NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 S 4.2425 8.3344 116.7825 58.3581 64.9360 173.8979 5 V 3.7197 7.5031 125.3865 60.8262 30.8599 170.4624 6 V 4.0265 8.8920 128.4589 62.2989 33.5196 174.8003 7 K 4.7631 8.1039 122.4641 54.3159 36.0178 177.4760 8 S 4.2116 8.9230 118.1271 61.9662 62.8092 176.4494 9 E 4.1249 8.1343 114.8478 57.8439 29.7794 176.5083 10 D 4.6842 8.0261 120.4831 54.4051 40.9258 177.9305 11 Y 4.1350 7.2280 120.1206 59.9438 38.0529 177.6066 12 A 4.1469 7.0432 122.4209 54.4401 18.7498 177.6822 13 L 4.3709 7.0903 114.8955 53.0817 42.6401 175.1463 14 P 4.3011 0.0000 0.0000 63.1682 31.7084 175.7574 15 S 4.8621 8.3848 115.4639 56.4276 66.0219 172.3344 16 Y 4.6681 8.3214 121.0833 56.7055 39.6934 174.8499 17 V 4.1393 6.8617 117.4064 60.1018 35.6764 173.7187 18 D 4.5812 8.2820 123.6189 52.8015 41.4346 176.3868 19 R 4.5267 7.8905 122.7996 54.2269 34.0564 176.8241 20 R 3.4696 8.5907 121.7974 58.5507 30.1820 177.0717 21 D 4.8165 7.9517 114.5030 53.4215 40.4433 176.0107 22 Y 4.7750 7.7344 120.3932 55.1471 38.5865 172.5300 23 P 4.3891 0.0000 0.0000 64.7200 31.9678 177.2171 24 L 4.6384 7.2613 119.0756 51.6063 41.2971 174.1181 25 P 4.6534 0.0000 0.0000 62.2698 32.0289 176.7541 26 D 4.5738 8.9231 119.0955 56.9940 40.8386 176.8051 27 V 4.5484 7.5628 109.4125 59.2744 35.7670 174.2916 28 A 4.4840 8.1695 123.2549 51.2805 19.7530 177.0523 29 H 3.5616 8.6207 121.4649 58.1218 29.9278 175.9212 30 V 4.1563 7.6768 119.1956 60.7822 32.8977 174.7302 31 K 4.0934 8.5702 126.5965 58.0842 33.5775 176.2797 32 N 4.5931 7.8876 116.9095 51.9230 38.1078 174.2858 33 L 4.4301 8.1328 123.6628 53.5788 43.3008 177.7323 34 S 4.5630 8.1513 116.8856 56.8769 66.2256 174.9213 35 A 3.9730 8.4131 122.6313 55.6865 18.1151 179.9674 36 S 4.1371 8.0161 111.8359 61.3855 62.9530 176.6187 37 Q 3.9279 7.7712 121.8082 58.8812 28.5237 178.3026 38 K 3.8415 8.3808 119.6549 59.5378 32.0614 179.1830 39 A 3.9784 7.9816 120.8419 55.0845 18.3335 179.4369 40 L 3.9306 7.7509 118.5923 58.2947 41.9448 179.2961 41 K 3.9873 8.1741 117.7306 59.4345 32.2074 178.8922 42 E 4.1410 7.9619 118.7777 59.2315 29.4005 179.1698 43 K 4.0343 8.1694 119.5910 59.2945 31.9663 178.3865 44 E 4.1739 8.1460 119.0439 59.0418 29.5919 178.5273 45 K 4.1839 8.0696 117.1231 57.2694 32.2827 176.8099 46 A 4.5080 7.3099 122.0232 49.8124 20.4202 176.4479 47 S 3.8325 8.4092 112.7386 58.8279 62.8151 175.5777 48 W 4.7151 8.5257 125.9226 58.9055 29.2929 178.5098 49 S 4.3119 7.9868 114.4634 61.3765 62.3268 175.7063 50 S 4.3549 7.6846 114.4835 60.0302 62.8831 174.5049 51 L 4.2523 7.5787 121.6749 54.2609 42.1358 177.6530 52 S 4.5548 8.7380 118.6847 57.4169 65.5720 175.5132 53 I 3.6459 8.2202 123.4111 65.0310 36.9345 178.3872 54 D 4.5266 8.1344 118.8054 57.3100 40.5183 178.8097 55 E 3.9575 7.9262 118.9181 59.2233 29.5805 179.1605 56 K 3.8402 8.5794 118.8503 59.6042 32.1660 179.4730 57 V 3.5941 8.2266 118.7259 66.0357 31.2047 177.6872 58 E 4.0029 7.8991 118.0215 59.2218 29.2730 178.4603 59 L 4.0897 8.1779 119.3263 57.7253 41.2573 178.9079 60 Y 3.9469 7.9777 119.5481 60.7360 38.6994 177.8216 61 R 4.4866 8.0214 117.6328 57.4634 30.2756 177.5987 62 L 4.1790 7.3872 118.9495 56.7051 42.6870 179.0390 63 K 3.5241 7.6268 119.1812 58.0833 32.4273 176.2605 64 F 5.3434 7.5778 115.9564 55.5840 42.1580 175.7561 65 K 3.9591 9.3114 123.8720 58.1445 32.5424 176.6231 66 E 5.0100 7.7779 116.6911 54.0669 32.5493 176.8377 67 S 4.8476 8.5055 118.5436 56.9250 65.5245 175.6573 68 F 3.9392 8.9813 120.0912 60.9118 38.4610 177.6094 69 A 4.0524 8.2322 118.1880 