NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2521 8.2544 120.8607 54.5247 32.2672 175.1678 3 R 4.1814 7.7433 122.1275 55.2192 31.7171 175.3431 4 R 3.8519 8.7204 118.5089 57.5652 31.1376 175.9381 5 V 4.4064 8.1189 117.6203 60.2198 34.4367 174.6096 6 I 4.5258 7.9667 123.7140 60.7467 37.5990 175.3467 7 G 4.2165 8.4445 109.0728 43.2980 0.0000 170.9998 8 Q 4.1790 8.2996 119.7560 54.9516 29.9479 175.6848 9 R 4.1197 8.1976 121.8047 54.5166 29.3376 175.7426 10 K 3.8821 8.5583 127.3472 56.8891 32.2189 176.2844 11 I 4.2849 8.0392 127.1077 60.0491 38.4831 175.5812 12 L 4.2396 8.2525 123.5191 53.3807 42.1350 175.5633 13 P 4.4269 0.0000 0.0000 62.2262 31.8642 175.2086 14 D 4.5508 8.7859 118.1276 54.0536 41.3992 175.5354 15 P 4.5442 0.0000 0.0000 63.9205 30.7153 176.3867 16 K 4.4112 7.5518 119.5852 57.7269 36.2079 177.4820 17 F 4.1645 8.2993 122.1970 58.4894 39.4537 175.3175 18 G 3.9761 7.6603 106.8679 45.6129 0.0000 171.8395 19 S 4.4827 7.9605 117.4917 56.3498 66.2608 174.4120 20 E 4.0552 9.1025 127.5587 59.3783 29.0539 179.1571 21 L 4.0436 7.9520 118.3334 58.6833 40.1089 178.4142 22 L 4.0771 8.1089 120.0248 57.0604 42.1755 177.1818 23 A 4.1088 8.5599 121.8028 54.8792 18.0947 178.8303 24 K 3.9683 8.5002 117.3352 58.3805 32.6391 179.3909 25 F 4.2160 7.8433 120.1134 61.8797 39.4290 177.4511 26 V 3.5851 7.9422 112.0219 64.2535 31.0305 178.4990 27 N 4.3004 7.9156 115.1445 56.4892 38.6510 177.1190 28 I 3.7830 7.8310 120.0783 63.9786 37.1579 177.6672 29 L 4.0801 7.3142 119.9539 56.2286 42.3151 176.7300 30 M 4.1641 7.4002 118.0944 55.9454 32.8837 175.4725 31 V 4.4400 7.9762 120.2798 61.6576 34.2422 173.9053 32 D 4.4452 9.6189 120.1132 55.2832 38.3807 174.3204 33 G 3.9789 8.3007 103.1203 46.4938 0.0000 175.1629 34 K 4.3477 8.0620 119.4989 56.4497 32.0884 178.8912 35 K 3.9202 7.9928 122.0711 59.8527 32.3866 176.2380 36 S 4.0182 8.1666 112.8043 61.9557 62.2164 176.0217 37 T 3.8449 7.9610 117.7140 66.6673 68.1736 175.9840 38 A 3.9924 8.1054 121.9408 55.5718 18.2393 179.1475 39 E 4.0066 8.1314 116.5598 59.8390 29.4729 179.5693 40 S 4.3805 8.0980 112.7589 60.1791 63.2115 175.2703 41 I 4.2413 7.8211 121.8030 61.8903 38.9476 176.9158 42 V 4.0611 8.0389 118.6030 65.0736 31.6236 177.1546 43 Y 4.2984 8.6936 119.7249 60.5952 38.3863 178.0394 44 S 4.2179 8.2230 115.0201 61.1391 63.4230 175.9194 45 A 4.4561 7.9879 126.4535 53.5981 18.1412 178.8880 46 L 3.9878 8.3543 118.5600 57.6811 42.3943 178.1093 47 E 4.4105 7.5388 117.3434 57.3371 30.0540 177.7953 48 T 4.0573 8.3675 109.9632 63.5093 68.6489 175.9035 49 L 4.0160 7.9023 121.8413 57.1587 41.5072 178.6087 50 A 3.9573 8.0603 121.5505 55.4803 18.1408 179.4996 51 Q 3.9097 7.6134 115.9606 58.9634 29.1638 177.9208 52 R 4.3626 7.7540 117.3278 57.1624 30.5367 176.5343 53 S 4.4617 8.8773 112.0902 55.5258 67.5756 173.3560 54 G 3.6731 8.1905 110.0494 43.5577 0.0000 172.0308 55 K 4.2732 6.9055 115.3536 57.2427 36.1127 176.2237 56 S 4.4338 8.5863 111.3505 58.5337 60.2782 173.7684 57 E 4.1142 7.8700 119.0620 56.8434 28.3387 176.0787 58 L 4.4270 8.1485 122.9990 55.7791 45.0962 178.3607 59 E 3.8161 8.1196 116.5461 58.2321 29.4248 178.4670 60 A 3.9852 8.0775 121.1642 55.2407 18.2153 179.0039 61 F 3.9996 7.6754 118.4579 61.5717 39.4720 176.9859 62 E 3.4294 8.0196 118.1861 59.1491 29.2870 178.7749 63 V 4.0646 8.1524 118.7506 65.4413 31.5391 177.5952 64 A 4.1304 8.1879 121.0306 54.9258 18.1572 179.4288 65 L 3.6767 7.5060 117.0750 57.0347 41.3651 179.2115 66 E 3.8595 7.6422 118.7430 59.5904 29.4797 178.3298 67 N 4.7151 7.5227 112.3303 53.9726 38.5054 175.4764 68 V 4.4053 7.9919 116.8845 62.3557 32.4704 175.6100 69 R 4.1725 7.4953 118.5204 53.3951 29.2215 174.4214 70 P 4.7756 0.0000 0.0000 62.9524 32.7335 