NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6249 8.2227 120.4783 54.1962 42.9947 173.7269 2 V 4.2151 7.9112 120.6905 61.9589 32.7432 173.7513 3 Q 4.6609 9.8336 126.2267 54.2951 33.7427 173.4160 4 L 5.2348 8.5665 121.9090 53.2096 45.8261 175.3580 5 Q 4.5395 8.4836 122.3928 55.0603 32.5610 173.5901 6 E 5.1362 8.9340 126.2674 56.2303 31.0261 175.8035 7 S 4.6067 9.1233 116.0216 57.1856 66.9781 173.7763 8 G 4.4368 8.6874 107.9153 42.3222 0.0000 171.0273 9 P 4.3461 0.0000 0.0000 62.9685 31.7106 176.3629 10 S 4.7205 8.5226 113.8296 58.4642 64.9455 172.9520 11 L 5.1971 7.7336 122.3093 53.5007 44.5449 175.6500 12 V 4.6192 8.7594 118.1919 59.6394 36.6858 174.5139 13 K 5.0025 9.1719 121.7400 54.1660 34.1800 174.9871 14 P 4.4886 0.0000 0.0000 64.4758 31.4616 177.2720 15 S 4.1638 9.5126 117.1666 58.5322 62.1201 169.6623 16 Q 4.3386 7.6320 118.8766 55.5337 31.0305 174.4626 17 T 4.8709 8.1309 115.7923 62.1007 69.9193 174.5064 18 L 4.3037 8.8370 129.8193 54.3061 43.5760 175.4424 19 S 5.1174 8.4291 121.3726 56.7092 66.1429 173.3116 20 L 4.9614 8.7201 123.6016 53.1370 45.8302 175.5351 21 T 5.1808 9.0516 117.8337 61.9588 72.4686 172.2911 22 C 5.1181 8.7492 125.2110 54.9088 40.7074 172.6117 23 S 4.8505 8.9909 123.7281 57.3028 64.2689 173.3455 24 V 4.7914 8.0669 125.2729 61.2305 33.0340 174.9607 25 T 4.5343 8.9659 117.6213 60.9047 71.3224 174.3260 26 G 4.0157 9.2139 111.9314 46.8618 0.0000 172.7749 27 D 4.4225 7.2894 116.0394 53.3956 44.0753 174.6423 28 S 4.4295 8.2250 117.0838 57.6322 62.9998 175.0476 29 I 4.2145 8.2836 119.8789 63.6019 37.5462 176.9508 30 T 4.3001 7.9687 110.2219 63.1980 68.7459 174.9693 31 S 4.7466 7.6640 118.2595 58.0485 63.1684 172.7492 32 D 4.1701 7.7118 118.3995 53.9736 43.6909 174.0658 33 F 5.0468 7.5751 119.0500 55.5575 41.4537 175.2228 34 W 4.9829 8.9821 121.8582 54.9887 32.5243 174.8168 35 S 5.6595 9.2714 119.0964 56.6308 67.1849 172.8236 36 W 5.5255 9.2017 119.9338 55.2796 32.7581 174.9617 37 I 5.2396 9.3294 124.6447 59.5385 41.1744 174.5410 38 R 5.0129 8.9158 120.5647 54.2468 33.3413 173.7288 39 K 4.8015 8.8135 122.0390 54.7177 34.9180 176.0174 40 F 4.9030 9.1398 126.7011 55.9742 39.9688 174.6797 41 P 4.3709 0.0000 0.0000 65.5493 31.3188 177.5061 42 G 4.1021 7.9828 106.3721 45.7700 0.0000 172.6673 43 N 4.1436 7.6006 109.1556 54.0798 37.2626 174.7312 44 R 4.6477 8.0523 117.9614 54.8073 32.1722 174.3408 45 L 5.1174 8.6124 126.4293 53.3893 43.8713 175.6925 46 E 4.7498 9.0474 123.3123 54.6026 33.0934 173.6663 47 Y 4.5340 8.9222 128.5439 57.4527 38.9322 174.7759 48 M 4.4420 9.3259 128.2475 56.6273 33.5284 177.0861 49 G 4.9452 7.9034 104.7373 47.0476 0.0000 170.3060 50 Y 5.9328 8.3054 117.0771 55.7539 42.0460 174.1562 51 V 4.9642 9.3004 120.6673 60.1091 34.2887 175.8328 52 S 4.2699 8.5596 119.8727 55.9326 64.9294 174.3463 53 Y 4.1628 7.8315 118.1714 60.0594 37.3367 177.7817 54 S 3.6371 7.1057 112.8144 58.7872 63.5075 174.8759 55 G 3.9443 7.8530 109.9407 44.9505 0.0000 174.2607 56 S 4.0709 7.5835 115.3961 58.3360 63.5815 173.2496 57 T 4.7869 7.6355 111.9433 60.0042 71.9223 172.7319 58 Y 4.1893 7.9150 119.3738 56.4222 41.4173 174.0276 59 Y 5.5940 8.3689 121.5579 55.8763 41.2735 175.1500 60 N 4.6313 9.4056 122.8664 53.0926 39.6887 174.2544 61 P 4.3716 0.0000 0.0000 65.3517 31.7546 178.5449 62 S 4.2124 8.6369 112.6607 61.0066 63.0362 175.1348 63 L 4.3212 8.4583 119.7563 54.2057 41.5455 176.8086 64 K 3.6029 8.7369 117.3225 57.5547 30.2242 174.3753 65 S 3.7084 8.1028 106.5362 59.8428 60.8427 171.8909 66 R 4.4574 7.8965 115.9316 55.7177 31.2857 176.0004 67 I 4.7512 7.3023 119.4337 59.3097 40.1862 174.5949 68 S 4.5202 8.6480 121.8429 56.6282 65.9106 172.4206 69 I 5.7112 9.5114 127.9981 59.0668 39.5331 174.9116 70 T 5.0325 8.9253 115.7971 60.0818 72.8209 172.5640 71 R 5.1247 8.6658 119.1658 54.6663 34.7112 175.3392 72 D 4.5987 9.0535 120.4374 53.0184 43.3247 176.0067 73 T 3.9393 8.7602 124.0236 66.4756 68.8666 177.1528 74 S 4.1532 8.2855 114.5918 60.6908 62.8773 174.9848 75 K 4.2817 8.2876 117.4121 55.0894 33.0495 175.2751 76 N 4.1036 7.9387 117.4542 54.6613 37.8254 172.6214 77 Q 4.9360 7.8347 114.4165 