NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 44 M 4.3223 8.3044 118.1703 54.3755 32.6381 174.9974 45 D 4.2329 8.3222 117.7557 54.6671 42.6663 176.0543 46 K 4.1159 9.3788 132.0128 59.7746 32.4974 177.1905 47 T 4.1583 7.8546 115.6170 66.9038 68.3471 176.8451 48 T 3.8979 7.8720 117.8862 66.4543 68.5325 176.3498 49 F 4.0324 7.8086 122.5534 61.6033 39.3705 177.3453 50 R 3.8172 8.1069 117.3653 59.0245 29.8613 178.8107 51 L 3.9110 8.0433 119.9905 58.2847 42.1729 179.1137 52 L 4.0478 8.0592 118.8176 57.6218 41.6493 179.4165 53 R 3.9000 7.9915 118.8043 59.2734 29.9917 178.5901 54 G 3.6802 7.8807 105.5910 48.0065 0.0000 175.2247 55 E 4.0835 8.2463 121.7550 58.9196 29.6605 178.7803 56 S 4.1979 8.1476 113.3117 61.6165 62.5103 175.9883 57 N 4.4908 8.6117 119.4607 56.0631 38.0415 177.1315 58 L 3.9150 7.9021 120.9733 58.3848 42.3804 178.9251 59 F 3.7602 8.5731 117.7527 60.2413 38.6224 177.0809 60 Y 3.8108 7.8727 119.7545 60.7949 38.3117 178.3234 61 T 3.6196 7.7320 109.1747 63.8513 69.1427 175.4903 62 L 4.1671 7.2098 120.1608 53.7784 42.2059 175.7075 63 A 4.5901 6.9490 124.5182 51.9032 19.4076 177.8177 64 K 4.6348 9.1278 125.2112 52.9428 36.1321 173.0545 65 W 5.2386 8.9679 135.0000 56.1227 32.6308 175.4611 66 E 4.4715 8.4249 123.0382 55.2835 33.3837 171.6284 67 N 4.0797 9.1139 121.3271 55.4239 36.4679 174.7217 68 N 3.4610 7.4413 108.7980 51.7791 35.3271 176.2151 69 K 3.9970 5.6600 116.4557 55.4611 36.2043 173.1962 70 I 5.0007 8.3827 126.1823 59.9776 39.3509 174.6056 71 S 4.9547 8.9790 122.6231 56.5137 66.9202 172.7368 72 V 4.5612 8.0255 119.7293 60.8103 33.7173 174.6411 73 E 4.0800 8.9434 129.8653 55.8391 30.4402 175.9442 74 L 4.2395 8.3594 128.8294 53.1381 42.2300 174.4626 75 P 4.4195 0.0000 0.0000 61.8238 32.1605 175.8438 76 E 4.0097 8.5255 120.4972 57.1241 30.0960 175.8336 77 N 4.6124 8.5406 116.4793 53.9704 36.2646 174.8623 78 L 4.2145 7.3693 122.8946 54.4499 41.2801 176.3393 79 D 4.4065 8.2457 127.8706 55.0329 39.7566 174.2657 80 M 4.3060 8.1811 115.7844 55.0994 33.0018 176.3078 81 Q 4.3279 8.5130 124.4466 55.0901 29.8985 176.2064 82 S 4.2220 8.7967 121.9562 58.6394 63.1928 169.8685 83 P 4.9213 0.0000 0.0000 60.7140 29.6562 174.5447 84 T 5.1993 7.6570 114.3239 61.2754 72.7399 173.6035 85 M 4.8728 8.9645 122.4828 54.2203 35.2519 174.1487 86 T 5.0088 8.7556 122.7847 61.8689 71.0784 173.6245 87 L 5.2266 9.1183 125.3726 52.9704 45.6826 175.4233 88 I 5.0895 8.8820 122.7197 59.8792 40.4485 174.3262 89 Y 5.3246 9.4428 124.1836 56.2783 42.3646 175.0078 90 D 5.2126 8.6368 123.6280 52.5212 41.8786 177.6734 91 E 4.0765 8.8802 113.7269 59.2584 29.7129 175.2477 92 T 4.0569 8.0344 113.4137 65.7416 68.7167 175.5319 93 G 4.1072 8.1589 107.0236 44.8628 0.0000 173.4230 94 K 4.1856 8.4862 122.4045 55.3492 32.7886 175.8465 95 L 3.8213 8.5471 128.5030 55.2684 42.3453 176.0365 96 L 4.6398 8.3977 126.1891 55.6498 43.7417 176.9528 97 W 4.4297 7.4999 125.6402 56.6833 33.9875 172.9563 98 T 4.6315 7.7673 121.6765 60.1974 68.9648 173.4673 99 Q 3.6210 8.4555 129.8293 58.4800 29.7347 176.6856 100 R 4.3730 7.3704 115.4756 54.1888 33.9725 174.5182 101 N 4.3517 8.5346 120.8989 53.0331 38.0766 174.8735 102 I 4.2629 7.5942 127.2599 57.8992 38.5526 173.8244 103 P 4.1824 0.0000 0.0000 65.3956 31.1249 178.1555 104 W 4.2497 8.0135 113.3299 59.6375 28.2538 177.6433 105 L 3.5320 6.2686 122.0176 56.8848 41.1799 178.8013 106 I 3.7843 7.5972 122.3421 64.6602 36.7895 178.9034 107 K 4.2200 7.8713 123.2516 58.9412 31.6663 181.6683 108 S 4.7352 7.7695 113.2775 60.2029 62.7914 173.7942 109 I 3.9987 6.8971 121.1435 59.7830 36.1981 175.4706 110 Q 3.7166 6.1620 125.4202 54.4132 29.4860 176.1810 111 P 4.0843 0.0000 0.0000 66.3667 31.6257 179.0319 112 E 4.0506 8.0642 114.6515 58.3935 30.1367 181.5931 113 W 4.4094 8.1179 118.5240 60.0230 29.1044 178.0872 114 L 4.1274 