176.8808 71 T 4.6073 8.0073 108.2532 61.8710 68.2091 172.5133 72 V 4.8944 7.3946 109.7450 60.0681 35.5477 172.2081 73 E 4.7811 9.5268 122.9687 54.8093 33.7480 174.9903 74 V 4.0524 8.0917 120.6820 62.4234 33.6701 175.6627 75 K 4.4387 8.3048 117.0590 55.1843 34.2521 173.3069 76 S 4.8470 8.6597 118.8574 57.8405 63.3343 172.8510 77 R 4.5324 8.3526 125.8148 53.7334 32.8974 175.8605 78 R 4.2330 8.3592 128.2229 56.3261 28.1365 174.4466 79 V 4.3935 6.9231 109.5295 59.6322 35.8717 175.6138 80 G 3.6699 9.2939 106.1873 46.7816 0.0000 175.1151 81 G 4.2878 8.4786 113.0709 45.6581 0.0000 174.9081 82 S 4.5332 7.3024 122.7745 57.7023 63.1043 174.1227 83 T 4.7650 8.1415 111.5413 59.7880 70.4628 174.1335 84 Y 4.6293 8.6395 126.8612 58.4635 38.6013 176.2625 85 Q 4.3001 8.4580 113.6908 57.3676 33.8318 175.9765 86 V 3.3962 6.4582 114.5717 59.9586 28.6314 172.0956 87 P 4.8359 0.0000 0.0000 62.4214 32.3240 176.0677 88 V 4.6524 9.2055 121.1544 59.8452 35.3807 175.8349 89 E 4.7156 8.4803 119.3114 56.0425 30.6619 175.7155 90 V 4.3350 8.0436 111.8857 59.0870 35.1529 176.3066 91 R 4.1293 8.5737 124.0917 55.4954 31.7328 175.8554 92 P 4.2200 0.0000 0.0000 66.2351 31.0141 178.7425 93 V 3.5830 7.7779 111.0775 63.9877 31.6532 177.6764 94 R 4.3709 7.7964 113.6074 57.3159 30.4297 178.0770 95 R 3.8827 7.6069 118.8898 59.7231 29.8614 178.3473 96 N 4.1891 7.7030 114.7774 56.8668 38.9656 176.7675 97 A 4.0062 8.1826 121.4883 54.7356 18.2620 179.2739 98 L 3.5859 8.8447 115.7377 57.5667 41.8472 179.5826 99 A 3.1893 7.3280 120.0582 55.7150 18.4132 179.3240 100 M 4.1346 7.8813 116.5642 58.9517 31.4082 179.3859 101 R 3.9612 8.1803 118.0610 59.2871 30.4141 178.9996 102 W 4.8323 8.4005 118.1471 60.1988 28.8179 178.5528 103 I 3.9070 8.2235 119.0897 63.4331 36.7490 177.6793 104 V 4.1338 7.5534 117.7534 64.6738 32.1471 177.5035 105 E 4.1158 9.4618 115.7334 58.0186 29.3291 177.2357 106 A 4.6181 7.5146 118.8450 51.7151 20.6072 176.8391 107 A 4.3375 7.9887 117.5701 53.3618 19.1444 178.9236 108 R 4.1537 7.9019 114.3184 58.5656 30.5036 177.5115 109 K 4.3797 7.9137 114.1462 56.5801 32.3586 177.7779 110 R 3.8878 8.0480 119.7276 57.8184 30.5974 176.7693 111 G 3.8216 7.9800 103.1700 46.7901 0.0000 171.8281 112 D 5.1269 7.3976 120.2095 53.4490 42.7475 177.7125 113 K 4.1152 8.9262 121.0831 59.5262 32.2828 177.6284 114 S 4.5769 7.8827 110.3215 56.5097 66.0366 175.9287 115 M 3.7470 8.5351 123.0805 59.0886 31.4801 178.5415 116 A 4.2301 8.0119 121.5689 54.3743 18.7363 178.8153 117 L 3.9949 7.6749 117.5211 57.4130 42.5464 178.4802 118 R 3.9902 8.8671 118.1338 58.7697 30.0921 178.2778 119 L 4.2208 7.6730 119.6879 57.7527 42.4158 177.8205 120 A 3.9784 7.3385 120.1692 55.7727 18.2141 178.9783 121 N 4.2102 8.1320 113.3512 56.7517 38.6784 177.0326 122 E 4.0850 8.0490 120.0195 59.4171 29.4802 178.9418 123 L 4.0193 8.0877 118.8155 58.0859 41.6194 179.7426 124 S 4.1539 8.0547 114.4832 61.6430 62.9248 176.2257 125 D 4.4135 8.3538 121.1883 56.9104 40.4708 178.0554 126 A 4.0034 8.2508 122.1719 55.1520 18.1834 179.4646 127 A 3.8498 7.9163 120.3791 54.4214 18.7695 178.0418 128 E 4.2723 7.7761 114.9918 54.9544 29.5172 174.3644 129 N 3.9657 7.9847 115.1753 54.0474 35.8727 173.1697 130 K 4.1518 8.6760 120.7429 56.5661 36.0745 175.5522 131 G 4.2726 8.4296 110.2644 45.4942 0.0000 174.8672 132 T 3.8556 8.2877 114.5526 66.0740 67.9762 176.5068 133 A 4.4241 8.1401 122.1949 55.6516 18.4925 179.6882 134 V 3.8189 7.4630 116.8466 64.6001 31.4575 178.1289 135 K 3.8812 7.9481 119.8910 59.5430 31.9300 178.7358 136 K 3.5747 8.8219 119.7281 60.2593 31.8665 177.8395 137 R 4.3253 8.0691 118.7986 59.9427 29.7154 178.1552 138 E 4.0988 8.0495 117.2107 59.5496 29.7665 178.9098 139 D 4.4031 8.2964 117.7550 56.1989 