NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9606 8.0544 114.0474 61.5828 32.8870 174.8371 2 H 4.3805 8.5441 120.6164 55.1348 28.3020 172.6558 3 L 4.6691 7.6402 125.3672 52.6732 44.7643 177.0933 4 T 4.1432 8.3206 112.7574 60.7637 70.8939 174.0853 5 P 4.1977 0.0000 0.0000 65.6425 31.2740 178.6884 6 E 3.9935 8.0584 115.8064 58.9581 29.7851 178.8816 7 E 3.9186 7.7202 118.9941 59.1362 29.4443 179.1894 8 K 3.8583 8.1502 118.7054 59.5339 32.0244 179.3260 9 S 4.0375 8.3452 113.3469 61.1558 62.3202 176.0108 10 A 3.9826 7.9719 123.6289 55.0708 18.1343 179.8463 11 V 3.4207 7.7614 116.5901 66.5178 31.6701 178.4436 12 T 3.9758 8.1193 115.4477 66.5859 68.0418 176.5996 13 A 4.0529 8.1872 122.1332 55.0377 18.6292 179.1797 14 L 3.8659 7.9558 118.4626 58.0029 42.1681 179.0030 15 W 4.2769 8.7169 128.4510 60.2587 30.4043 177.9856 16 G 3.7452 8.0707 104.3607 46.7370 0.0000 174.6524 17 K 4.4289 7.8522 118.6596 55.3355 32.9461 176.4089 18 V 3.7391 7.0359 120.5388 61.7870 32.2709 175.6241 19 N 4.4785 8.3155 125.3349 52.6439 39.1466 175.6438 20 V 3.5032 8.1023 128.6805 66.0810 31.7791 177.4291 21 D 4.3674 8.0485 118.2461 57.1277 40.7447 178.1841 22 E 3.8446 8.3077 119.8262 59.4305 29.6997 179.1735 23 V 3.5830 8.1269 118.8073 65.5884 31.4742 178.2777 24 G 3.6830 8.5713 106.3849 47.6974 0.0000 175.9755 25 G 3.6083 8.2067 108.4837 47.3726 0.0000 175.4579 26 E 3.8854 8.2940 121.4466 58.9501 29.6235 178.8446 27 A 3.9275 8.3518 121.3054 55.0595 18.4658 179.4290 28 L 3.9720 8.1431 119.1283 57.9758 42.1342 179.2498 29 G 3.6034 8.1810 105.8024 48.1273 0.0000 175.9125 30 R 3.9030 8.2514 121.3814 58.3854 29.9589 178.7740 31 L 4.0125 8.1069 120.4624 58.4704 42.2208 179.2530 32 L 4.0638 7.8666 119.7915 56.6660 41.2428 179.5865 33 V 3.6022 7.3171 117.7948 65.6374 31.6988 177.9180 34 V 3.5314 7.9275 117.1152 64.2262 32.8534 175.6417 35 Y 3.8647 7.3433 116.1285 54.4595 37.7856 174.2404 36 P 4.8910 0.0000 0.0000 64.0121 32.0199 178.2901 37 W 4.3490 8.0143 116.8364 59.2325 27.9392 177.5407 38 T 4.2465 7.6958 110.4504 63.6923 68.2624 175.8604 39 Q 4.2809 8.2200 121.5688 57.8242 28.5013 178.0204 40 R 3.7497 7.5136 116.1015 58.4857 29.4072 177.5566 41 F 4.2350 6.8058 115.0278 57.9073 39.2861 175.9928 42 F 4.5132 7.8263 120.0833 56.7110 39.5232 177.1041 43 E 3.9910 8.2516 121.7080 59.2178 29.3218 177.8730 44 S 4.4532 8.0368 111.7992 59.4914 63.4520 174.4935 45 F 4.7158 8.3293 119.6529 57.9563 40.0274 176.1878 46 G 3.9828 8.1353 105.5026 43.8969 0.0000 174.4624 47 D 4.4617 8.6643 125.7527 54.5957 40.9749 175.8416 48 L 4.8747 8.3381 127.6775 54.5274 42.7203 178.1622 49 S 4.3578 8.2105 116.0428 60.2504 63.7025 174.5702 50 T 4.7385 7.4463 110.2316 58.4151 72.9248 172.6823 51 P 4.2290 0.0000 0.0000 66.0081 31.3475 178.6828 52 D 4.3131 8.1053 116.9291 57.2870 40.5292 178.5761 53 A 4.0020 7.8583 120.4746 54.9351 18.7901 179.5779 54 V 3.6896 7.8734 116.7367 66.6222 31.4621 178.3223 55 M 4.2256 8.2365 117.3473 57.6488 31.8160 177.9904 56 G 4.0587 7.7178 103.2613 43.5295 0.0000 173.5124 57 N 4.5293 7.6076 121.0562 52.3910 39.8990 173.9553 58 P 4.2866 0.0000 0.0000 65.5785 31.3889 178.4460 59 K 3.7210 8.6569 118.9016 58.5287 31.9013 179.2847 60 V 3.7204 7.8321 118.2944 65.8994 31.4694 177.8565 61 K 3.8488 8.0147 117.9241 59.6612 31.9984 179.1933 62 A 3.9656 7.9832 120.8000 55.3402 18.1998 179.2080 63 H 4.3575 8.6477 117.3959 59.2070 29.8730 177.6405 64 G 3.6888 8.5940 108.1540 47.8630 0.0000 175.7905 65 K 4.0136 8.2756 120.8668 58.9585 32.0800 179.4623 66 K 3.9660 7.8562 