7.7334 118.3570 56.9802 40.9703 178.4711 115 K 4.3391 7.6371 119.6597 55.0986 32.2688 181.6158 116 T 4.7356 7.2466 104.3582 60.3724 71.9641 172.9708 117 N 4.7186 8.0423 119.4905 52.7591 39.1929 174.9650 118 G 3.9608 7.9864 109.3803 45.8643 0.0000 171.2003 119 F 5.2850 8.6291 118.1290 55.9594 41.5811 174.9659 120 H 4.7784 8.8749 119.0025 54.1179 33.3597 171.7589 121 E 5.2893 8.4329 116.7808 55.1316 33.7167 175.5200 122 I 4.6285 8.7853 124.3338 59.5874 39.4322 174.4747 123 E 4.7011 8.9490 129.3022 56.4650 30.3584 175.5128 124 T 4.6495 9.3531 121.7851 61.0477 71.5491 171.5097 125 N 5.4156 8.3806 119.1509 51.1863 40.6304 176.1586 126 V 3.6727 8.2029 118.0224 66.2091 31.2697 176.4343 127 D 4.5136 7.9373 117.8241 57.2704 40.5256 178.2731 128 A 3.8777 7.6666 120.7513 55.3372 18.3592 179.6903 129 T 4.1048 7.9207 114.3938 66.6625 68.3720 177.1469 130 S 4.2593 8.1521 116.1836 61.6405 62.7821 176.6993 131 T 4.0946 7.4981 117.8560 66.2330 68.2256 175.4704 132 L 4.2726 7.8764 119.5667 56.0118 42.1990 176.8469 133 L 4.7728 7.1318 116.5207 52.4185 43.9561 176.3882 134 S 4.2632 8.5084 118.4220 58.7464 62.9771 175.7556 135 E 4.0693 8.9581 124.3818 59.2554 29.5663 178.4113 136 D 4.7089 7.9326 114.0745 54.8535 40.9841 181.1383 137 H 4.4827 8.0438 118.0621 56.8058 30.0919 176.1587 138 S 4.2838 8.5894 119.3465 60.0995 63.4929 175.4913 139 A 4.2113 7.4601 122.5540 53.9319 18.4045 178.9411 140 Q 3.9224 7.9354 116.7187 58.7923 28.8184 178.3100 141 E 4.1149 7.8950 118.8522 58.4947 29.7540 178.6175 142 K 4.0153 7.8829 118.3676 59.4033 32.2495 179.0757 143 L 4.1131 8.4228 122.0094 58.2279 41.0523 180.3660 144 K 4.1179 8.0132 125.9018 60.3970 31.5287 182.5207 145 E 4.0164 8.1629 118.7875 60.6513 29.5478 181.6086 146 V 3.8175 7.8210 117.7626 66.1585 31.4002 178.1111 147 R 3.8971 7.9058 117.4631 58.4316 29.9103 177.3641 148 E 4.3736 7.4210 115.9326 58.1860 30.5553 177.7356 149 D 4.7232 7.6278 119.1843 55.9832 41.9825 176.7669 150 D 4.4514 8.5979 121.7077 53.0406 41.2963 177.3264 151 D 3.8327 6.7724 121.9692 55.0195 42.7190 177.5591 152 D 4.8365 7.6337 119.2538 52.9670 40.8053 179.0398 153 A 4.2278 7.6154 124.0176 52.5516 19.1817 177.6005 154 E 4.7367 8.5419 120.4168 55.4983 31.4603 175.3686 155 M 4.9826 8.9103 122.3462 53.8728 35.6392 174.7708 156 T 5.1052 8.3693 118.8708 62.1579 72.1670 172.5357 157 H 5.2053 9.0084 123.3582 53.9751 31.6703 174.3147 158 S 4.8537 8.7057 118.7110 58.6707 64.4873 173.3061 159 V 5.0297 8.7743 121.6354 61.3090 35.1903 173.7453 160 A 4.6056 9.0417 128.6889 49.9004 22.2311 174.6888 161 V 4.6800 8.0418 122.2513 60.9959 34.2466 173.9455 162 N 5.1251 8.9950 125.9114 51.8257 42.3803 172.6438 163 I 4.7901 8.3272 126.5094 59.8852 39.2775 174.7890 164 Y 4.2503 8.9844 125.1337 55.3257 39.4993 173.6764 165 P 4.6114 0.0000 0.0000 62.3859 32.3370 176.4680 166 A 4.2574 8.5753 124.1219 52.7253 19.0470 176.9706 167 T 4.5917 8.9235 117.9367 60.9462 72.1739 174.9831 168 A 3.9806 8.7571 124.6371 55.4491 18.1182 178.8944 169 R 4.6043 7.7256 110.8013 55.7173 30.7279 175.5957 170 M 4.3007 7.6182 117.2835 53.7158 35.5315 172.6373 171 P 4.6374 0.0000 0.0000 61.7025 33.0401 175.5448 172 Q 4.2108 8.4862 121.1944 56.9329 29.5217 175.4227 173 L 4.8168 9.0963 126.2909 53.2882 44.9313 175.4434 174 T 5.0635 9.0453 121.2774 62.1724 70.6765 173.3534 175 I 5.0676 8.7728 128.1372 59.5329 40.0284 175.0772 176 V 4.9856 9.0023 126.5072 61.0807 34.4228 174.1443 177 V 4.8104 8.7841 127.8097 61.0821 34.3520 174.0219 178 V 4.7698 8.7362 128.3346 61.0119 33.6005 174.0963 179 D 4.9162 8.7343 128.9331 54.7326 40.9545 176.0672 180 T 4.3672 8.6367 116.3017 62.9594 69.8994 174.8634 181 I 4.3331 7.7684 124.1257 59.1790 38.2889 173.9520 182 P 4.4652 0.0000 0.0000 62.1161 32.3790 177.3454 183 I 3.7288 8.4735 121.4133 64.6702 37.1842 178.5292 184 E 4.0287 