41.0598 177.8144 140 V 4.1002 7.3013 118.6279 64.9244 32.3878 177.3004 141 H 4.2451 8.8142 116.0145 58.3999 28.2928 177.0583 142 R 4.0922 8.2259 119.1529 58.4693 29.9278 176.7472 143 M 4.3147 8.1322 116.6729 56.8402 33.4394 175.3585 144 A 4.1168 7.2397 123.8638 52.9247 19.5075 178.9257 145 E 3.7472 8.8862 119.4234 56.7561 29.5801 174.7178 146 A 4.7229 8.0054 118.8309 52.4672 20.1351 176.7280 147 N 4.9532 7.8074 115.1863 51.3883 39.8961 176.2309 148 K 3.9726 8.3280 119.8294 58.0616 32.6831 177.5789 149 A 3.7966 7.7237 120.5207 55.1011 18.2052 178.0525 150 F 4.5539 7.3980 112.2470 58.4867 40.7770 175.7045 151 A 4.1472 7.5565 127.1121 52.6339 18.0840 176.9109 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 2 R 8.25 4.25 0.00 1.79 1.86 0.00 3.18 0.00 0.00 3.22 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 3 R 7.74 4.18 0.00 1.88 1.91 0.00 3.48 0.00 0.00 3.19 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 4 R 8.72 3.85 0.00 1.79 1.85 0.00 3.31 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.75 0.00 5 V 8.12 4.41 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 0.84 0.00 0.00 0.93 0.00 0.00 6 I 7.97 4.53 1.87 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 1.35 0.67 0.91 0.00 0.00 7 G 8.44 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 0.00 0.00 0.00 0.00 8 Q 8.30 4.18 0.00 2.03 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.01 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 9 R 8.20 4.12 0.00 1.82 1.86 0.00 3.31 0.00 0.00 3.16 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.61 0.00 10 K 8.56 3.88 0.00 1.74 1.75 0.00 1.80 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.54 7.81 11 I 8.04 4.28 1.90 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.81 0.93 0.00 0.00 12 L 8.25 4.24 0.00 1.65 1.62 0.93 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.43 0.00 2.16 2.11 0.00 3.82 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.98 0.00 14 D 8.79 4.55 0.00 2.81 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 P 0.00 4.54 0.00 2.07 2.10 0.00 3.96 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.02 0.00 16 K 7.55 4.41 0.00 1.72 1.38 0.00 1.10 0.00 0.00 1.25 0.00 0.00 2.75 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.20 1.45 7.81 17 F 8.30 4.16 0.00 3.03 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 18 G 7.66 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 19 S 7.96 4.48 0.00 4.02 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 20 E 9.10 4.06 0.00 2.05 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 0.00 2.56 2.41 0.00 21 L 7.95 4.04 0.00 1.88 1.85 0.96 0.62 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 22 L 8.11 4.08 0.00 1.54 1.79 0.75 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.56 4.11 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 24 K 8.50 3.97 0.00 1.92 1.91 0.00 1.67 0.00 0.00 1.60 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.49 7.81 25 F 7.84 4.22 0.00 3.39 3.25 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 26 V 7.94 3.59 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 1.04 0.00 0.00 1.07 0.00 0.00 27 N 7.92 4.30 0.00 2.86 2.88 0.00 0.00 6.92 7.45 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 28 I 7.83 3.78 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.62 0.88 0.00 0.00 29 L 7.31 4.08 0.00 1.27 1.68 0.79 0.76 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 30 M 7.40 4.16 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.49 0.00 31 V 7.98 4.44 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 0.84 0.00 0.00 0.93 0.00 0.00 32 D 9.62 4.45 0.00 2.81 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 33 G 8.30 