NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 28 K 4.3586 8.2993 120.1428 55.9425 34.9412 175.2925 29 P 4.8156 0.0000 0.0000 62.8261 33.0285 173.0976 30 A 5.6378 9.5966 124.2008 51.5227 23.7553 176.0862 31 A 4.4412 8.8488 120.7415 50.6817 23.3358 175.0839 32 H 4.7373 8.1516 119.9271 54.4229 33.2571 172.2359 33 L 5.2789 8.9132 125.4530 52.7826 45.7969 175.5457 34 I 5.2226 8.3459 114.5234 58.9205 40.8597 174.9942 35 G 3.8240 9.1219 112.1087 46.0443 0.0000 172.8772 36 D 4.7027 9.2071 125.6619 53.3649 41.6579 175.0335 37 P 4.5003 0.0000 0.0000 64.1007 31.5576 177.0600 38 S 4.3166 8.2978 113.3475 58.8964 63.6683 174.2518 39 K 4.3185 7.5362 121.2241 54.8672 31.5177 176.4539 40 Q 4.0819 8.6127 123.5004 58.1500 28.9211 176.7269 41 N 4.8171 8.0428 112.5706 52.6971 39.6698 173.4627 42 S 4.5575 7.6301 111.5981 56.2490 65.7654 173.1102 43 L 4.1521 8.0624 125.1023 52.9660 41.7672 174.1590 44 L 4.6281 7.6105 124.9135 52.4188 43.8877 175.7223 45 W 5.4030 8.9847 124.7406 56.3713 30.4038 175.9623 46 R 4.8463 9.2560 118.6533 54.5964 32.9460 175.0210 47 A 4.7472 8.5730 120.5951 51.9879 19.8827 176.1884 48 N 4.9140 8.3526 113.3815 53.7281 37.9231 174.3338 49 T 4.7485 7.1463 108.1424 60.8252 72.9125 174.0394 50 D 4.1117 8.3863 121.2441 56.4043 39.2840 174.9155 51 R 4.5367 8.6518 125.7007 57.1609 30.2723 176.0958 52 A 4.6445 7.7290 119.9293 52.2440 19.3373 177.3760 53 F 4.7771 8.3129 113.2930 56.5817 41.7512 172.7592 54 L 5.3298 8.7512 118.5554 53.3323 45.6023 176.0117 55 Q 4.6308 9.3023 119.4199 55.7369 32.4459 174.1071 56 D 4.7174 9.6497 119.3100 56.3071 38.0527 174.8794 57 G 4.0848 8.6576 107.8079 45.4385 0.0000 175.1658 58 F 4.4954 7.9662 118.0508 57.8215 39.9036 174.6916 59 S 4.7013 8.6017 112.0587 57.5024 67.0137 173.0845 60 L 5.5452 8.8221 120.6192 52.6172 42.8209 176.1544 61 S 4.5684 8.3072 118.0191 57.1327 66.3888 174.7056 62 N 3.9937 9.0545 116.5915 56.0185 34.6288 173.5430 63 N 4.3976 8.0068 112.9101 54.4605 38.6530 173.1263 64 S 5.1560 8.8361 110.8306 56.2112 67.4431 172.9102 65 L 4.9691 8.7803 122.3488 53.4705 43.1221 175.2996 66 L 4.8785 8.5953 126.0164 53.3696 44.0312 175.4963 67 V 3.6446 8.6407 128.0401 62.0526 31.7125 175.1575 68 P 4.3575 0.0000 0.0000 65.3724 31.6657 176.4497 69 T 4.7228 7.2386 105.1904 59.5022 71.8175 173.6781 70 S 4.4860 8.6517 118.8546 57.8779 63.7901 175.0936 71 G 3.8823 7.9057 110.3872 45.8434 0.0000 170.2524 72 I 5.0462 7.4651 119.8265 60.1102 39.1509 174.8419 73 Y 5.1753 9.2631 124.2302 56.1294 42.2029 174.1539 74 F 4.8608 8.9547 125.8456 56.8741 41.2359 174.4974 75 V 4.8636 8.2067 126.5598 61.1968 34.3062 173.7957 76 Y 5.3771 8.5639 124.5986 56.0999 42.1180 173.6232 77 S 5.0545 8.4771 113.1202 57.6592 66.6656 173.1362 78 Q 4.8360 8.4362 125.4300 54.5443 32.7291 174.0578 79 V 4.5375 8.3802 116.7980 59.5825 36.6200 174.4564 80 V 4.7356 7.7803 121.6673 61.2367 34.8367 174.2007 81 F 5.7125 9.3361 125.7215 56.2214 42.8386 174.1022 82 S 4.6223 7.9933 114.7762 57.1415 66.5844 172.7228 83 G 3.4914 6.5438 105.8892 46.1848 0.0000 172.5604 84 K 4.6604 8.4985 119.3081 55.4220 33.8970 174.7862 85 A 4.2101 8.7281 132.0552 52.7147 18.5483 177.4830 86 Y 4.0282 8.8216 121.4308 59.3710 38.7971 175.9272 87 S 4.9269 7.7435 112.8780 55.3760 66.3645 173.1778 88 P 4.3016 0.0000 0.0000 65.4667 31.6266 179.1645 89 K 3.9322 8.2893 117.5266 59.4163 32.0561 178.8816 90 A 4.1475 7.6744 120.2396 54.7386 18.3404 178.2391 91 T 4.4201 7.4230 110.5148 64.6042 68.7339 176.3999 92 S 4.2416 7.5625 118.0745 60.6303 63.2703 174.2063 93 S 4.6876 7.5442 117.1001 56.3330 64.2827 172.4578 94 P 4.2602 0.0000 0.0000 62.5507 32.6038 174.9145 95 L 4.5991 8.3151 119.5116 52.9499 44.4169 175.2288 96 Y 4.7476 8.4572 124.7403 56.0876 40.2979 174.4078 97 L 4.5134 8.0318 126.2341 52.6697 45.0203 175.4153 98 A 5.1073 8.4474 123.7068 50.9679 23.1186 174.4535 99 H 5.4501 9.1377 119.4372 54.8398 34.0763 171.7881 100 E 5.0626 8.5212 122.5845 55.1564 33.8519 173.6418 101 V 4.5502 8.6424 126.5425 61.3563 33.5496 174.5474 102 Q 5.1375 9.2780 126.7025 54.0137 32.4338 174.1337 103 L 5.0956 9.0640 123.2245 53.3322 45.3685 175.1606 104 F 4.8880 9.2744 127.6270 56.6641 41.5669 173.3389 105 S 5.2243 8.1492 