119.5423 59.3920 32.1558 179.1019 67 V 3.6265 8.0934 118.9126 66.2207 31.4778 178.0407 68 L 4.3863 8.4297 118.6827 57.2276 41.4614 179.6935 69 G 3.7163 8.5296 106.3048 47.7332 0.0000 175.7520 70 A 4.1238 8.2035 123.2035 54.7047 18.1853 179.3440 71 F 4.1517 8.4072 118.5341 61.5840 39.8260 176.9313 72 S 4.1357 8.7955 112.9636 61.7625 62.3511 176.0258 73 D 4.5127 8.4616 121.4844 57.1323 40.4482 178.9677 74 G 3.5361 7.9190 106.0643 47.2296 0.0000 175.5888 75 L 3.7555 7.1853 119.6602 56.7703 41.5910 178.3965 76 A 4.1699 7.4454 118.7910 53.0268 19.2887 176.7715 77 H 4.9117 7.9662 115.2728 54.9821 29.6742 175.7478 78 L 3.9254 7.9237 120.0199 57.6163 41.8403 178.5130 79 D 4.5674 7.9219 116.1690 55.5089 41.7920 176.0433 80 N 5.0030 8.2020 119.3608 51.3356 39.5063 175.6880 81 L 4.1118 7.9201 121.0726 57.8645 41.9940 179.3172 82 K 4.1608 7.9938 117.5379 59.2575 32.0639 179.2229 83 G 3.6792 8.0416 105.6464 48.0935 0.0000 175.8163 84 T 3.7713 7.7675 117.2100 65.3971 68.5870 175.7918 85 F 4.7478 7.9687 116.8567 57.0318 39.4218 177.3222 86 A 4.0632 7.6055 121.9005 55.7869 18.1751 180.4615 87 T 3.9097 7.8598 113.6659 66.7309 68.5223 176.9370 88 L 4.1354 7.9803 120.4808 57.4992 41.6461 179.3681 89 S 4.3846 8.2359 114.9074 60.9937 62.4323 175.9320 90 E 3.8992 8.2638 121.2951 59.3215 29.1844 179.1878 91 L 3.9153 8.1072 120.2765 58.6249 42.1515 178.8620 92 H 4.2353 8.6788 116.3270 58.5576 28.7261 177.3722 93 C 3.4852 7.8582 120.9033 62.3414 31.1850 175.2561 94 D 4.4631 8.3534 119.4914 55.8534 40.6022 177.4056 95 K 4.3250 7.7645 117.3319 57.2050 33.9290 177.2137 96 L 4.2189 7.6581 116.0293 54.5045 42.5383 175.8854 97 H 4.1233 7.1166 113.5874 56.6614 26.5107 175.2152 98 V 3.8980 7.9084 118.9726 61.0086 32.3229 174.8723 99 D 4.3853 8.8229 127.2694 53.9643 41.6429 175.1740 100 P 3.3528 0.0000 0.0000 64.1129 31.8231 177.8885 101 E 3.9066 8.3613 119.4287 59.1962 29.2412 178.3277 102 N 4.2993 8.0079 116.6690 56.2388 38.5115 177.2923 103 F 4.4267 7.3512 119.2229 60.5101 38.9376 177.9907 104 R 3.9910 7.9497 117.4114 59.1174 29.9284 178.8302 105 L 3.7903 7.9076 118.8015 57.6805 41.5821 179.2897 106 L 4.0635 8.3313 120.7185 58.0862 42.0035 179.2319 107 G 3.6783 8.2249 105.6668 47.9930 0.0000 175.4843 108 N 4.4685 8.3073 118.9927 55.9620 38.4547 177.7803 109 V 3.6506 8.1005 119.9249 65.7279 31.5192 177.8105 110 L 3.8581 8.3851 120.6417 58.1611 41.9217 179.1175 111 V 3.5595 7.9212 118.1098 66.2840 31.4084 177.7956 112 C 4.1172 8.1246 116.4964 62.7330 27.8499 176.3061 113 V 3.5499 7.9371 120.1609 65.8572 31.0247 178.1303 114 L 3.8239 8.0209 118.9254 57.5480 41.3084 179.2866 115 A 3.6785 7.3397 120.6763 55.2018 18.0532 179.1897 116 H 4.0900 8.0061 115.7694 59.8512 30.0459 176.9976 117 H 3.8515 8.2625 117.1035 57.9078 28.8311 176.8759 118 F 4.7411 8.3991 117.7766 56.2162 40.1045 177.1257 119 G 3.8149 8.8668 108.6588 46.2105 0.0000 177.4697 120 K 4.0786 8.8408 122.5557 59.0374 32.5480 177.9039 121 E 4.0752 8.0237 119.6465 58.4868 29.9103 177.0648 122 F 4.5528 8.1643 123.2510 57.2052 37.8431 175.2144 123 T 4.2617 7.3777 116.1968 59.9167 71.5077 173.6560 124 P 4.1809 0.0000 0.0000 65.5054 31.3427 177.2681 125 P 4.2356 0.0000 0.0000 65.3949 31.2710 178.8992 126 V 3.5518 7.4711 117.3996 65.7210 31.3686 177.8072 127 Q 3.5837 7.9396 119.5703 59.0544 28.8564 178.1500 128 A 4.0285 8.0598 121.4597 55.0997 18.3722 179.4630 129 A 3.8583 7.9202 119.0576 55.6956 18.4430 179.5985 130 Y 3.9227 8.2470 115.1246 61.1209 37.8761 178.7699 131 Q 4.1485 8.6922 119.7705 58.8848 28.7775 