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 34 K 8.06 4.35 0.00 1.86 1.81 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.63 7.81 35 K 7.99 3.92 0.00 1.81 1.83 0.00 1.74 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.52 1.55 7.81 36 S 8.17 4.02 0.00 3.91 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 37 T 7.96 3.84 4.33 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 0.00 0.00 0.00 1.22 0.00 0.00 38 A 8.11 3.99 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 39 E 8.13 4.01 0.00 2.09 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 2.63 2.48 0.00 40 S 8.10 4.38 0.00 3.86 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 41 I 7.82 4.24 2.09 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.35 1.02 0.00 0.00 42 V 8.04 4.06 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 1.02 0.00 0.00 0.98 0.00 0.00 43 Y 8.69 4.30 0.00 3.12 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 44 S 8.22 4.22 0.00 4.15 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 45 A 7.99 4.46 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 0.00 0.00 0.00 0.00 0.00 0.00 46 L 8.35 3.99 0.00 1.82 1.61 0.54 0.78 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 47 E 7.54 4.41 0.00 1.96 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 2.12 2.43 0.00 48 T 8.37 4.06 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 1.27 0.00 0.00 49 L 7.90 4.02 0.00 1.70 1.94 0.98 0.90 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 50 A 8.06 3.96 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 51 Q 7.61 3.91 0.00 2.04 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.46 0.00 52 R 7.75 4.36 0.00 1.84 1.96 0.00 3.25 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 53 S 8.88 4.46 0.00 3.91 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 54 G 8.19 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 55 K 6.91 4.27 0.00 1.81 1.79 0.00 1.60 0.00 0.00 1.74 0.00 0.00 3.25 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.29 7.81 56 S 8.59 4.43 0.00 3.89 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 7.87 4.11 0.00 1.94 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 2.47 2.24 0.00 58 L 8.15 4.43 0.00 1.64 1.54 0.73 1.01 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 59 E 8.12 3.82 0.00 2.07 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 2.38 2.42 0.00 60 A 8.08 3.99 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 61 F 7.68 4.00 0.00 2.87 3.04 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 62 E 8.02 3.43 0.00 2.00 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 2.26 2.22 0.00 63 V 8.15 4.06 2.14 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 1.22 0.00 0.00 0.95 0.00 0.00 64 A 8.19 4.13 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.51 3.68 0.00 1.48 1.44 0.14 0.33 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 66 E 7.64 3.86 0.00 2.14 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 2.25 2.48 0.00 67 N 7.52 4.72 0.00 2.82 2.86 0.00 0.00 6.76 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 68 V 7.99 4.41 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 1.01 0.00 0.00 1.01 0.00 0.00 69 R 7.50 4.17 0.00 1.89 1.80 0.00 3.12 0.00 0.00 3.15 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.63 0.00 70 P 0.00 4.78 0.00 2.27 2.37 0.00 3.39 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.52 0.00 71 T 8.01 4.61 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 1.26 0.00 0.00 72 V 7.39 4.89 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 0.71 0.00 0.00 0.84 0.00 0.00 73 E 9.53 4.78 0.00 1.99 2.04 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 2.37 2.26 0.00 74 V 8.09 4.05 