55.4392 18.0998 179.1195 70 E 4.1183 7.9119 116.5083 59.6693 29.4643 179.2251 71 M 4.2575 8.0343 115.6418 57.5693 31.4855 176.7256 72 N 4.7200 7.9064 115.9965 52.9217 38.9165 175.4400 73 R 4.1872 7.3793 114.5225 55.8936 30.2861 176.2075 74 S 4.6826 8.3645 114.2058 57.2837 64.7475 173.3363 75 T 4.5990 8.2191 111.7333 60.4975 71.1575 173.5831 76 N 4.7688 8.3353 115.4369 53.1352 39.1244 176.5913 77 E 3.9002 8.3461 122.3554 59.1464 29.4208 178.7824 78 W 4.3766 8.4007 116.2046 59.8193 28.1119 178.0351 79 K 3.0220 6.2725 119.1565 59.2680 31.2457 179.4135 80 T 3.8415 7.4112 115.2462 66.5298 68.4514 176.6559 81 V 3.6007 7.7802 120.1813 66.0419 31.5821 177.7859 82 V 3.7739 8.4761 118.1726 66.2624 31.4127 178.1287 83 G 3.7572 8.0763 104.2911 48.1002 0.0000 175.3249 84 A 4.3169 8.3944 123.5620 54.5373 18.2418 179.5478 85 A 4.0969 8.4260 119.5627 55.6905 18.4814 179.3523 86 M 3.9921 8.2382 116.9636 58.8601 32.0909 178.6844 87 F 3.8816 8.7474 120.7162 61.6690 39.2184 177.2742 88 F 3.8931 8.2591 116.0094 60.2262 39.0089 177.6323 89 I 4.0563 8.3593 120.3593 64.2234 36.9801 178.5817 90 G 3.5098 8.8170 107.4227 47.8407 0.0000 175.4348 91 F 3.9412 7.9492 123.2875 61.1002 39.1238 177.3761 92 T 3.6035 7.8146 115.3195 66.3352 68.1933 176.1218 93 A 3.8997 7.6815 122.5531 55.3515 18.2507 179.5898 94 L 3.8403 7.2386 117.0807 57.8866 41.6578 179.7795 95 L 3.7836 7.1812 118.2134 57.6615 41.5826 179.2688 96 L 3.9675 7.9920 119.0522 57.9072 41.7030 179.6889 97 I 3.6847 8.0403 119.9729 64.2441 37.0821 178.2578 98 W 4.2543 8.4174 129.2249 60.3973 30.4473 177.4398 99 E 3.9814 8.4525 119.3384 59.3287 28.9291 178.6109 100 K 4.0370 7.7163 118.4967 60.1008 32.2179 177.7646 101 H 4.0865 7.8483 117.4745 59.1073 29.9785 176.4606 102 Y 3.8781 7.7740 118.7568 59.4847 37.8656 176.5240 103 V 3.9933 7.5987 118.4482 64.5379 32.7284 175.4937 104 Y 4.5451 7.6439 116.8030 58.1627 38.6768 177.0881 105 G 3.9609 8.4573 117.3846 44.7908 0.0000 170.9116 106 P 4.6502 0.0000 0.0000 61.2241 33.0317 175.7448 107 I 3.9276 7.7903 113.0663 59.5137 38.5927 174.0177 108 P 4.3330 0.0000 0.0000 62.9106 31.8393 177.4415 109 H 4.1949 8.5449 116.2483 58.6542 28.4729 177.2159 110 T 2.4800 7.0145 107.2919 62.3572 68.0459 174.3035 111 F 4.5528 7.3096 120.0606 57.8370 40.2275 176.7201 112 E 4.1218 8.4994 122.3984 56.1986 30.8066 176.8926 113 E 3.9787 9.0648 124.3925 59.7321 29.5379 178.7458 114 E 3.8876 8.2946 118.2929 59.1592 29.7302 178.0436 115 W 3.9597 8.3861 127.7217 60.6545 30.5437 177.8426 116 V 3.7291 8.4901 117.9780 66.1288 31.0352 177.7367 117 A 3.9459 8.6107 120.7984 55.1945 18.1379 179.6600 118 K 3.7798 8.2170 117.0467 59.6105 32.0918 179.0723 119 Q 3.8935 8.3239 120.0299 59.7934 28.8956 179.0996 120 T 3.9803 8.6347 117.0728 66.4140 68.4390 176.5017 121 K 3.6521 7.9432 121.4193 59.4797 32.2758 178.4266 122 R 3.8137 8.4043 119.2586 59.9431 29.9807 178.1467 123 M 3.9779 8.2614 118.3051 58.5545 31.6832 178.8678 124 L 4.2007 8.0070 118.7330 57.6477 41.3792 179.4424 125 D 4.4707 8.0569 119.0840 57.1154 40.9528 177.6530 126 M 4.2774 8.0094 114.2591 54.1934 32.7309 176.1358 127 K 4.0455 7.5361 117.5364 56.3901 30.3204 175.9922 128 V 3.4694 7.9234 118.0964 64.2094 32.8029 174.8717 129 A 4.1109 8.7487 128.8371 52.8539 15.4463 175.1754 130 P 4.5275 0.0000 0.0000 64.7600 32.5244 179.1728 131 I 4.0698 7.8466 119.0491 63.9354 37.5601 176.0770 132 Q 4.5847 8.1478 115.1566 57.5014 34.1334 175.8137 133 G 3.8923 8.1188 104.7819 48.2888 0.0000 172.5786 134 F 4.7734 8.5080 118.8837 59.0685 41.8549 177.8237 135 S 4.3911 9.0794 