NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3543 8.2649 123.5822 52.0641 20.2352 178.3090 3 R 3.8984 8.2951 121.6441 59.6191 30.0121 175.9326 4 R 4.2981 8.0587 116.1317 57.5440 32.5432 176.1780 5 R 3.9704 7.6068 115.7711 56.9694 30.7869 177.0193 6 R 4.3108 8.6463 121.5134 55.6508 30.1105 174.3320 7 A 3.6194 7.4219 122.8268 51.0659 18.5267 177.1009 8 E 4.5076 8.3609 116.4731 54.1155 31.3576 176.1037 9 V 3.6961 8.3158 123.7168 61.9036 31.2302 175.3395 10 R 3.8452 8.4850 127.6565 56.9088 30.2953 175.1380 11 Q 4.4605 8.3901 125.0845 54.3278 30.1387 175.3608 12 L 4.3014 8.3104 125.1551 54.4837 42.6511 176.0083 13 Q 4.4475 8.2890 119.4639 53.8055 29.8022 174.2294 14 P 4.2834 0.0000 0.0000 61.9109 32.5283 175.2034 15 D 4.6836 8.3463 118.2675 54.5027 41.6542 176.2945 16 L 4.9889 8.3363 122.9620 54.2247 42.2510 177.3138 17 V 4.5096 7.3751 117.3236 63.7412 37.3083 173.9342 18 Y 4.5014 8.0310 113.4268 55.9508 40.2253 174.3917 19 G 4.3998 8.2654 109.3029 44.2754 0.0000 171.6102 20 D 4.4533 7.6197 119.4360 52.5689 43.9954 176.4399 21 V 3.7068 7.9958 119.1735 63.9589 31.5785 178.6178 22 L 3.8545 7.7256 119.2002 58.6341 42.2895 179.2879 23 V 3.1370 8.9117 118.7608 65.8075 31.3681 177.7189 24 T 3.7213 7.8634 108.5145 64.9694 68.4039 175.3863 25 A 4.0291 8.0973 123.9397 55.0489 18.1337 179.4883 26 F 4.0711 8.0362 117.2956 61.3137 39.7264 177.1007 27 I 3.5373 7.8782 120.0211 64.1012 36.8678 177.8949 28 N 4.1927 8.7124 118.3138 56.5585 38.2420 177.3805 29 K 3.9183 7.5865 117.9478 59.5991 32.1214 178.7817 30 I 3.9872 7.1053 118.5480 62.0646 37.2279 175.7414 31 M 4.0116 7.8782 120.2169 55.3454 31.9713 175.0399 32 R 4.4289 8.3739 126.7545 55.8279 32.0941 175.1546 33 D 4.5022 9.0090 123.5426 54.8199 37.7245 176.4366 34 G 3.9743 8.2539 105.9106 46.4609 0.0000 176.3002 35 K 4.3135 7.5870 121.8842 55.8941 28.4630 176.6485 36 K 3.7463 7.9934 124.6525 58.9469 32.8023 176.9254 37 N 4.1595 8.2150 117.1290 57.0580 38.7759 176.2655 38 L 3.9929 7.9597 120.6066 57.7490 42.2397 178.2486 39 A 3.9000 7.4586 120.4287 55.3671 18.3050 179.3451 40 A 3.8285 8.2166 118.9635 55.4081 18.3329 179.7785 41 R 3.9630 7.9429 116.2915 59.5257 30.0159 178.8883 42 I 3.6941 8.1953 119.7318 64.8175 37.3765 178.0875 43 F 4.4171 8.1822 120.9124 61.4966 39.0457 176.8402 44 Y 4.0922 7.5062 115.7970 61.2367 37.6582 177.6230 45 D 4.4704 8.3795 118.4155 57.0366 41.1424 178.8596 46 A 4.1558 7.4487 120.0107 55.2627 18.7745 179.0674 47 C 3.8663 7.5052 114.9142 63.1446 28.1711 176.5226 48 K 3.9836 8.4874 121.3242 59.5373 31.4993 178.9620 49 I 3.8750 8.2968 120.3152 63.7969 36.3712 177.2538 50 I 4.4592 7.5245 120.0184 60.6011 36.8549 176.6738 51 Q 4.1352 8.1738 120.6584 56.7605 28.1100 176.3050 52 E 4.0359 9.1927 125.2675 59.6341 31.0751 177.1688 53 K 3.5569 7.3275 115.9657 58.5466 31.6481 176.3689 54 T 4.3630 8.3722 116.6852 60.0721 68.4449 174.8991 55 G 3.9942 8.4311 119.3995 45.9540 0.0000 171.4679 56 Q 4.5051 8.0344 122.2892 53.4285 33.6086 175.6982 57 E 4.2396 8.7752 120.3471 55.2835 29.8108 175.7803 58 P 4.2420 0.0000 0.0000 66.8715 31.0352 176.7904 59 L 3.7281 8.6064 116.2891 58.9726 41.7516 178.4611 60 K 3.9373 8.3075 117.6761 59.7441 32.3529 179.2312 61 V 3.5453 7.7477 118.0753 65.9306 31.4807 177.4152 62 F 4.0208 9.0761 121.2984 61.4533 39.1505 176.9559 63 K 3.7554 8.5633 119.1781 59.7653 32.1154 178.5451 64 Q 3.9721 8.6346 119.6827 58.8188 28.6554 177.8647 65 A 4.0821 8.0494 121.8536 55.0375 18.8105 179.0275 66 V 3.4557 7.5165 116.4120 66.2085 31.4363 177.8526 67 E 3.8263 8.0116 