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 0.84 0.00 0.00 0.94 0.00 0.00 75 K 8.30 4.44 0.00 1.75 1.65 0.00 1.78 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.64 0.00 0.00 0.00 0.00 1.24 1.30 7.81 76 S 8.66 4.85 0.00 3.91 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 77 R 8.35 4.53 0.00 2.00 1.82 0.00 3.30 0.00 0.00 3.29 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 78 R 8.36 4.23 0.00 1.80 1.84 0.00 3.37 0.00 0.00 3.19 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 79 V 6.92 4.39 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 0.73 0.00 0.00 0.81 0.00 0.00 80 G 9.29 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 81 G 8.48 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 0.00 0.00 0.00 82 S 7.30 4.53 0.00 3.96 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 83 T 8.14 4.77 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 1.18 0.00 0.00 84 Y 8.64 4.63 0.00 3.04 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 85 Q 8.46 4.30 0.00 1.81 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.62 6.50 0.00 0.00 0.00 0.00 0.00 2.15 2.19 0.00 86 V 6.46 3.40 2.04 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 0.76 0.00 0.00 0.64 0.00 0.00 87 P 0.00 4.84 0.00 2.12 2.05 0.00 3.86 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.99 0.00 88 V 9.21 4.65 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 0.81 0.00 0.00 0.93 0.00 0.00 89 E 8.48 4.72 0.00 1.97 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 0.00 2.28 2.25 0.00 90 V 8.04 4.34 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 0.81 0.00 0.00 0.91 0.00 0.00 91 R 8.57 4.13 0.00 1.88 1.86 0.00 3.18 0.00 0.00 3.39 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 92 P 0.00 4.22 0.00 2.24 2.29 0.00 3.72 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.05 0.00 93 V 7.78 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 0.81 0.00 0.00 0.92 0.00 0.00 94 R 7.80 4.37 0.00 2.00 2.15 0.00 2.99 0.00 0.00 3.33 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.73 0.00 95 R 7.61 3.88 0.00 2.03 1.94 0.00 3.09 0.00 0.00 3.11 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.94 0.00 96 N 7.70 4.19 0.00 2.63 2.85 0.00 0.00 7.13 7.16 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 97 A 8.18 4.01 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 98 L 8.84 3.59 0.00 1.48 1.19 0.85 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.33 3.19 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 0.00 100 M 7.88 4.13 0.00 2.37 2.43 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.09 3.02 0.00 101 R 8.18 3.96 0.00 2.18 2.39 0.00 3.25 0.00 0.00 3.42 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.94 0.00 102 W 8.40 4.83 0.00 3.53 3.17 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 0.00 103 I 8.22 3.91 2.22 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.73 1.08 0.00 0.00 104 V 7.55 4.13 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 1.00 0.00 0.00 0.88 0.00 0.00 105 E 9.46 4.12 0.00 2.17 2.04 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 2.38 2.48 0.00 106 A 7.51 4.62 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 0.00 107 A 7.99 4.34 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 0.00 108 R 7.90 4.15 0.00 1.82 2.00 0.00 3.20 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.87 0.00 109 K 7.91 4.38 0.00 1.74 1.83 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.40 7.81 110 R 8.05 3.89 0.00 1.93 2.17 0.00 3.50 0.00 0.00 3.44 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.75 0.00 111 G 7.98 3.82 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 0.00 0.00 0.00 112 D 7.40 5.13 0.00 2.64 