120.5645 55.2440 64.9394 174.9259 106 S 4.0718 8.5247 118.1343 60.3623 63.0869 175.4591 107 Q 4.1023 7.5732 119.4581 58.2444 28.9580 175.6953 108 Y 4.7022 7.4404 119.0321 55.3741 41.9099 173.3329 109 P 4.2467 0.0000 0.0000 63.7516 31.5268 175.8026 110 F 5.4677 6.7658 116.0197 55.8240 42.0018 174.5257 111 H 4.8909 9.1078 120.0775 56.0707 29.4727 175.0883 112 V 4.5234 8.8975 122.6602 60.3633 34.5079 172.8142 113 P 4.6584 0.0000 0.0000 62.8612 31.2658 175.9190 114 L 4.3745 8.9414 124.3654 55.7982 43.4752 177.2234 115 L 4.7887 7.4263 116.9594 53.3284 46.2250 175.6108 116 S 5.1547 8.5384 117.7142 57.1470 67.2825 173.5360 117 S 4.8884 9.4068 119.5441 56.9715 66.3659 173.2062 118 Q 5.0422 8.6166 121.5812 54.4357 32.8958 174.3249 119 K 4.4876 8.4062 120.6654 55.5905 36.2617 173.8037 120 M 4.8449 8.5304 125.9080 53.6452 34.5030 174.6781 121 V 3.9902 8.2615 126.0481 61.2405 34.3316 173.9935 122 Y 4.5724 8.2294 125.6346 55.1462 38.0380 173.1037 123 P 4.2676 0.0000 0.0000 62.4313 32.1885 176.5314 124 G 4.6163 8.3666 110.3120 42.6454 0.0000 172.6503 125 L 3.9352 8.2214 123.1212 56.3070 41.8962 177.1497 126 Q 3.6549 8.8110 127.5052 55.9710 29.6108 172.8194 127 E 4.3722 7.5844 116.8971 54.9575 30.0426 173.8736 128 P 5.0150 0.0000 0.0000 62.3669 32.5121 175.6379 129 W 5.0843 8.2824 118.8639 54.9430 31.4577 174.5347 130 L 5.2772 8.6177 120.2843 53.7631 44.9994 175.1233 131 H 5.1918 9.7820 122.9048 54.6329 33.8038 172.0072 132 S 5.2375 8.4053 118.9686 57.0570 66.3731 173.3343 133 M 4.9676 9.0231 122.0007 53.8983 35.9643 173.7862 134 Y 5.2448 8.5949 122.8897 56.5011 42.6519 173.6031 135 H 4.9327 7.5099 118.4185 54.8996 32.2659 172.5864 136 G 4.9031 8.5930 104.2671 45.2923 0.0000 171.9965 137 A 4.6208 7.4593 122.8124 50.8438 23.0242 174.3766 138 A 5.0719 7.9161 120.5365 50.5393 20.9451 176.5272 139 F 4.9299 9.2189 119.4856 55.9524 44.2793 174.3216 140 Q 4.8723 8.9560 120.1358 55.2771 28.8232 175.3271 141 L 4.7986 9.3437 125.0051 53.4130 44.9419 176.0461 142 T 4.8241 8.9793 117.4983 61.2614 70.8678 174.1705 143 Q 4.2508 8.4662 126.5467 58.2124 29.4320 176.4206 144 G 4.0868 9.2079 113.0265 45.4233 0.0000 173.7835 145 D 4.7332 7.8712 118.8843 54.9270 42.3058 175.7709 146 Q 5.0632 9.1192 119.4730 54.2130 32.4252 174.4083 147 L 5.2708 8.9075 123.8046 53.1714 44.3150 175.8321 148 S 5.2424 9.1880 117.5662 57.2409 67.1793 172.6085 149 T 5.0158 8.4072 109.3580 60.1091 71.7374 172.7752 150 H 4.9805 9.0230 121.9748 54.8486 33.3919 172.1405 151 T 5.0921 8.3111 120.7656 61.8917 72.2717 172.9507 152 D 4.6266 9.3817 126.4581 55.4385 42.8702 175.8746 153 G 3.9651 9.3828 113.0678 45.4084 0.0000 174.5695 154 I 3.7355 8.4501 123.6490 64.0028 37.0642 176.3873 155 P 4.3283 0.0000 0.0000 65.0719 31.3583 176.4292 156 H 4.9831 8.6865 114.9665 55.4091 29.9611 174.6323 157 L 4.2939 7.9757 119.0157 54.9109 42.2612 177.7082 158 V 4.0192 8.2509 123.9663 61.2737 31.1310 174.5080 159 L 4.1894 8.1965 126.3744 54.2675 41.5442 176.7784 160 S 4.7225 8.2309 116.5063 56.0764 65.9321 173.8880 161 P 4.4755 0.0000 0.0000 65.2804 31.1663 177.2739 162 S 4.6781 8.1442 111.8663 58.9146 63.8721 174.3561 163 T 4.4815 7.7078 109.6098 62.2255 70.7495 174.5340 164 V 4.5761 8.1993 122.7839 60.8835 33.7415 174.4892 165 F 5.8611 8.2778 122.0278 55.8712 42.4195 173.0353 166 F 5.0808 8.9474 119.7622 57.3280 42.9715 173.0382 167 G 3.4908 8.3060 111.4763 45.7824 0.0000 171.3679 168 A 5.1980 7.9512 120.1454 51.0911 23.2079 175.4295 169 F 5.7631 8.8109 113.0159 55.6792 41.6408 173.6041 170 A 4.0113 9.0668 124.3080 51.6390 19.0791 177.6869 171 L 4.2919 8.5956 121.1139 55.0661 41.8007 176.9211 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 28 K 8.30 4.36 0.00 1.79 2.03 0.00 1.72 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.36 1.45 7.81 29 P 0.00 4.82 0.00 2.10 2.36 0.00 3.75 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.06 0.00 30 A 9.60 5.64 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 0.00 0.00 0.00 0.00 0.00 31 A 8.85 4.44 0.47 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 32 H 8.15 4.74 0.00 2.87 2.67 0.00 5.72 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.91 5.28 0.00 1.33 1.54 0.53 0.30 