118.4967 59.4450 29.4289 178.3822 68 N 4.5414 7.7416 113.7253 54.9024 38.7286 175.5815 69 V 4.2869 7.2234 118.3772 62.2228 32.3098 175.6172 70 K 4.1871 8.4331 119.3504 55.0188 30.8405 174.7319 71 P 4.3819 0.0000 0.0000 63.3801 31.3516 176.9354 72 R 4.1977 8.7608 122.6595 59.2595 31.1585 176.1548 73 M 4.9711 7.8024 115.3474 54.6528 36.2570 173.6892 74 E 4.7986 8.6389 117.3434 54.9766 33.9642 174.8479 75 V 4.1465 8.4465 114.2862 61.2681 32.0679 175.9435 76 R 4.7560 8.9188 127.6554 54.0283 31.9769 175.2786 77 S 4.4062 8.9444 120.8526 59.4484 63.4263 173.6655 78 R 4.4078 9.2050 123.0659 54.5117 34.1294 174.0578 79 R 4.6098 7.8853 120.6230 55.2096 32.5486 174.2816 80 V 4.1144 7.9011 126.0039 62.2469 34.7282 174.7090 81 G 3.9871 8.8905 113.9446 47.0390 0.0000 174.0285 82 G 3.8266 8.3457 104.1166 45.4149 0.0000 173.6684 83 A 4.5813 7.2745 121.6173 49.8419 21.2732 175.2497 84 N 5.2621 8.4979 120.6494 51.7566 40.0770 173.7374 85 Y 4.7969 8.1897 123.6662 55.9760 41.0708 175.5294 86 Q 4.6519 7.9210 119.3667 55.1979 28.2769 176.7788 87 V 3.9318 8.0734 119.0318 63.5490 32.7108 173.6225 88 P 5.8400 0.0000 0.0000 60.4975 33.9717 173.9433 89 M 4.2247 8.4051 118.0760 54.7152 33.2507 173.8567 90 E 4.3747 8.6825 118.3467 56.3331 30.4254 177.1174 91 V 3.9992 8.1954 122.6843 61.3594 32.7863 176.1210 92 S 4.0593 8.6628 120.8852 58.3091 63.7315 172.9283 93 P 4.1256 0.0000 0.0000 66.3063 30.6805 178.5231 94 R 3.7869 7.8864 117.6611 59.2045 30.1060 178.1102 95 R 4.4013 7.8750 119.1734 58.9686 29.8648 177.9196 96 Q 3.8622 8.7478 118.2417 59.0637 28.6737 178.4835 97 Q 4.0922 8.1572 120.3638 59.4274 29.2119 178.6652 98 S 4.0044 8.3100 115.3389 61.7748 62.8499 176.5911 99 L 3.2556 8.2466 122.5156 56.6712 41.2725 179.0292 100 A 3.7834 8.2237 121.8759 55.4124 18.2616 179.8052 101 L 4.1011 8.0799 117.3976 57.8549 41.6543 179.4335 102 R 3.8041 7.6127 118.3021 59.4225 29.9622 178.5430 103 W 4.5729 7.7900 118.3427 59.8080 29.0531 177.8506 104 L 4.0685 7.9957 119.8026 58.5655 41.4201 179.1948 105 V 3.6301 8.3475 117.7309 66.4064 31.3362 177.7180 106 Q 3.9936 8.4526 116.4165 59.1318 28.8435 178.3330 107 A 4.1650 8.9986 121.2912 55.4962 17.9770 179.3106 108 A 4.0155 8.2354 119.0012 55.6493 18.2766 179.1559 109 N 4.5739 8.1774 111.9656 54.8921 38.8607 176.6203 110 Q 4.3301 7.9448 118.8078 55.9650 29.7482 176.3214 111 R 4.1426 6.9984 118.8266 55.9323 30.6425 174.4123 112 P 4.9353 0.0000 0.0000 63.2453 31.7612 175.8249 113 E 4.3461 7.6856 118.5649 56.7856 30.0690 177.4795 114 R 4.1049 8.5611 121.5715 57.5341 30.8763 176.5583 115 R 4.4836 7.6636 117.0649 53.6700 32.4527 175.7373 116 A 3.9846 8.9122 125.7102 55.5382 18.2877 179.0787 117 A 3.9884 7.9267 118.5074 55.4526 18.6504 180.1724 118 V 3.5768 7.8964 110.9032 64.4615 31.4102 178.7822 119 R 3.9312 7.9394 117.6695 59.3448 30.0477 178.6767 120 I 3.5017 7.8917 118.8709 64.9460 37.0796 177.9822 121 A 4.0630 8.0922 121.4469 55.1786 18.2522 179.0399 122 H 4.1627 9.0056 113.7118 58.9139 28.9104 177.4602 123 E 3.9476 9.0647 121.8711 59.6735 29.5175 179.0107 124 L 3.9915 8.0657 118.6344 57.9380 41.6998 179.5472 125 M 4.0751 8.2698 118.9744 58.7353 31.9591 178.6068 126 D 4.6156 8.7678 118.7190 56.8625 40.8200 178.7723 127 A 3.8757 8.3606 121.9761 54.7764 18.1433 179.5375 128 A 3.8813 7.8966 118.4700 55.3975 18.5998 179.2610 129 E 4.1326 7.7066 115.4549 59.6684 29.5827 178.5468 130 G 4.2985 7.2843 106.6151 45.7414 0.0000 174.0701 131 K 4.5503 8.8686 116.3227 55.5424 33.6404 176.6004 132 G 3.8008 7.9665 109.2633 45.6454 0.0000 175.1004 133 