8.2010 118.3554 58.5065 28.8922 177.4765 185 L 4.6707 7.9242 117.2525 54.1984 42.4550 178.1242 186 K 3.8457 8.2558 122.7991 59.7994 32.0922 178.0933 187 R 4.6870 6.9491 112.0040 54.3807 31.1505 178.2979 188 S 4.5035 8.6328 114.0570 60.0667 63.7313 173.1589 189 Y 4.7588 7.4079 117.2842 56.3253 40.3172 173.0485 190 M 4.3336 8.2608 119.3616 53.3482 34.3975 174.8986 191 H 4.3895 8.3349 123.1099 56.4670 29.5207 174.0484 192 H 4.7902 8.5648 121.3649 54.5901 32.1391 173.1141 193 H 4.5447 8.6188 124.1951 55.3205 27.6958 173.5346 194 H 4.7415 8.4033 124.0815 54.5096 31.1995 173.8462 195 H 5.0781 8.3785 123.2411 54.3710 31.2909 173.8828 196 H 4.4324 8.4853 117.1138 56.0317 28.2425 173.1589 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 44 M 8.30 4.32 0.00 1.96 1.97 0.00 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.25 0.00 45 D 8.32 4.23 0.00 2.81 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 K 9.38 4.12 0.00 1.80 1.79 0.00 1.85 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.43 1.09 7.81 47 T 7.85 4.16 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 1.24 0.00 0.00 48 T 7.87 3.90 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 49 F 7.81 4.03 0.00 2.88 3.18 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 50 R 8.11 3.82 0.00 1.97 2.00 0.00 3.24 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 2.07 0.00 51 L 8.04 3.91 0.00 1.86 1.94 0.96 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.06 4.05 0.00 1.93 1.77 1.09 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 53 R 7.99 3.90 0.00 1.45 1.42 0.00 3.25 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.59 0.00 54 G 7.88 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 E 8.25 4.08 0.00 2.30 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 0.00 2.42 2.60 0.00 56 S 8.15 4.20 0.00 4.10 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 57 N 8.61 4.49 0.00 2.84 2.95 0.00 0.00 6.69 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 58 L 7.90 3.92 0.00 1.84 1.83 0.89 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 59 F 8.57 3.76 0.00 3.26 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 60 Y 7.87 3.81 0.00 1.93 2.80 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 61 T 7.73 3.62 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 62 L 7.21 4.17 0.00 1.22 1.57 0.54 0.70 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 63 A 6.95 4.59 1.09 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 0.00 0.00 64 K 9.13 4.63 0.00 1.37 1.63 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.70 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.25 1.21 7.81 65 W 8.97 5.24 0.00 3.28 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 66 E 8.42 4.47 0.00 1.86 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 0.00 2.13 2.13 0.00 67 N 9.11 4.08 0.00 2.67 2.77 0.00 0.00 7.02 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 68 N 7.44 3.46 0.00 2.85 2.69 0.00 0.00 6.71 7.44 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 69 K 5.66 4.00 0.00 1.57 1.51 0.00 1.52 0.00 0.00 1.50 0.00 0.00 2.96 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.20 1.26 7.81 70 I 8.38 5.00 2.25 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.14 1.16 0.00 0.00 71 S 8.98 4.95 0.00 3.92 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 V 8.03 4.56 1.51 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 0.40 0.00 0.00 -0.42 0.00 0.00 73 E 8.94 4.08 0.00 1.88 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 2.23 2.19 0.00 74 L 8.36 4.24 0.00 1.63 1.56 0.92 0.98 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 75 P 0.00 4.42 0.00 2.15 1.93 0.00 3.72 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 1.90 1.80 0.00 76 E 8.53 4.01 0.00 1.99 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 