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 34 I 8.35 5.22 2.05 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.04 1.01 0.00 0.00 35 G 9.12 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 36 D 9.21 4.70 0.00 2.75 2.54 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 37 P 0.00 4.50 0.00 2.21 2.27 0.00 3.82 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.96 0.00 38 S 8.30 4.32 0.00 3.99 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 K 7.54 4.32 0.00 1.71 1.75 0.00 1.68 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.50 1.44 7.81 40 Q 8.61 4.08 0.00 2.12 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.87 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 41 N 8.04 4.82 0.00 2.67 2.82 0.00 0.00 6.59 7.57 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 42 S 7.63 4.56 0.00 3.70 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 43 L 8.06 4.15 0.00 1.31 1.27 -0.04 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 44 L 7.61 4.63 0.00 1.53 1.47 0.84 0.91 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 45 W 8.98 5.40 0.00 3.25 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 R 9.26 4.85 0.00 1.89 2.03 0.00 2.75 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.77 0.00 47 A 8.57 4.75 1.24 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 0.00 0.00 48 N 8.35 4.91 0.00 2.86 2.95 0.00 0.00 5.95 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 49 T 7.15 4.75 4.28 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 1.24 0.00 0.00 50 D 8.39 4.11 0.00 2.89 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 51 R 8.65 4.54 0.00 1.87 2.02 0.00 3.37 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 52 A 7.73 4.64 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 53 F 8.31 4.78 0.00 3.10 3.19 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 54 L 8.75 5.33 0.00 1.58 1.65 0.96 0.76 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 55 Q 9.30 4.63 0.00 2.24 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.18 0.00 0.00 0.00 0.00 0.00 2.74 2.57 0.00 56 D 9.65 4.72 0.00 2.96 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 57 G 8.66 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.97 4.50 0.00 3.04 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 59 S 8.60 4.70 0.00 3.95 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 60 L 8.82 5.55 0.00 1.56 1.70 1.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 61 S 8.31 4.57 0.00 3.99 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 62 N 9.05 3.99 0.00 2.81 3.22 0.00 0.00 7.00 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 N 8.01 4.40 0.00 2.82 2.91 0.00 0.00 7.07 7.63 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 64 S 8.84 5.16 0.00 3.87 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 65 L 8.78 4.97 0.00 1.46 1.50 -0.29 -0.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.60 4.88 0.00 1.94 1.57 0.96 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.64 3.64 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 0.43 0.00 0.00 0.79 0.00 0.00 68 P 0.00 4.36 0.00 2.11 2.15 0.00 2.97 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.42 0.00 69 T 7.24 4.72 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 1.20 0.00 0.00 70 S 8.65 4.49 0.00 3.91 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 71 G 7.91 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 0.00 0.00 0.00 72 I 7.47 5.05 1.84 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.59 0.99 0.00 0.00 73 Y 9.26 5.18 0.00 2.95 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 F 8.95 4.86 0.00 2.68 1.50 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 75 V 8.21 4.86 2.15 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 0.96 0.00 0.00 0.97 0.00 0.00 76 Y 8.56 5.38 0.00 3.16 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 77 S 8.48 5.05 0.00 3.88 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 78 Q 8.44 4.84 0.00 2.12 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.50 0.00 0.00 0.00 0.00 0.00 2.16 2.60 0.00 79 V 8.38 4.54 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 0.08 0.00 0.00 0.78 0.00 