G 3.5901 8.7981 108.1339 47.6147 0.0000 175.9814 134 A 4.1603 7.9910 121.2736 54.6253 18.2634 179.8461 135 V 3.6158 7.9609 117.3990 65.8786 31.3212 178.3362 136 K 4.1770 7.8024 119.8759 58.7239 31.8283 179.3775 137 K 3.6552 7.6733 118.2668 58.9684 31.8922 178.9433 138 K 3.7911 7.5239 119.8969 59.6625 32.2173 178.2667 139 E 3.8694 8.2669 118.8116 59.5936 29.3020 178.6269 140 D 4.3934 8.9036 118.7704 57.7123 41.1820 178.8154 141 V 3.5401 8.1635 118.5969 66.0736 31.4729 177.9015 142 E 4.0010 8.1294 118.3058 59.4020 29.2517 179.2981 143 R 3.9682 8.0913 118.1413 59.6708 30.0114 178.6101 144 M 4.1688 7.8243 118.0583 58.4389 31.7771 178.2038 145 A 4.0201 7.6186 119.4688 55.5274 18.7429 178.7336 146 E 3.9956 8.7055 117.2464 59.6850 29.4567 178.4669 147 A 4.0264 8.4264 119.7246 55.5918 18.4942 180.3088 148 N 4.7893 8.6488 114.3888 53.5564 39.3538 177.2529 149 R 4.1241 7.8263 120.9593 58.2203 30.2095 176.6676 150 A 3.7947 7.7179 120.3603 54.9634 18.8020 177.4685 151 Y 4.5136 7.2098 111.5692 57.8375 38.2737 177.7782 152 A 4.1780 7.8434 126.0520 55.0335 18.5455 179.7017 153 H 4.7662 8.2601 109.3507 56.4133 28.5636 175.2354 154 Y 5.0845 7.6488 116.0606 57.4891 38.7529 175.8099 155 R 4.0265 7.5718 116.8060 56.3364 29.8342 176.4733 156 W 4.4700 8.3965 116.4157 56.6651 28.2823 175.2469 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 2 A 8.26 4.35 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 3 R 8.30 3.90 0.00 1.89 1.99 0.00 3.19 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.71 0.00 4 R 8.06 4.30 0.00 1.79 1.88 0.00 3.22 0.00 0.00 3.22 7.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 5 R 7.61 3.97 0.00 1.87 1.86 0.00 3.11 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.63 0.00 6 R 8.65 4.31 0.00 1.78 1.91 0.00 3.40 0.00 0.00 3.23 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.63 0.00 7 A 7.42 3.62 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 8 E 8.36 4.51 0.00 2.03 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 2.17 2.31 0.00 9 V 8.32 3.70 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 0.77 0.00 0.00 0.93 0.00 0.00 10 R 8.49 3.85 0.00 1.80 1.83 0.00 3.26 0.00 0.00 3.14 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.64 0.00 11 Q 8.39 4.46 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.42 0.00 12 L 8.31 4.30 0.00 1.68 1.58 0.91 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.29 4.45 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.87 0.00 0.00 0.00 0.00 0.00 2.31 2.37 0.00 14 P 0.00 4.28 0.00 2.06 2.08 0.00 3.69 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 2.06 2.14 0.00 15 D 8.35 4.68 0.00 2.97 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 16 L 8.34 4.99 0.00 1.76 1.70 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17 V 7.38 4.51 2.36 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 0.43 0.00 0.00 0.61 0.00 0.00 18 Y 8.03 4.50 0.00 3.16 3.01 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 19 G 8.27 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 0.00 0.00 0.00 0.00 20 D 7.62 4.45 0.00 2.70 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 21 V 8.00 3.71 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 0.74 0.00 0.00 0.96 0.00 0.00 22 L 7.73 3.85 0.00 1.82 2.00 0.98 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 23 V 8.91 3.14 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 0.68 0.00 0.00 0.82 0.00 0.00 24 T 7.86 3.72 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 25 A 8.10 4.03 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 F 8.04 4.07 0.00 3.30 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 27 I 7.88 3.54 1.86 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.31 0.82 0.00 0.00 28 N 8.71 4.19 0.00 2.77 2.81 0.00 0.00 7.