178.8412 132 K 4.0177 8.1334 119.6728 59.2510 31.9720 179.6659 133 V 3.5004 7.6657 118.5233 66.2108 31.4845 178.6694 134 V 3.8584 8.3932 112.2847 64.1818 31.2371 178.5239 135 A 4.1144 8.2207 121.0896 55.0589 18.1862 179.9462 136 G 3.4851 8.2863 104.4088 47.8088 0.0000 176.2256 137 V 3.3347 8.2021 120.8220 65.5807 31.6522 177.9941 138 A 3.8687 8.1352 120.6487 55.2111 17.9864 179.3720 139 N 4.2897 8.2228 114.0516 56.4319 38.7809 177.2381 140 A 4.1512 8.1274 122.2672 55.1187 18.6075 179.6754 141 L 3.8702 8.0029 117.0974 56.8553 41.6693 178.4720 142 A 4.4997 7.7009 119.1294 52.8519 18.9705 178.3552 143 H 4.3341 8.0966 116.7444 58.1420 29.9727 175.7583 144 K 4.5003 7.9858 118.0937 56.1187 32.1703 176.2262 145 Y 4.1563 7.9868 117.4178 58.6001 38.3665 175.8897 146 H 4.4368 8.3735 117.4447 56.2408 28.1684 173.3735 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 V 8.05 3.96 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 0.90 0.00 0.00 0.88 0.00 0.00 2 H 8.54 4.38 0.00 3.15 3.23 0.00 5.70 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.64 4.67 0.00 1.56 1.45 0.78 0.95 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 4 T 8.32 4.14 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 5 P 0.00 4.20 0.00 2.15 2.12 0.00 3.56 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.12 0.00 6 E 8.06 3.99 0.00 2.14 2.18 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 2.33 2.31 0.00 7 E 7.72 3.92 0.00 2.13 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 2.27 2.29 0.00 8 K 8.15 3.86 0.00 1.90 1.79 0.00 1.61 0.00 0.00 1.51 0.00 0.00 2.82 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.52 7.81 9 S 8.35 4.04 0.00 3.86 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 10 A 7.97 3.98 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 11 V 7.76 3.42 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 0.64 0.00 0.00 0.44 0.00 0.00 12 T 8.12 3.98 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 1.26 0.00 0.00 13 A 8.19 4.05 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 14 L 7.96 3.87 0.00 2.00 1.93 0.21 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.72 4.28 0.00 3.82 3.24 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 16 G 8.07 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 17 K 7.85 4.43 0.00 1.98 2.09 0.00 1.80 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.59 7.81 18 V 7.04 3.74 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 -0.04 0.00 0.00 0.75 0.00 0.00 19 N 8.32 4.48 0.00 2.71 2.59 0.00 0.00 6.85 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 20 V 8.10 3.50 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 1.21 0.00 0.00 0.96 0.00 0.00 21 D 8.05 4.37 0.00 2.71 2.68 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 22 E 8.31 3.84 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 23 V 8.13 3.58 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 0.85 0.00 0.00 0.59 0.00 0.00 24 G 8.57 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 25 G 8.21 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 8.29 3.89 0.00 2.08 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 2.28 2.29 0.00 27 A 8.35 3.93 1.33 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 0.00 0.00 0.00 28 L 8.14 3.97 0.00 1.77 1.64 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.18 3.60 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 0.00 0.00 0.00 30 R 8.25 3.90 0.00 1.88 1.93 0.00 3.10 0.00 0.00 3.03 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.71 