0.00 80 V 7.78 4.74 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 1.14 0.00 0.00 0.91 0.00 0.00 81 F 9.34 5.71 0.00 3.28 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 S 7.99 4.62 0.00 3.44 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 83 G 6.54 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 84 K 8.50 4.66 0.00 1.63 1.69 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.13 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.97 1.38 7.81 85 A 8.73 4.21 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 86 Y 8.82 4.03 0.00 3.00 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 87 S 7.74 4.93 0.00 3.99 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 88 P 0.00 4.30 0.00 2.22 2.16 0.00 3.63 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.13 0.00 89 K 8.29 3.93 0.00 1.84 1.88 0.00 1.69 0.00 0.00 1.84 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.55 1.47 7.81 90 A 7.67 4.15 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 91 T 7.42 4.42 4.40 0.00 0.00 0.00 0.00 0.00 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 92 S 7.56 4.24 0.00 3.85 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 93 S 7.54 4.69 0.00 3.83 3.74 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 94 P 0.00 4.26 0.00 1.38 0.49 0.00 3.67 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.89 0.00 95 L 8.32 4.60 0.00 1.23 1.12 0.84 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 96 Y 8.46 4.75 0.00 2.80 2.79 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.03 4.51 0.00 1.06 0.43 0.57 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 98 A 8.45 5.11 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 99 H 9.14 5.45 0.00 3.31 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 E 8.52 5.06 0.00 2.08 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 2.18 2.38 0.00 101 V 8.64 4.55 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 0.67 0.00 0.00 0.75 0.00 0.00 102 Q 9.28 5.14 0.00 2.03 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.26 2.23 0.00 103 L 9.06 5.10 0.00 1.54 1.38 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 104 F 9.27 4.89 0.00 2.96 2.90 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 0.00 105 S 8.15 5.22 0.00 3.82 3.53 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 0.00 106 S 8.52 4.07 0.00 3.93 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 0.00 107 Q 7.57 4.10 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.36 2.24 0.00 108 Y 7.44 4.70 0.00 2.73 2.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.25 0.00 1.36 1.68 0.00 2.63 0.00 0.00 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.15 0.00 110 F 6.77 5.47 0.00 3.32 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 H 9.11 4.89 0.00 3.13 3.34 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 V 8.90 4.52 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 0.95 0.00 0.00 1.09 0.00 0.00 113 P 0.00 4.66 0.00 1.96 1.96 0.00 3.71 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 114 L 8.94 4.37 0.00 1.18 0.79 0.44 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 115 L 7.43 4.79 0.00 1.18 1.12 0.90 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 116 S 8.54 5.15 0.00 3.72 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 0.00 117 S 9.41 4.89 0.00 3.80 3.79 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.62 5.04 0.00 1.93 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.66 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 119 K 8.41 4.49 0.00 1.81 1.42 0.00 1.36 0.00 0.00 1.43 0.00 0.00 2.61 0.00 0.00 2.62 0.00 0.00 0.00 0.00 0.92 1.16 7.81 120 M 8.53 4.84 0.00 2.01 1.91 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.46 0.00 121 V 8.26 3.99 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 -0.50 0.00 0.00 0.36 0.00 0.00 122 Y 8.23 4.57 0.00 2.84 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.27 0.00 2.06 2.11 0.00 3.54 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.63 0.00 124 G 8.37 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.22 3.94 0.00 1.61 1.63 0.93 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 126 Q 8.81 3.65 