 175.1324 65 N 5.1028 7.9426 125.1201 51.9236 39.1220 172.8671 66 P 4.2512 0.0000 0.0000 64.5539 32.2421 177.8682 67 L 4.3133 7.6420 117.4592 53.7657 42.2496 176.2536 68 S 3.6058 7.3707 113.8855 59.9349 60.5589 171.0806 69 R 4.5688 8.3436 117.9586 54.3162 32.9743 176.3909 70 K 4.4700 8.5540 117.9832 55.6785 33.8160 176.5452 71 H 4.0781 8.7390 123.2532 56.8950 30.5034 174.5365 72 G 4.2630 7.4430 110.1590 45.8204 0.0000 172.6130 73 G 3.9617 8.8981 109.2449 44.2690 0.0000 173.2729 74 P 4.3953 0.0000 0.0000 64.6953 31.3728 177.2955 75 K 4.4042 7.8644 115.9114 56.4839 33.0965 175.9751 76 D 4.6212 7.6687 120.6072 53.9257 41.3521 176.6710 77 E 4.0033 8.7324 120.5497 57.9088 29.8310 176.3794 78 E 4.5028 7.9921 120.0864 54.7796 30.2688 174.8267 79 R 4.7789 7.7698 118.1474 54.9199 32.5738 174.5881 80 H 4.5547 8.9486 116.6058 55.5291 29.3896 176.6793 81 V 3.4574 8.4385 123.3338 66.4906 31.3910 177.2326 82 G 3.8493 8.5340 105.4397 47.5133 0.0000 173.2184 83 D 4.8939 8.1907 121.3405 53.6049 40.6164 175.8101 84 L 4.6301 8.0911 122.6956 53.2294 42.7452 178.8845 85 G 3.8877 8.4609 109.4309 47.0253 0.0000 174.3475 86 N 5.6536 8.7487 120.9171 51.3960 41.6181 173.7702 87 V 4.2158 8.5676 115.8341 60.3484 34.5453 175.0492 88 T 5.0261 8.2262 119.2528 61.8596 70.9352 173.1277 89 A 4.7673 9.2461 129.8920 51.0253 20.6404 177.4931 90 D 4.6354 8.7325 122.5069 52.3967 41.4827 177.0353 91 K 4.0448 8.5410 117.1903 59.6516 32.0401 177.6763 92 D 4.4887 8.2580 116.2549 54.4536 41.4979 177.1539 93 G 4.2030 8.4151 108.6530 44.1521 0.0000 172.5803 94 V 4.5692 8.1271 120.5361 61.3594 33.3066 174.6182 95 A 5.2047 8.9232 130.8840 49.7193 20.3155 175.3086 96 D 4.8070 8.5505 122.3418 54.6660 41.9447 176.4285 97 V 4.0265 8.4915 124.6189 61.7128 33.3384 175.1840 98 S 4.8413 8.5586 122.4365 57.3549 63.4694 172.2714 99 I 4.6983 9.4549 126.6877 58.9161 40.4939 173.8615 100 E 5.2171 8.7663 125.3366 54.5563 32.2438 174.5106 101 D 4.8998 9.2369 125.1982 52.9233 44.8623 175.6815 102 S 4.7486 8.9909 119.5223 58.5386 63.9500 174.7154 103 V 4.1180 7.9577 120.1411 64.3324 32.3301 176.2517 104 I 4.0607 7.7742 111.4024 61.3275 38.1972 174.6612 105 S 4.6237 8.2149 113.5320 57.7932 64.9436 174.2307 106 L 4.5449 8.5623 123.6456 54.0921 41.5717 176.1373 107 S 4.3919 7.9280 112.6308 58.5119 66.3099 175.4268 108 G 3.8560 8.4197 109.0723 44.8429 0.0000 173.4558 109 D 4.6580 8.6422 116.9345 55.1528 39.8527 176.2957 110 H 5.0195 8.0393 116.2798 55.7073 28.9740 174.2575 111 C 4.2741 7.9932 121.2378 59.8276 31.6891 173.4684 112 I 3.8697 8.2501 119.4122 60.3797 38.0657 175.6626 113 I 3.7346 7.2216 123.0452 62.8362 37.5085 176.3642 114 G 3.7950 9.3588 113.1257 45.4825 0.0000 172.9500 115 R 4.8072 7.4982 119.0920 54.8114 33.3664 174.6201 116 T 4.9634 7.9764 115.7562 62.0378 70.7634 173.9909 117 L 4.6523 8.4259 129.4317 54.2677 43.9252 175.7885 118 V 5.0750 8.6583 124.9027 59.9292 35.3324 174.3831 119 V 5.1247 8.7591 122.2425 60.5135 34.0218 174.4060 120 H 5.2401 9.1063 120.7970 53.9305 30.9721 174.2297 121 E 4.1968 9.2824 122.1485 59.2335 29.9803 176.4555 122 K 4.8069 8.5325 116.8456 53.7960 36.8391 175.3232 123 A 4.5699 8.3595 122.0701 52.2092 19.5355 176.5321 124 D 4.6803 9.5583 122.8077 54.1515 41.5053 175.8381 125 D 4.6146 9.4551 125.3363 52.9485 39.8792 176.7980 126 L 3.4873 9.4938 119.3107 56.1799 39.5816 175.7554 127 G 4.4542 8.6213 104.3816 46.1852 0.0000 174.8496 128 K 4.5727 8.1242 116.7469 55.9133 32.6038 177.4230 129 G 3.7789 8.0264 107.9188 44.8957 0.0000 175.0886 130 G 3.8621 8.5250 107.5379 46.1132 0.0000 172.6637 131 N 5.0415 7.7803 115.1398 49.7133 40.7208 174.3433 132 E 4.0643 8.7184 117.8836 59.4565 29.6151 178.3402 133 E 3.9618 8.1550 118.2031 59.1338 29.6311 178.9804 134 S 4.1260 8.3385 113.8042 61.5258 62.4310 175.9025 135 T 4.2116 7.7898 110.8917 63.0019 68.5406 176.0592 136 K 4.2556 7.7234 120.3392 57.9156 33.5471 177.0103 137 T 4.2213 8.2549 104.9336 60.1135 70.2923 174.9636 138 G 3.8477 8.0176 110.0230 44.6682 0.0000 172.9550 139 N 4.3036 7.4739 114.2991 54.2912 36.6551 174.6061 140 A 4.5988 7.4841 117.3792 50.9662 19.4097 179.9175 141 G 3.6732 7.8695 106.4086 45.5991 0.0000 173.8995 142 S 4.4911 8.3817 113.8935 58.1377 64.8130 173.8009 143 R 4.2218 8.3629 120.2714 56.1832 30.0674 176.4167 144 L 4.4497 9.1813 124.5081 56.7920 43.4240 176.6031 145 A 5.0688 7.6960 117.9708 51.2607 22.8951 173.9209 146 C 5.5699 8.4734 113.2134 55.8685 40.8577 172.6368 147 G 4.4831 8.1096 104.7694 46.2831 0.0000 172.2629 148 V 4.4737 8.2220 120.4182 62.1156 32.7768 175.4661 149 I 4.0717 8.9159 129.6604 61.1490 37.9525 175.5279 150 G 4.3772 8.9282 114.7147 43.9470 0.0000 172.2046 151 I 4.4233 8.2582 121.1160 61.1399 