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 0.00 113 K 8.93 4.12 0.00 1.75 1.88 0.00 1.79 0.00 0.00 1.77 0.00 0.00 3.07 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.45 1.44 7.81 114 S 7.88 4.58 0.00 3.99 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 0.00 115 M 8.54 3.75 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.72 0.00 116 A 8.01 4.23 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 0.00 117 L 7.67 3.99 0.00 1.70 1.67 0.96 0.99 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 0.00 118 R 8.87 3.99 0.00 1.67 2.14 0.00 3.22 0.00 0.00 3.20 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.90 0.00 119 L 7.67 4.22 0.00 1.78 1.76 1.03 1.01 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 0.00 120 A 7.34 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 0.00 121 N 8.13 4.21 0.00 2.83 2.93 0.00 0.00 6.77 7.15 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 0.00 122 E 8.05 4.08 0.00 2.08 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.48 0.00 123 L 8.09 4.02 0.00 1.96 1.74 1.06 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 124 S 8.05 4.15 0.00 4.05 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 0.00 125 D 8.35 4.41 0.00 3.08 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 0.00 126 A 8.25 4.00 1.48 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 0.00 127 A 7.92 3.85 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 0.00 128 E 7.78 4.27 0.00 1.96 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 2.24 2.25 0.00 129 N 7.98 3.97 0.00 2.85 2.84 0.00 0.00 6.64 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 0.00 130 K 8.68 4.15 0.00 1.77 1.70 0.00 1.71 0.00 0.00 1.96 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.32 7.81 131 G 8.43 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 0.00 0.00 0.00 0.00 132 T 8.29 3.86 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 1.13 0.00 0.00 133 A 8.14 4.42 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 0.00 134 V 7.46 3.82 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.00 0.00 0.00 135 K 7.95 3.88 0.00 1.86 1.92 0.00 1.59 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.64 1.44 7.81 136 K 8.82 3.57 0.00 1.43 0.74 0.00 1.18 0.00 0.00 0.61 0.00 0.00 2.62 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.04 1.37 7.81 137 R 8.07 4.33 0.00 2.12 1.94 0.00 3.36 0.00 0.00 3.17 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.96 0.00 138 E 8.05 4.10 0.00 2.02 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 2.38 2.34 0.00 139 D 8.30 4.40 0.00 2.65 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 0.00 140 V 7.30 4.10 2.43 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 1.13 0.00 0.00 0.75 0.00 0.00 141 H 8.81 4.25 0.00 3.49 3.39 0.00 5.87 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 142 R 8.23 4.09 0.00 1.96 1.96 0.00 3.24 0.00 0.00 3.23 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 143 M 8.13 4.31 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.57 0.00 144 A 7.24 4.12 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 0.00 145 E 8.89 3.75 0.00 2.11 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.36 0.00 146 A 8.01 4.72 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 N 7.81 4.95 0.00 2.96 2.82 0.00 0.00 6.57 6.85 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 0.00 148 K 8.33 3.97 0.00 1.76 1.76 0.00 1.73 0.00 0.00 1.80 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.42 7.81 149 A 7.72 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 150 F 7.40 4.55 0.00 2.82 2.49 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 0.00 151 A 7.56 4.15 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