54.3242 34.2078 174.9527 78 Y 4.8727 7.9891 117.6571 55.5601 42.2603 173.5610 79 Y 5.5881 9.5312 116.9968 56.2983 43.0429 174.1702 80 L 4.9407 8.6371 121.8856 53.3523 45.2074 174.7350 81 D 5.2182 8.9736 125.8229 52.2942 44.4552 174.6775 82 L 5.0006 8.9296 125.1103 53.2769 44.6871 175.5085 83 N 4.6876 9.2346 124.6161 52.5551 39.6078 175.4803 84 S 3.7701 8.2027 114.2606 58.6332 60.6102 172.7890 85 V 4.0751 7.7382 114.3907 61.6893 32.6059 176.0202 86 T 4.9159 8.8343 111.4770 59.7713 72.2203 174.9490 87 T 4.0591 8.4015 110.4371 64.4497 68.6040 175.6635 88 E 4.1894 8.0056 120.3051 58.0627 29.4908 176.9455 89 D 4.9881 8.2182 118.2952 54.2713 41.4292 176.7303 90 T 4.1864 7.9314 117.3657 63.8117 68.8198 173.4323 91 A 4.3917 8.4538 126.7518 52.0817 23.9211 174.5792 92 T 4.6708 8.1617 116.2817 62.8095 70.0838 174.1101 93 Y 4.9665 8.9759 125.0106 56.6970 40.2370 174.5041 94 Y 5.6057 9.7140 121.1618 56.4322 42.3615 172.0788 95 C 4.8847 9.4519 117.4100 53.9793 44.2090 172.4274 96 A 4.9039 7.9805 120.0031 50.8644 22.6551 175.6477 97 N 4.6312 8.6590 117.4820 52.0353 38.5282 175.8417 98 W 4.0791 8.4164 130.6426 60.9344 30.5604 177.3185 99 D 4.0876 8.1232 117.9663 55.5022 40.4242 177.4244 100 G 3.9057 7.8323 106.2929 45.5739 0.0000 174.0903 101 D 4.3521 7.5711 119.7803 55.7349 41.4271 176.2041 102 Y 5.1067 7.4910 116.6402 55.8894 40.4790 174.5246 103 W 5.3203 8.9526 123.7235 54.6565 32.8032 175.4483 104 G 4.2169 8.9731 111.5599 44.4415 0.0000 174.0114 105 Q 4.1376 8.6002 116.6315 57.2196 29.0055 177.2769 106 G 3.7564 9.7540 106.1272 45.9516 0.0000 172.6276 107 T 4.5569 8.5514 116.1684 59.8283 70.7926 172.5146 108 L 4.6418 8.6824 131.4241 54.9343 43.2046 175.8038 109 V 4.5877 9.0486 126.2563 61.4542 34.4345 173.9769 110 T 4.8816 9.0166 125.0724 61.7943 71.0863 173.4264 111 V 4.8610 8.5718 127.3183 61.5124 32.7351 175.0100 112 S 4.7848 8.8210 121.4234 56.9363 66.0811 175.5039 113 A 4.0690 8.9284 124.0186 54.2973 18.5226 177.6419 114 A 4.3039 7.4082 121.9644 52.2332 19.1270 176.7831 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 D 8.22 4.62 0.00 2.68 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 2 V 7.91 4.22 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 0.00 0.00 0.53 0.00 0.00 0.73 0.00 0.00 3 Q 9.83 4.66 0.00 1.94 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.50 0.00 0.00 0.00 0.00 0.00 2.26 2.29 0.00 4 L 8.57 5.23 0.00 1.70 1.53 1.11 0.92 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 5 Q 8.48 4.54 0.00 2.17 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.26 2.39 0.00 6 E 8.93 5.14 0.00 1.95 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 2.56 2.45 0.00 7 S 9.12 4.61 0.00 3.85 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 8 G 8.69 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 0.00 0.00 0.00 0.00 9 P 0.00 4.35 0.00 2.13 2.02 0.00 3.83 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.88 0.00 10 S 8.52 4.72 0.00 4.00 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 11 L 7.73 5.20 0.00 1.59 1.52 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 12 V 8.76 4.62 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 0.64 0.00 0.00 0.96 0.00 0.00 13 K 9.17 5.00 0.00 1.62 1.69 0.00 1.69 0.00 0.00 1.85 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.53 7.81 14 P 0.00 4.49 0.00 2.03 2.00 0.00 3.72 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 2.03 2.12 0.00 15 S 9.51 4.16 0.00 4.02 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 16 Q 7.63 4.34 0.00 2.13 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.82 0.00 0.00 0.00 0.00 0.00 2.54 2.29 0.00 17 T 8.13 4.87 4.18 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 1.23 0.00 0.00 18 L 8.84 4.30 0.00 1.59 1.37 0.67 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.43 5.12 0.00 3.62 3.59 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 0.00 0.00 0.00 0.00 20 L 8.72 4.96 0.00 0.97 1.09 0.69 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 21 T 9.05 5.18 4.34 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 1.31 0.00 0.00 22 C 8.75 5.12 0.00 2.06 1.54 