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 K 7.59 3.92 0.00 1.49 1.68 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.95 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.55 1.56 7.81 30 I 7.11 3.99 1.77 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.42 0.82 0.00 0.00 31 M 7.88 4.01 0.00 2.01 1.93 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 32 R 8.37 4.43 0.00 1.75 1.76 0.00 3.34 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.59 0.00 33 D 9.01 4.50 0.00 2.92 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 34 G 8.25 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 35 K 7.59 4.31 0.00 1.85 1.87 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.44 7.81 36 K 7.99 3.75 0.00 1.84 1.78 0.00 1.81 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.47 7.81 37 N 8.22 4.16 0.00 2.80 2.85 0.00 0.00 6.81 6.66 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 38 L 7.96 3.99 0.00 1.80 1.64 0.94 1.17 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 39 A 7.46 3.90 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.22 3.83 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 41 R 7.94 3.96 0.00 2.17 2.04 0.00 3.19 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.98 0.00 42 I 8.20 3.69 2.09 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.43 0.94 0.00 0.00 43 F 8.18 4.42 0.00 2.90 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 44 Y 7.51 4.09 0.00 3.23 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 45 D 8.38 4.47 0.00 2.63 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 46 A 7.45 4.16 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 C 7.51 3.87 0.00 3.11 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 48 K 8.49 3.98 0.00 1.80 1.93 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.48 7.81 49 I 8.30 3.87 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.94 0.92 0.00 0.00 50 I 7.52 4.46 2.02 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.13 0.99 0.00 0.00 51 Q 8.17 4.14 0.00 2.16 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.87 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 52 E 9.19 4.04 0.00 1.93 2.01 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 2.31 2.33 0.00 53 K 7.33 3.56 0.00 1.84 1.67 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.51 1.47 7.81 54 T 8.37 4.36 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 55 G 8.43 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 0.00 0.00 0.00 56 Q 8.03 4.51 0.00 1.94 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.97 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 57 E 8.78 4.24 0.00 2.12 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 2.43 2.45 0.00 58 P 0.00 4.24 0.00 2.20 2.35 0.00 3.79 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.16 0.00 59 L 8.61 3.73 0.00 2.21 1.81 1.10 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.31 3.94 0.00 1.89 1.92 0.00 1.76 0.00 0.00 1.78 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.59 1.59 7.81 61 V 7.75 3.55 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 1.11 0.00 0.00 1.07 0.00 0.00 62 F 9.08 4.02 0.00 3.11 3.29 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 63 K 8.56 3.76 0.00 1.93 2.03 0.00 1.55 0.00 0.00 1.58 