0.00 31 L 8.11 4.01 0.00 1.86 1.88 0.99 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 32 L 7.87 4.06 0.00 1.89 1.67 0.90 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.32 3.60 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 0.71 0.00 0.00 0.94 0.00 0.00 34 V 7.93 3.53 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 -0.10 0.00 0.00 0.77 0.00 0.00 35 Y 7.34 3.86 0.00 2.63 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 36 P 0.00 4.89 0.00 2.32 2.30 0.00 3.80 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 2.20 1.89 0.00 37 W 8.01 4.35 0.00 3.54 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 7.70 4.25 4.41 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 1.09 0.00 0.00 39 Q 8.22 4.28 0.00 2.26 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.83 0.00 0.00 0.00 0.00 0.00 2.42 2.47 0.00 40 R 7.51 3.75 0.00 1.61 1.92 0.00 2.98 0.00 0.00 2.71 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 0.50 0.00 41 F 6.81 4.23 0.00 1.54 2.39 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 42 F 7.83 4.51 0.00 3.03 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 0.00 0.00 0.00 0.00 43 E 8.25 3.99 0.00 2.06 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 2.30 2.32 0.00 44 S 8.04 4.45 0.00 4.14 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 45 F 8.33 4.72 0.00 3.14 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 G 8.14 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 47 D 8.66 4.46 0.00 2.67 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 48 L 8.34 4.87 0.00 1.66 1.63 0.98 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 49 S 8.21 4.36 0.00 4.02 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 50 T 7.45 4.74 4.23 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 1.21 0.00 0.00 51 P 0.00 4.23 0.00 2.15 2.11 0.00 3.58 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 2.08 2.15 0.00 52 D 8.11 4.31 0.00 2.67 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 53 A 7.86 4.00 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 54 V 7.87 3.69 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 1.06 0.00 0.00 0.97 0.00 0.00 55 M 8.24 4.23 0.00 1.99 2.09 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 2.60 2.86 0.00 56 G 7.72 4.06 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 0.00 0.00 0.00 57 N 7.61 4.53 0.00 3.04 2.84 0.00 0.00 6.94 7.10 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 58 P 0.00 4.29 0.00 2.24 2.25 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 2.02 2.02 0.00 59 K 8.66 3.72 0.00 1.37 0.74 0.00 1.58 0.00 0.00 1.44 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.14 1.23 7.81 60 V 7.83 3.72 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 1.06 0.00 0.00 1.11 0.00 0.00 61 K 8.01 3.85 0.00 1.97 1.82 0.00 1.68 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.58 7.81 62 A 7.98 3.97 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 63 H 8.65 4.36 0.00 3.53 3.51 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 G 8.59 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 65 K 8.28 4.01 0.00 1.93 2.03 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.67 7.81 66 K 7.86 3.97 0.00 1.88 1.99 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.49 1.51 7.81 67 V 8.09 3.63 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 1.03 0.00 0.00 0.92 0.00 0.00 68 L 8.43 4.39 0.00 1.99 1.91 1.15 1.08 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 69 G 8.53 3.72 