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 23 S 8.99 4.85 0.00 3.73 3.70 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 24 V 8.07 4.79 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 0.62 0.00 0.00 0.21 0.00 0.00 25 T 8.97 4.53 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 1.18 0.00 0.00 26 G 9.21 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 D 7.29 4.42 0.00 2.60 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 28 S 8.22 4.43 0.00 3.94 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 29 I 8.28 4.21 1.72 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 1.46 0.76 0.39 0.00 0.00 30 T 7.97 4.30 4.35 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 1.29 0.00 0.00 31 S 7.66 4.75 0.00 4.14 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 32 D 7.71 4.17 0.00 2.34 1.54 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 33 F 7.58 5.05 0.00 2.65 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 34 W 8.98 4.98 0.00 2.48 1.74 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 0.00 35 S 9.27 5.66 0.00 3.67 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 36 W 9.20 5.53 0.00 3.46 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 37 I 9.33 5.24 2.05 0.00 0.00 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 -0.27 1.09 0.00 0.00 38 R 8.92 5.01 0.00 0.99 1.23 0.00 2.21 0.00 0.00 2.66 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.78 0.00 39 K 8.81 4.80 0.00 1.93 1.80 0.00 1.68 0.00 0.00 1.74 0.00 0.00 2.89 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.41 7.81 40 F 9.14 4.90 0.00 3.13 2.92 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 41 P 0.00 4.37 0.00 2.10 2.21 0.00 3.87 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 42 G 7.98 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 0.00 0.00 0.00 43 N 7.60 4.14 0.00 2.96 2.92 0.00 0.00 6.61 7.54 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 44 R 8.05 4.65 0.00 1.99 2.06 0.00 3.21 0.00 0.00 3.39 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.76 0.00 45 L 8.61 5.12 0.00 1.61 1.61 0.85 0.89 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 46 E 9.05 4.75 0.00 2.26 1.75 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 2.36 2.42 0.00 47 Y 8.92 4.53 0.00 3.17 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 48 M 9.33 4.44 0.00 2.25 2.52 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.61 0.00 49 G 7.90 4.95 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 0.00 0.00 0.00 50 Y 8.31 5.93 0.00 3.42 3.43 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 51 V 9.30 4.96 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 0.94 0.00 0.00 0.97 0.00 0.00 52 S 8.56 4.27 0.00 2.72 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 53 Y 7.83 4.16 0.00 3.20 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 54 S 7.11 3.64 0.00 3.62 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 55 G 7.85 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 0.00 0.00 0.00 56 S 7.58 4.07 0.00 3.68 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 57 T 7.64 4.79 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 58 Y 7.91 4.19 0.00 1.94 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.37 5.59 0.00 2.90 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 60 N 9.41 4.63 0.00 3.25 2.88 0.00 0.00 7.13 8.11 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 61 P 0.00 4.37 0.00 2.28 2.16 0.00 3.76 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.18 0.00 62 S 8.64 4.21 0.00 4.05 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 63 L 8.46 4.32 0.00 1.86 1.75 1.08 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 64 K 8.74 3.60 0.00 1.86 1.86 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.97 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.59 1.52 7.81 65 S 8.10 3.71 0.00 4.01 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 66 R 7.90 4.46 0.00 1.84 2.00 0.00 3.39 0.00 0.00 3.10 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.70 0.00 67 I 7.30 4.75 1.73 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.78 