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.56 0.00 0.00 0.00 0.00 0.00 2.15 2.20 0.00 127 E 7.58 4.37 0.00 2.17 1.90 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 2.30 2.40 0.00 128 P 0.00 5.02 0.00 1.97 1.96 0.00 3.71 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.93 0.00 129 W 8.28 5.08 0.00 3.52 3.23 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 0.00 130 L 8.62 5.28 0.00 1.56 1.65 0.93 1.02 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 0.00 131 H 9.78 5.19 0.00 3.43 3.40 0.00 5.72 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 132 S 8.41 5.24 0.00 3.74 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 0.00 133 M 9.02 4.97 0.00 1.98 1.98 0.00 0.00 0.00 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.60 0.00 134 Y 8.59 5.24 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 0.00 135 H 7.51 4.93 0.00 3.21 3.34 0.00 5.37 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.59 4.90 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 0.00 0.00 0.00 137 A 7.46 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.92 5.07 1.21 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 0.00 0.00 139 F 9.22 4.93 0.00 2.92 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 0.00 140 Q 8.96 4.87 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.84 0.00 0.00 0.00 0.00 0.00 2.36 2.44 0.00 141 L 9.34 4.80 0.00 1.71 1.54 0.73 0.57 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 0.00 142 T 8.98 4.82 4.53 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 1.20 0.00 0.00 143 Q 8.47 4.25 0.00 2.07 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.51 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 144 G 9.21 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 D 7.87 4.73 0.00 2.61 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 0.00 146 Q 9.12 5.06 0.00 2.10 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.44 0.00 147 L 8.91 5.27 0.00 1.64 1.72 0.80 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 148 S 9.19 5.24 0.00 3.88 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 0.00 149 T 8.41 5.02 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 0.30 0.00 0.00 150 H 9.02 4.98 0.00 3.20 3.11 0.00 5.72 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 151 T 8.31 5.09 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 1.46 0.00 0.00 152 D 9.38 4.63 0.00 2.58 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 0.00 153 G 9.38 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 0.00 0.00 0.00 154 I 8.45 3.74 1.87 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.13 0.92 0.00 0.00 155 P 0.00 4.33 0.00 1.93 2.06 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.10 0.00 156 H 8.69 4.98 0.00 3.51 3.64 0.00 5.62 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 L 7.98 4.29 0.00 1.47 1.40 0.77 -0.01 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 0.00 158 V 8.25 4.02 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 0.73 0.00 0.00 0.87 0.00 0.00 159 L 8.20 4.19 0.00 1.63 1.59 0.83 0.73 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 0.00 160 S 8.23 4.72 0.00 4.04 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 0.00 161 P 0.00 4.48 0.00 2.28 2.31 0.00 3.80 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 2.05 2.14 0.00 162 S 8.14 4.68 0.00 4.08 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 T 7.71 4.48 4.24 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 1.25 0.00 0.00 164 V 8.20 4.58 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 1.06 0.00 0.00 0.84 0.00 0.00 165 F 8.28 5.86 0.00 3.31 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 0.00 166 F 8.95 5.08 0.00 1.51 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 0.00 167 G 8.31 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 0.00 168 A 7.95 5.20 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 169 F 8.81 5.76 0.00 3.33 3.36 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 0.00 170 A 9.07 4.01 0.93 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 0.00 0.00 171 L 8.60 4.29 0.00 1.60 1.64 0.97 1.01 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