116.5265 61.3092 62.9615 176.6491 136 A 4.2627 8.1969 121.8711 54.3481 18.4148 177.9438 137 K 4.4218 8.2565 114.5437 56.2726 32.6375 175.8355 138 W 4.8313 8.0243 129.7933 55.3574 32.2934 175.0497 139 D 4.4884 7.8389 125.8937 53.0273 39.7906 176.4307 140 Y 4.1641 8.3965 125.4773 60.8815 38.6400 177.7635 141 D 4.4532 8.1343 119.7229 57.4229 41.1764 178.0391 142 K 4.0627 8.4667 115.9542 56.3619 32.6387 176.8467 143 N 3.7031 7.1086 115.1441 52.7315 37.3548 171.8281 144 E 3.5697 6.0031 116.1676 54.3542 33.9383 176.7299 145 W 4.5341 8.1858 120.6957 56.4253 29.7709 176.5051 146 K 3.8261 8.7528 123.9562 56.7498 32.2617 177.2757 147 K 4.1538 8.5606 122.4572 56.8048 32.0153 176.8722 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 4 S 8.33 4.24 0.00 3.81 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 V 7.50 3.72 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 0.93 0.00 0.00 6 V 8.89 4.03 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 0.90 0.00 0.00 0.98 0.00 0.00 7 K 8.10 4.76 0.00 1.96 1.79 0.00 1.89 0.00 0.00 1.82 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.42 1.42 7.81 8 S 8.92 4.21 0.00 3.93 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 9 E 8.13 4.12 0.00 2.00 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 2.24 2.25 0.00 10 D 8.03 4.68 0.00 2.94 2.67 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 11 Y 7.23 4.14 0.00 3.11 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 12 A 7.04 4.15 1.04 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 0.00 0.00 13 L 7.09 4.37 0.00 1.60 1.59 0.92 0.98 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 14 P 0.00 4.30 0.00 2.07 2.05 0.00 3.62 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.12 0.00 15 S 8.38 4.86 0.00 3.99 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 16 Y 8.32 4.67 0.00 2.98 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 17 V 6.86 4.14 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 0.63 0.00 0.00 0.82 0.00 0.00 18 D 8.28 4.58 0.00 2.57 2.50 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.89 4.53 0.00 1.82 1.94 0.00 3.07 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 20 R 8.59 3.47 0.00 1.76 1.99 0.00 3.23 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.45 0.00 21 D 7.95 4.82 0.00 2.83 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 22 Y 7.73 4.78 0.00 2.79 2.84 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 0.00 0.00 0.00 23 P 0.00 4.39 0.00 2.27 2.42 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.04 0.00 24 L 7.26 4.64 0.00 1.54 1.69 0.95 1.18 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 25 P 0.00 4.65 0.00 2.53 2.01 0.00 4.05 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.20 0.00 26 D 8.92 4.57 0.00 2.94 2.83 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.56 4.55 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 0.78 0.00 0.00 1.07 0.00 0.00 28 A 8.17 4.48 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 29 H 8.62 3.56 0.00 2.10 3.19 0.00 5.89 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 30 V 7.68 4.16 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 0.77 0.00 0.00 0.70 0.00 0.00 31 K 8.57 4.09 0.00 1.86 1.86 0.00 1.59 0.00 0.00 1.68 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.31 1.41 7.81 32 N 7.89 4.59 0.00 2.69 2.80 0.00 0.00 6.88 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 33 L 8.13 4.43 0.00 1.60 1.56 0.89 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.15 4.56 0.00 4.03 