0.00 2.36 2.32 0.00 77 N 8.54 4.61 0.00 2.85 2.84 0.00 0.00 6.87 7.85 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 78 L 7.37 4.21 0.00 1.59 1.60 0.90 1.11 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 79 D 8.25 4.41 0.00 2.74 2.35 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 80 M 8.18 4.31 0.00 2.11 2.11 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 2.58 2.60 0.00 81 Q 8.51 4.33 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.86 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.32 0.00 82 S 8.80 4.22 0.00 3.67 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 83 P 0.00 4.92 0.00 2.15 2.23 0.00 3.69 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.98 0.00 84 T 7.66 5.20 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 1.26 0.00 0.00 85 M 8.96 4.87 0.00 1.98 1.88 0.00 0.00 0.00 0.00 0.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.56 0.00 86 T 8.76 5.01 3.38 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 0.79 0.00 0.00 87 L 9.12 5.23 0.00 1.65 1.38 0.80 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 88 I 8.88 5.09 2.03 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.85 1.01 0.00 0.00 89 Y 9.44 5.32 0.00 2.91 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 90 D 8.64 5.21 0.00 2.79 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 91 E 8.88 4.08 0.00 2.01 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 2.23 1.92 0.00 92 T 8.03 4.06 4.51 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 1.25 0.00 0.00 93 G 8.16 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 0.00 0.00 0.00 94 K 8.49 4.19 0.00 1.91 2.08 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.48 1.41 7.81 95 L 8.55 3.82 0.00 1.48 1.46 0.18 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 96 L 8.40 4.64 0.00 1.79 1.89 1.10 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 97 W 7.50 4.43 0.00 3.37 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 98 T 7.77 4.63 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 0.94 0.00 0.00 99 Q 8.46 3.62 0.00 2.35 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.38 0.00 0.00 0.00 0.00 0.00 2.41 2.60 0.00 100 R 7.37 4.37 0.00 1.66 1.66 0.00 3.25 0.00 0.00 3.13 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 101 N 8.53 4.35 0.00 2.57 2.69 0.00 0.00 6.87 7.94 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 0.00 102 I 7.59 4.26 1.41 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 1.53 0.74 0.61 0.00 0.00 103 P 0.00 4.18 0.00 2.21 2.14 0.00 3.61 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 104 W 8.01 4.25 0.00 3.51 3.20 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 0.00 105 L 6.27 3.53 0.00 0.27 0.90 0.64 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.60 3.78 1.90 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.83 0.90 0.00 0.00 107 K 7.87 4.22 0.00 1.88 1.72 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.35 7.81 108 S 7.77 4.74 0.00 3.98 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 0.00 109 I 6.90 4.00 2.04 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.68 0.89 0.00 0.00 110 Q 6.16 3.72 0.00 0.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.82 6.89 0.00 0.00 0.00 0.00 0.00 1.99 1.43 0.00 111 P 0.00 4.08 0.00 2.14 2.22 0.00 3.47 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.88 0.00 112 E 8.06 4.05 0.00 1.92 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 1.91 0.00 113 W 8.12 4.41 0.00 3.34 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 L 7.73 4.13 0.00 1.77 1.61 0.41 -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 0.00 0.00 0.00 0.00 115 K 7.64 4.34 0.00 1.73 1.71 0.00 1.75 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.34 1.23 7.81 116 T 7.25 4.74 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 0.00 117 N 8.04 4.72 0.00 2.57 2.70 0.00 0.00 7.06 7.65 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 0.00 118 G 7.99 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 0.00 119 F 8.63 5.28 0.00 2.83 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 0.00 120 H 8.87 4.78 0.00 1.78 1.89 0.00 5.76 0.00 0.00 0.00 0.00 6.