37.5486 175.6782 152 A 4.8149 8.3622 128.3379 49.6695 21.8656 176.3147 153 Q 4.0699 8.5237 119.1211 56.4317 29.1979 176.0987 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 A 8.26 4.68 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 2 T 8.89 4.64 4.27 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 1.22 0.00 0.00 3 K 9.01 5.35 0.00 1.71 1.71 0.00 1.80 0.00 0.00 1.93 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.50 7.81 4 A 8.96 5.35 1.16 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 0.00 0.00 5 V 8.80 4.98 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 0.84 0.00 0.00 0.88 0.00 0.00 6 C 9.30 4.96 0.00 3.12 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 7 V 8.46 4.71 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 0.94 0.00 0.00 0.93 0.00 0.00 8 L 8.73 4.74 0.00 1.63 1.60 0.97 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.02 4.84 0.00 1.66 1.62 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.38 7.81 10 G 8.07 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 0.00 0.00 0.00 11 D 8.84 4.69 0.00 2.68 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 12 G 7.59 4.30 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 13 P 0.00 4.37 0.00 2.23 2.30 0.00 3.69 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 1.94 0.00 14 V 7.57 4.38 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 0.74 0.00 0.00 0.95 0.00 0.00 15 Q 8.90 4.77 0.00 2.12 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.48 0.00 0.00 0.00 0.00 0.00 2.25 2.31 0.00 16 G 8.28 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 0.00 0.00 0.00 0.00 17 I 8.41 5.09 1.83 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 1.21 0.69 0.83 0.00 0.00 18 I 8.92 4.64 1.84 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 1.31 0.48 0.00 0.00 19 N 8.57 4.96 0.00 1.44 1.45 0.00 0.00 6.38 5.29 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 20 F 8.91 5.34 0.00 2.86 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 21 E 9.66 5.32 0.00 2.45 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 0.00 2.32 2.40 0.00 22 Q 9.04 4.81 0.00 2.22 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.59 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 23 K 9.04 4.11 0.00 1.79 1.84 0.00 1.83 0.00 0.00 1.64 0.00 0.00 2.83 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.43 1.44 7.81 24 E 7.79 4.76 0.00 1.96 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 2.28 2.25 0.00 25 S 8.86 4.22 0.00 4.02 4.02 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 26 N 8.18 4.78 0.00 2.74 2.86 0.00 0.00 6.99 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 G 8.11 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 0.00 0.00 0.00 28 P 0.00 4.58 0.00 1.99 2.04 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 29 V 9.15 4.59 2.23 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 1.26 0.00 0.00 1.06 0.00 0.00 30 K 9.47 4.83 0.00 1.95 1.94 0.00 1.56 0.00 0.00 1.42 0.00 0.00 2.44 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.56 1.43 7.81 31 V 9.01 4.72 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 0.78 0.00 0.00 1.07 0.00 0.00 32 W 8.56 5.53 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 33 G 7.46 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 34 S 7.81 5.10 0.00 3.88 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 35 I 8.69 5.02 1.81 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 1.29 0.43 0.96 0.00 0.00 36 K 9.46 4.84 0.00 1.73 1.88 0.00 1.34 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.28 1.34 7.81 37 G 8.72 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 38 L 7.48 4.51 0.00 1.87 1.41 0.81 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.22 4.28 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 1.24 0.00 0.00 40 E 8.78 4.07 0.00 1.96 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 2.31 2.58 0.00 41 G 8.35 3.77 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 0.00 42 L 8.25 4.86 0.00 1.52 1.60 0.92 0.93 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 43 H 9.42 5.03 0.00 3.01 3.36 0.00 5.63 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 44 G 9.18 4.12 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 0.00 0.00 0.00 45 F 9.29 5.62 0.00 3.05 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 46 R 8.51 4.53 0.00 1.93 1.90 0.00 2.99 0.00 0.00 3.09 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.25 0.00 47 V 8.43 4.61 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 0.77 0.00 0.00 0.85 0.00 0.00 48 Q 9.25 4.66 0.00 1.99 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.55 0.00 0.00 0.00 0.00 0.00 