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 35 A 8.41 3.97 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 36 S 8.02 4.14 0.00 4.06 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 37 Q 7.77 3.93 0.00 2.29 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.78 0.00 0.00 0.00 0.00 0.00 2.46 2.38 0.00 38 K 8.38 3.84 0.00 1.91 1.87 0.00 1.66 0.00 0.00 1.64 0.00 0.00 3.05 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.73 7.81 39 A 7.98 3.98 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 40 L 7.75 3.93 0.00 1.90 1.86 0.93 0.57 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 41 K 8.17 3.99 0.00 1.91 1.87 0.00 1.74 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.67 1.61 7.81 42 E 7.96 4.14 0.00 2.18 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 2.61 2.46 0.00 43 K 8.17 4.03 0.00 1.86 2.01 0.00 1.67 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.49 7.81 44 E 8.15 4.17 0.00 2.20 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 0.00 2.67 2.50 0.00 45 K 8.07 4.18 0.00 1.88 1.86 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.22 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.52 1.63 7.81 46 A 7.31 4.51 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 47 S 8.41 3.83 0.00 3.79 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 48 W 8.53 4.72 0.00 3.55 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 49 S 7.99 4.31 0.00 3.93 3.97 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 50 S 7.68 4.35 0.00 4.06 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.58 4.25 0.00 2.05 1.63 0.99 0.99 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 52 S 8.74 4.55 0.00 4.08 3.99 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 0.00 0.00 0.00 53 I 8.22 3.65 1.87 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 1.64 0.78 0.90 0.00 0.00 54 D 8.13 4.53 0.00 2.72 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 55 E 7.93 3.96 0.00 2.26 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 2.33 2.35 0.00 56 K 8.58 3.84 0.00 1.91 1.82 0.00 1.67 0.00 0.00 1.55 0.00 0.00 2.86 0.00 0.00 3.19 0.00 0.00 0.00 0.00 1.38 1.53 7.81 57 V 8.23 3.59 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 1.00 0.00 0.00 0.90 0.00 0.00 58 E 7.90 4.00 0.00 2.12 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 0.00 2.32 2.36 0.00 59 L 8.18 4.09 0.00 1.93 1.63 0.83 0.62 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 60 Y 7.98 3.95 0.00 3.17 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 61 R 8.02 4.49 0.00 2.03 2.06 0.00 3.44 0.00 0.00 3.32 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.75 0.00 62 L 7.39 4.18 0.00 1.84 1.58 0.87 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 63 K 7.63 3.52 0.00 1.28 0.84 0.00 1.21 0.00 0.00 1.44 0.00 0.00 2.70 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.35 0.21 7.81 64 F 7.58 5.34 0.00 2.95 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 65 K 9.31 3.96 0.00 1.46 2.25 0.00 1.70 0.00 0.00 1.82 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.24 7.81 66 E 7.78 5.01 0.00 2.25 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 2.27 2.26 0.00 67 S 8.51 4.85 0.00 4.10 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 68 F 8.98 3.94 0.00 3.02 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 69 A 8.23 4.05 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 70 E 7.91 4.12 0.00 2.33 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 71 M 8.03 4.26 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.65 0.00 72 