0.39 0.00 0.00 68 S 8.65 4.52 0.00 3.83 3.57 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.51 5.71 2.33 0.00 0.00 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 1.37 2.32 1.45 0.00 0.00 70 T 8.93 5.03 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 1.33 0.00 0.00 71 R 8.67 5.12 0.00 1.74 1.87 0.00 3.26 0.00 0.00 3.28 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 72 D 9.05 4.60 0.00 3.00 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 73 T 8.76 3.94 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 74 S 8.29 4.15 0.00 3.99 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 8.29 4.28 0.00 1.84 1.91 0.00 1.92 0.00 0.00 1.67 0.00 0.00 3.18 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.40 7.81 76 N 7.94 4.10 0.00 2.88 2.73 0.00 0.00 6.87 6.83 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 77 Q 7.83 4.94 0.00 1.65 1.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.45 0.00 0.00 0.00 0.00 0.00 2.18 2.35 0.00 78 Y 7.99 4.87 0.00 3.15 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 79 Y 9.53 5.59 0.00 2.92 2.94 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 80 L 8.64 4.94 0.00 0.27 0.13 0.66 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.97 5.22 0.00 2.51 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 82 L 8.93 5.00 0.00 1.57 1.39 0.92 0.71 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 83 N 9.23 4.69 0.00 2.57 2.69 0.00 0.00 7.31 7.28 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 84 S 8.20 3.77 0.00 3.92 3.84 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 85 V 7.74 4.08 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 0.79 0.00 0.00 0.94 0.00 0.00 86 T 8.83 4.92 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 87 T 8.40 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 1.29 0.00 0.00 88 E 8.01 4.19 0.00 2.03 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 2.40 0.00 89 D 8.22 4.99 0.00 2.87 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 90 T 7.93 4.19 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 1.32 0.00 0.00 91 A 8.45 4.39 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 T 8.16 4.67 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 0.71 0.00 0.00 93 Y 8.98 4.97 0.00 2.92 3.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 9.71 5.61 0.00 3.15 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 C 9.45 4.88 0.00 2.10 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 A 7.98 4.90 -0.22 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 97 N 8.66 4.63 0.00 2.32 2.87 0.00 0.00 6.89 8.31 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 98 W 8.42 4.08 0.00 3.24 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 99 D 8.12 4.09 0.00 2.70 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 0.00 100 G 7.83 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 D 7.57 4.35 0.00 1.70 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 0.00 0.00 0.00 102 Y 7.49 5.11 0.00 3.10 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 0.00 103 W 8.95 5.32 0.00 3.22 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 0.00 104 G 8.97 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 0.00 105 Q 8.60 4.14 0.00 2.25 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.42 0.00 0.00 0.00 0.00 0.00 2.54 2.41 0.00 106 G 9.75 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 0.00 107 T 8.55 4.56 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 1.30 0.00 0.00 108 L 8.68 4.64 0.00 1.68 1.57 0.96 0.93 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 0.00 109 V 9.05 4.59 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 0.72 0.00 0.00 110 T 9.02 4.88 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 1.24 0.00 0.00 111 V 8.57 4.86 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 0.78 0.00 0.00 0.97 0.00 0.00 112 S 8.82 4.78 0.00 3.91 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 0.00 113 A 8.93 4.07 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 0.00 114 A 7.41 4.30 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