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 0.00 0.00 0.00 70 A 8.20 4.12 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 F 8.41 4.15 0.00 3.06 3.39 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 72 S 8.80 4.14 0.00 4.60 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 73 D 8.46 4.51 0.00 2.73 2.68 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 74 G 7.92 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 L 7.19 3.76 0.00 1.48 1.41 -0.45 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.45 4.17 1.10 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 0.00 0.00 77 H 7.97 4.91 0.00 3.09 3.14 0.00 5.82 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 78 L 7.92 3.93 0.00 1.54 1.64 0.75 0.95 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 79 D 7.92 4.57 0.00 2.64 2.69 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 80 N 8.20 5.00 0.00 2.69 2.61 0.00 0.00 7.10 6.55 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 81 L 7.92 4.11 0.00 1.76 1.83 0.94 0.93 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 82 K 7.99 4.16 0.00 1.67 1.77 0.00 1.50 0.00 0.00 1.27 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.45 7.81 83 G 8.04 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 84 T 7.77 3.77 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 0.60 0.00 0.00 85 F 7.97 4.75 0.00 3.23 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 86 A 7.61 4.06 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 87 T 7.86 3.91 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 1.23 0.00 0.00 88 L 7.98 4.14 0.00 2.02 1.86 1.16 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.24 4.38 0.00 4.18 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 0.00 90 E 8.26 3.90 0.00 2.21 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 2.34 2.64 0.00 91 L 8.11 3.92 0.00 1.77 1.87 0.91 0.94 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 92 H 8.68 4.24 0.00 3.52 3.73 0.00 5.86 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 93 C 7.86 3.49 0.00 1.23 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.35 4.46 0.00 2.69 2.68 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 95 K 7.76 4.33 0.00 1.81 1.77 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.33 1.49 7.81 96 L 7.66 4.22 0.00 1.66 1.58 0.70 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 97 H 7.12 4.12 0.00 3.54 3.45 0.00 5.64 0.00 0.00 0.00 0.00 8.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.91 3.90 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 0.18 0.00 0.00 0.34 0.00 0.00 99 D 8.82 4.39 0.00 2.82 2.58 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 0.00 100 P 0.00 3.35 0.00 1.96 1.88 0.00 3.39 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.44 0.00 101 E 8.36 3.91 0.00 2.04 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 2.33 2.40 0.00 102 N 8.01 4.30 0.00 2.49 2.72 0.00 0.00 6.90 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 0.00 103 F 7.35 4.43 0.00 3.10 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 R 7.95 3.99 0.00 1.98 1.97 0.00 3.29 0.00 0.00 3.34 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.75 0.00 105 L 7.91 3.79 0.00 1.69 1.30 0.71 -0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.33 4.06 0.00 1.85 1.87 0.93 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.22 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 0.00 108 N 8.31 4.47 0.00 2.93 2.95 0.00 0.00 6.68 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 