N 7.91 4.72 0.00 2.86 2.89 0.00 0.00 7.02 7.19 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 73 R 7.38 4.19 0.00 1.98 1.95 0.00 3.07 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.58 0.00 74 S 8.36 4.68 0.00 4.06 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 75 T 8.22 4.60 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 1.24 0.00 0.00 76 N 8.34 4.77 0.00 2.69 2.66 0.00 0.00 6.43 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 77 E 8.35 3.90 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 78 W 8.40 4.38 0.00 3.66 3.34 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 79 K 6.27 3.02 0.00 1.33 1.39 0.00 1.26 0.00 0.00 1.27 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.30 0.21 7.81 80 T 7.41 3.84 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 1.18 0.00 0.00 81 V 7.78 3.60 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 1.13 0.00 0.00 1.04 0.00 0.00 82 V 8.48 3.77 2.37 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 1.11 0.00 0.00 1.22 0.00 0.00 83 G 8.08 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 0.00 0.00 0.00 84 A 8.39 4.32 1.55 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 0.00 0.00 85 A 8.43 4.10 1.52 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 0.00 0.00 86 M 8.24 3.99 0.00 2.14 2.43 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.64 0.00 87 F 8.75 3.88 0.00 3.11 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 88 F 8.26 3.89 0.00 3.36 3.22 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 89 I 8.36 4.06 2.09 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.93 0.93 0.00 0.00 90 G 8.82 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 7.95 3.94 0.00 2.51 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 92 T 7.81 3.60 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 1.18 0.00 0.00 93 A 7.68 3.90 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 94 L 7.24 3.84 0.00 1.34 1.52 0.90 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 95 L 7.18 3.78 0.00 1.67 1.55 0.79 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 96 L 7.99 3.97 0.00 1.88 1.71 0.90 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 97 I 8.04 3.68 2.04 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 1.41 1.25 0.94 0.00 0.00 98 W 8.42 4.25 0.00 3.34 3.27 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 99 E 8.45 3.98 0.00 2.26 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.14 0.00 100 K 7.72 4.04 0.00 1.84 1.85 0.00 1.89 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.51 7.81 101 H 7.85 4.09 0.00 3.20 3.13 0.00 5.99 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 0.00 102 Y 7.77 3.88 0.00 1.43 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 0.00 0.00 0.00 103 V 7.60 3.99 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 0.80 0.00 0.00 0.95 0.00 0.00 104 Y 7.64 4.55 0.00 3.10 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 G 8.46 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 0.00 106 P 0.00 4.65 0.00 2.15 2.01 0.00 3.73 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.91 0.00 107 I 7.79 3.93 1.57 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.55 0.56 0.00 0.00 108 P 0.00 4.33 0.00 2.24 1.87 0.00 3.74 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.05 0.00 109 H 8.54 4.19 0.00 3.43 3.51 0.00 5.66 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 T 7.01 2.48 3.32 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 -0.03 0.00 0.00 111 F 7.31 4.55 0.00 3.12 