2.50 2.31 0.00 49 E 8.94 3.69 0.00 1.69 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 1.47 2.05 0.00 50 F 7.98 4.89 0.00 3.19 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 51 G 8.39 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 0.00 0.00 0.00 0.00 52 D 7.94 4.84 0.00 2.62 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 53 N 8.67 5.47 0.00 2.74 2.74 0.00 0.00 7.37 7.05 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 54 T 8.38 3.87 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 1.19 0.00 0.00 55 A 8.07 4.64 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 56 G 7.80 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 57 C 8.62 4.41 0.00 2.99 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 58 T 8.10 3.84 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 1.23 0.00 0.00 59 S 8.14 4.23 0.00 4.01 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 60 A 7.99 4.40 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.38 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.56 0.00 2.06 2.18 0.00 3.85 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.03 0.00 63 H 8.54 4.68 0.00 2.92 3.29 0.00 5.73 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 9.14 4.22 0.00 2.86 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 65 N 7.94 5.10 0.00 2.70 2.47 0.00 0.00 6.94 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 66 P 0.00 4.25 0.00 2.08 2.00 0.00 3.05 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 1.55 1.31 0.00 67 L 7.64 4.31 0.00 1.57 1.68 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 68 S 7.37 3.61 0.00 3.91 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 69 R 8.34 4.57 0.00 1.85 1.91 0.00 3.11 0.00 0.00 3.52 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.57 0.00 70 K 8.55 4.47 0.00 1.84 1.69 0.00 1.66 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.37 7.81 71 H 8.74 4.08 0.00 3.20 3.31 0.00 5.99 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 72 G 7.44 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 0.00 0.00 0.00 0.00 73 G 8.90 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 P 0.00 4.40 0.00 2.22 2.38 0.00 3.77 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 2.01 2.00 0.00 75 K 7.86 4.40 0.00 1.88 1.95 0.00 1.57 0.00 0.00 1.71 0.00 0.00 2.97 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.44 7.81 76 D 7.67 4.62 0.00 2.85 2.60 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 77 E 8.73 4.00 0.00 2.06 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 0.00 2.26 2.32 0.00 78 E 7.99 4.50 0.00 1.96 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 2.18 0.00 79 R 7.77 4.78 0.00 1.91 1.86 0.00 2.65 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 80 H 8.95 4.55 0.00 3.50 3.44 0.00 5.66 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 V 8.44 3.46 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 0.68 0.00 0.00 0.46 0.00 0.00 82 G 8.53 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 83 D 8.19 4.89 0.00 2.68 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 84 L 8.09 4.63 0.00 1.82 1.88 0.95 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 85 G 8.46 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 86 N 8.75 5.65 0.00 2.60 2.71 0.00 0.00 6.70 7.68 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 87 V 8.57 4.22 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 -0.14 0.00 0.00 0.84 0.00 0.00 88 T 8.23 5.03 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 1.21 0.00 0.00 89 A 9.25 4.77 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 90 D 8.73 4.64 0.00 2.90 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 91 K 8.54 4.04 0.00 1.77 1.92 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.51 1.66 7.81 92 D 8.26 4.49 0.00 2.81 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 G 8.42 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 0.00 0.00 0.00 0.00 94 V 8.13 4.57 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 0.99 0.00 0.00 0.92 0.00 0.00 95 A 8.92 5.20 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 96 D 8.55 4.81 0.00 2.56 2.63 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 97 V 8.49 4.03 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 0.67 0.00 0.00 0.61 0.00 0.00 98 S 8.56 4.84 0.00 3.90 3.71 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 99 I 9.45 4.70 1.97 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.69 1.02 0.00 0.00 100 E 8.77 5.22 0.00 1.97 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.31 0.00 101 D 9.24 4.90 0.00 2.87 2.52 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 0.00 102 S 8.99 4.75 0.00 