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 E 8.43 5.29 0.00 1.83 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 2.32 0.00 122 I 8.79 4.63 2.14 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 1.51 1.28 1.23 0.00 0.00 123 E 8.95 4.70 0.00 2.06 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 124 T 9.35 4.65 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 1.27 0.00 0.00 125 N 8.38 5.42 0.00 2.80 2.82 0.00 0.00 6.10 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 0.00 126 V 8.20 3.67 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 0.85 0.00 0.00 0.93 0.00 0.00 127 D 7.94 4.51 0.00 2.55 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 0.00 128 A 7.67 3.88 0.31 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 0.00 129 T 7.92 4.10 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 1.38 0.00 0.00 130 S 8.15 4.26 0.00 4.31 4.29 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 0.00 131 T 7.50 4.09 4.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 132 L 7.88 4.27 0.00 1.90 1.78 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 133 L 7.13 4.77 0.00 1.75 1.68 1.01 1.01 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 0.00 134 S 8.51 4.26 0.00 3.88 3.76 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 0.00 135 E 8.96 4.07 0.00 2.03 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 2.23 1.89 0.00 136 D 7.93 4.71 0.00 2.69 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 0.00 137 H 8.04 4.48 0.00 3.21 3.30 0.00 5.57 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 S 8.59 4.28 0.00 4.03 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 0.00 139 A 7.46 4.21 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 0.00 140 Q 7.94 3.92 0.00 2.24 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.72 0.00 0.00 0.00 0.00 0.00 2.47 2.80 0.00 141 E 7.90 4.11 0.00 2.08 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 2.28 2.34 0.00 142 K 7.88 4.02 0.00 2.01 1.84 0.00 1.72 0.00 0.00 1.81 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.53 1.53 7.81 143 L 8.42 4.11 0.00 1.89 1.73 0.98 1.03 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 0.00 144 K 8.01 4.12 0.00 1.76 1.82 0.00 1.81 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.37 1.32 7.81 145 E 8.16 4.02 0.00 2.01 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 2.24 2.18 0.00 146 V 7.82 3.82 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 1.00 0.00 0.00 0.97 0.00 0.00 147 R 7.91 3.90 0.00 2.09 1.94 0.00 3.29 0.00 0.00 3.27 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 148 E 7.42 4.37 0.00 2.11 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 2.39 2.32 0.00 149 D 7.63 4.72 0.00 2.74 2.77 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 0.00 150 D 8.60 4.45 0.00 2.67 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 0.00 151 D 6.77 3.83 0.00 2.71 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 D 7.63 4.84 0.00 2.69 2.53 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 0.00 153 A 7.62 4.23 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 0.00 154 E 8.54 4.74 0.00 1.98 1.95 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 2.22 2.33 0.00 155 M 8.91 4.98 0.00 1.92 2.01 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.62 0.00 156 T 8.37 5.11 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 1.26 0.00 0.00 157 H 9.01 5.21 0.00 3.28 3.43 0.00 5.81 