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 E 8.50 4.12 0.00 2.20 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 2.40 2.50 0.00 113 E 9.06 3.98 0.00 2.09 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 2.45 2.47 0.00 114 E 8.29 3.89 0.00 2.12 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 2.38 2.38 0.00 115 W 8.39 3.96 0.00 3.61 3.26 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 0.00 116 V 8.49 3.73 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 1.06 0.00 0.00 1.14 0.00 0.00 117 A 8.61 3.95 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 0.00 118 K 8.22 3.78 0.00 1.64 1.58 0.00 1.40 0.00 0.00 1.32 0.00 0.00 2.80 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.50 7.81 119 Q 8.32 3.89 0.00 2.20 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.50 0.00 120 T 8.63 3.98 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 121 K 7.94 3.65 0.00 1.69 1.89 0.00 1.56 0.00 0.00 1.51 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.35 1.34 7.81 122 R 8.40 3.81 0.00 1.78 2.03 0.00 3.08 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 123 M 8.26 3.98 0.00 1.72 2.24 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.69 2.39 0.00 124 L 8.01 4.20 0.00 1.60 1.35 -0.49 0.50 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 0.00 125 D 8.06 4.47 0.00 2.78 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 0.00 126 M 8.01 4.28 0.00 2.16 2.15 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.84 0.00 127 K 7.54 4.05 0.00 1.91 1.94 0.00 1.57 0.00 0.00 1.25 0.00 0.00 2.67 0.00 0.00 2.46 0.00 0.00 0.00 0.00 1.59 1.46 7.81 128 V 7.92 3.47 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 0.87 0.00 0.00 0.85 0.00 0.00 129 A 8.75 4.11 1.47 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 0.00 0.00 130 P 0.00 4.53 0.00 2.26 2.28 0.00 3.83 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.03 0.00 131 I 7.85 4.07 1.92 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.45 0.95 0.00 0.00 132 Q 8.15 4.58 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.00 0.00 0.00 0.00 0.00 0.00 2.30 2.39 0.00 133 G 8.12 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 0.00 134 F 8.51 4.77 0.00 3.12 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 0.00 135 S 9.08 4.39 0.00 4.22 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 0.00 136 A 8.20 4.26 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 0.00 137 K 8.26 4.42 0.00 2.18 1.97 0.00 1.75 0.00 0.00 1.53 0.00 0.00 2.85 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.47 1.44 7.81 138 W 8.02 4.83 0.00 2.81 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 0.00 139 D 7.84 4.49 0.00 2.43 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 0.00 0.00 0.00 140 Y 8.40 4.16 0.00 3.04 2.99 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 0.00 0.00 0.00 141 D 8.13 4.45 0.00 2.87 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 0.00 142 K 8.47 4.06 0.00 1.53 1.71 0.00 1.86 0.00 0.00 1.55 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.39 7.81 143 N 7.11 3.70 0.00 2.81 2.67 0.00 0.00 6.96 7.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 E 6.00 3.57 0.00 1.73 1.63 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 1.73 1.87 0.00 145 W 8.19 4.53 0.00 3.21 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 0.00 146 K 8.75 3.83 0.00 1.70 1.79 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.45 1.43 7.81 147 K 8.56 4.15 0.00 1.73 1.72 0.00 1.75 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.42 1.39 7.81