3.91 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 0.00 103 V 7.96 4.12 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.95 0.00 0.00 104 I 7.77 4.06 1.95 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.82 1.05 0.00 0.00 105 S 8.21 4.62 0.00 3.89 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 0.00 106 L 8.56 4.54 0.00 1.79 1.62 1.04 0.50 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 0.00 107 S 7.93 4.39 0.00 3.92 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 0.00 108 G 8.42 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 0.00 109 D 8.64 4.66 0.00 2.86 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 0.00 110 H 8.04 5.02 0.00 3.18 3.49 0.00 5.73 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.99 4.27 0.00 3.16 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 I 8.25 3.87 1.61 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 1.34 0.25 0.99 0.00 0.00 113 I 7.22 3.73 1.76 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 1.20 0.35 0.83 0.00 0.00 114 G 9.36 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 0.00 115 R 7.50 4.81 0.00 1.60 1.78 0.00 2.21 0.00 0.00 2.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.28 0.00 116 T 7.98 4.96 4.25 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 1.24 0.00 0.00 117 L 8.43 4.65 0.00 1.83 1.54 0.54 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.66 5.08 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 0.80 0.00 0.00 0.91 0.00 0.00 119 V 8.76 5.12 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.02 0.00 0.00 120 H 9.11 5.24 0.00 3.19 3.53 0.00 5.68 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 9.28 4.20 0.00 2.09 2.05 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 2.37 2.35 0.00 122 K 8.53 4.81 0.00 1.76 1.67 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.38 7.81 123 A 8.36 4.57 1.23 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 0.00 124 D 9.56 4.68 0.00 2.71 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 0.00 125 D 9.46 4.61 0.00 2.92 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 0.00 126 L 9.49 3.49 0.00 1.88 1.85 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 127 G 8.62 4.45 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 0.00 128 K 8.12 4.57 0.00 1.87 1.78 0.00 1.70 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.48 7.81 129 G 8.03 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 0.00 130 G 8.52 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 0.00 131 N 7.78 5.04 0.00 2.76 2.77 0.00 0.00 6.19 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 0.00 132 E 8.72 4.06 0.00 2.06 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 2.40 0.00 133 E 8.15 3.96 0.00 2.05 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 2.40 2.31 0.00 134 S 8.34 4.13 0.00 4.07 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.79 4.21 4.25 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 1.27 0.00 0.00 136 K 7.72 4.26 0.00 1.84 1.85 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.06 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.60 7.81 137 T 8.25 4.22 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 1.19 0.00 0.00 138 G 8.02 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 0.00 139 N 7.47 4.30 0.00 3.01 2.91 0.00 0.00 6.83 7.09 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 0.00 140 A 7.48 4.60 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 0.00 141 G 7.87 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 0.00 142 S 8.38 4.49 0.00 3.95 4.02 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 0.00 143 R 8.36 4.22 0.00 1.68 1.83 0.00 3.19 0.00 0.00 3.33 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.62 0.00 144 L 9.18 4.45 0.00 1.72 1.70 0.94 0.49 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 0.00 145 A 7.70 5.07 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 0.00 146 C 8.47 5.57 0.00 3.07 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 0.00 147 G 8.11 4.48 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 0.00 148 V 8.22 4.47 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 0.77 0.00 0.00 0.97 0.00 0.00 149 I 8.92 4.07 1.79 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 1.03 0.26 0.43 0.00 0.00 150 G 8.93 4.38 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 0.00 151 I 8.26 4.42 1.86 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 1.25 0.54 0.91 0.00 0.00 152 A 8.36 4.81 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 Q 8.52 4.07 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.82 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.37 0.00