0.00 109 V 8.10 3.65 2.25 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 1.11 0.00 0.00 1.16 0.00 0.00 110 L 8.39 3.86 0.00 1.72 1.77 0.89 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.92 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 1.30 0.00 0.00 1.18 0.00 0.00 112 C 8.12 4.12 0.00 3.18 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.94 3.55 2.13 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 1.00 0.00 0.00 0.89 0.00 0.00 114 L 8.02 3.82 0.00 1.03 1.16 0.62 0.88 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 0.00 115 A 7.34 3.68 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 0.00 116 H 8.01 4.09 0.00 3.13 3.42 0.00 5.78 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 0.00 117 H 8.26 3.85 0.00 2.81 2.42 0.00 5.88 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.40 4.74 0.00 3.32 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 0.00 119 G 8.87 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 0.00 120 K 8.84 4.08 0.00 1.92 2.01 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.46 1.48 7.81 121 E 8.02 4.08 0.00 2.08 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 0.00 2.31 2.27 0.00 122 F 8.16 4.55 0.00 3.06 3.14 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 0.00 123 T 7.38 4.26 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 1.28 0.00 0.00 124 P 0.00 4.18 0.00 2.16 2.14 0.00 3.58 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.49 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 126 V 7.47 3.55 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 0.89 0.00 0.00 127 Q 7.94 3.58 0.00 1.75 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.43 2.60 0.00 128 A 8.06 4.03 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 0.00 129 A 7.92 3.86 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 0.00 130 Y 8.25 3.92 0.00 3.38 3.30 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 0.00 131 Q 8.69 4.15 0.00 2.25 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.75 2.62 0.00 132 K 8.13 4.02 0.00 1.94 1.83 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.88 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.63 7.81 133 V 7.67 3.50 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 0.93 0.00 0.00 0.74 0.00 0.00 134 V 8.39 3.86 2.19 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 1.00 0.00 0.00 1.14 0.00 0.00 135 A 8.22 4.11 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 0.00 136 G 8.29 3.49 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 0.00 0.00 0.00 137 V 8.20 3.33 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 0.64 0.00 0.00 0.77 0.00 0.00 138 A 8.14 3.87 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 0.00 139 N 8.22 4.29 0.00 2.84 2.90 0.00 0.00 7.03 8.20 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 0.00 140 A 8.13 4.15 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 0.00 141 L 8.00 3.87 0.00 1.07 0.52 -0.09 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 142 A 7.70 4.50 1.33 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 0.00 0.00 0.00 143 H 8.10 4.33 0.00 3.31 3.51 0.00 5.74 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 7.99 4.50 0.00 1.87 1.84 0.00 1.82 0.00 0.00 1.84 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.51 1.71 7.81 145 Y 7.99 4.16 0.00 3.14 2.97 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 0.00 0.00 0.00 146 H 8.37 4.44 0.00 3.21 3.24 0.00 5.75 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