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 S 8.71 4.85 0.00 3.86 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 0.00 159 V 8.77 5.03 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 1.10 0.00 0.00 1.10 0.00 0.00 160 A 9.04 4.61 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 V 8.04 4.68 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 0.96 0.00 0.00 0.89 0.00 0.00 162 N 9.00 5.13 0.00 2.66 2.42 0.00 0.00 6.66 7.26 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 0.00 163 I 8.33 4.79 1.79 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 1.19 0.72 0.86 0.00 0.00 164 Y 8.98 4.25 0.00 2.82 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 0.00 165 P 0.00 4.61 0.00 1.91 1.97 0.00 3.59 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.04 0.00 166 A 8.58 4.26 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 0.00 167 T 8.92 4.59 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 168 A 8.76 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 0.00 169 R 7.73 4.60 0.00 1.82 1.98 0.00 3.26 0.00 0.00 3.17 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 170 M 7.62 4.30 0.00 2.00 1.83 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 171 P 0.00 4.64 0.00 1.73 1.61 0.00 3.04 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.44 0.00 172 Q 8.49 4.21 0.00 2.05 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.73 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 173 L 9.10 4.82 0.00 1.80 1.72 0.88 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 174 T 9.05 5.06 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 1.26 0.00 0.00 175 I 8.77 5.07 2.16 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.23 0.97 0.00 0.00 176 V 9.00 4.99 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 1.02 0.00 0.00 177 V 8.78 4.81 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 0.91 0.00 0.00 1.01 0.00 0.00 178 V 8.74 4.77 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 0.92 0.00 0.00 0.95 0.00 0.00 179 D 8.73 4.92 0.00 2.83 2.66 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 0.00 0.00 0.00 0.00 180 T 8.64 4.37 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 1.28 0.00 0.00 181 I 7.77 4.33 1.93 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 1.46 0.68 0.95 0.00 0.00 182 P 0.00 4.47 0.00 2.30 1.94 0.00 3.74 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 183 I 8.47 3.73 1.86 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 1.30 0.90 0.90 0.00 0.00 184 E 8.20 4.03 0.00 1.92 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 2.40 2.39 0.00 185 L 7.92 4.67 0.00 1.70 1.64 0.93 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 186 K 8.26 3.85 0.00 1.94 1.88 0.00 1.58 0.00 0.00 1.75 0.00 0.00 3.15 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.46 7.81 187 R 6.95 4.69 0.00 1.85 1.69 0.00 3.26 0.00 0.00 3.27 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.41 0.00 188 S 8.63 4.50 0.00 4.05 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 0.00 189 Y 7.41 4.76 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 0.00 190 M 8.26 4.33 0.00 1.91 1.87 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 2.36 2.46 0.00 191 H 8.33 4.39 0.00 3.12 3.22 0.00 5.71 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 0.00 192 H 8.56 4.79 0.00 3.02 3.18 0.00 5.92 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 193 H 8.62 4.54 0.00 3.15 3.21 0.00 5.76 0.00 0.00 0.00 0.00 6.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 194 H 8.40 4.74 0.00 2.99 3.14 0.00 5.70 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 195 H 8.38 5.08 0.00 3.15 3.12 0.00 5.74 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 196 H 8.49 4.43 0.00 3.19 3.06 0.00 5.58 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