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.47 1.62 7.81 64 Q 8.63 3.97 0.00 2.24 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 65 A 8.05 4.08 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 66 V 7.52 3.46 1.87 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 0.81 0.00 0.00 0.20 0.00 0.00 67 E 8.01 3.83 0.00 2.22 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 2.29 2.38 0.00 68 N 7.74 4.54 0.00 2.97 2.88 0.00 0.00 6.88 7.49 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 69 V 7.22 4.29 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 1.08 0.00 0.00 0.99 0.00 0.00 70 K 8.43 4.19 0.00 1.85 1.99 0.00 1.88 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.51 7.81 71 P 0.00 4.38 0.00 2.40 2.58 0.00 3.73 0.00 0.00 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 72 R 8.76 4.20 0.00 1.81 2.03 0.00 3.18 0.00 0.00 3.35 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.10 0.00 73 M 7.80 4.97 0.00 1.87 1.93 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.54 0.00 74 E 8.64 4.80 0.00 2.06 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 2.25 2.37 0.00 75 V 8.45 4.15 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 0.74 0.00 0.00 0.98 0.00 0.00 76 R 8.92 4.76 0.00 1.95 2.23 0.00 3.46 0.00 0.00 3.83 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.74 0.00 77 S 8.94 4.41 0.00 4.18 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 78 R 9.21 4.41 0.00 2.02 1.88 0.00 2.84 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.41 0.00 79 R 7.89 4.61 0.00 1.59 1.53 0.00 3.12 0.00 0.00 3.01 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.54 0.00 80 V 7.90 4.11 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 0.63 0.00 0.00 0.52 0.00 0.00 81 G 8.89 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 0.00 0.00 0.00 82 G 8.35 3.83 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 0.00 0.00 0.00 83 A 7.27 4.58 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 84 N 8.50 5.26 0.00 2.63 2.71 0.00 0.00 7.26 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 85 Y 8.19 4.80 0.00 2.92 2.34 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 86 Q 7.92 4.65 0.00 1.96 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 87 V 8.07 3.93 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 1.31 0.00 0.00 1.37 0.00 0.00 88 P 0.00 5.84 0.00 2.15 2.09 0.00 3.66 0.00 0.00 5.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.08 0.00 89 M 8.41 4.22 0.00 2.08 2.11 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.23 0.00 90 E 8.68 4.37 0.00 1.79 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 2.30 2.24 0.00 91 V 8.20 4.00 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 0.83 0.00 0.00 1.04 0.00 0.00 92 S 8.66 4.06 0.00 3.88 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 93 P 0.00 4.13 0.00 2.27 2.30 0.00 3.72 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 2.06 2.03 0.00 94 R 7.89 3.79 0.00 1.87 1.94 0.00 3.18 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 95 R 7.88 4.40 0.00 1.89 2.02 0.00 3.30 0.00 0.00 3.39 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.55 0.00 96 Q 8.75 3.86 0.00 2.28 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.53 0.00 0.00 0.00 0.00 0.00 2.49 2.63 0.00 97 Q 8.16 4.09 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.74 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 98 S 8.31 4.00 0.00 3.93 4.05 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 0.00 0.00 0.00 99 L 8.25 3.26 0.00 1.25 0.13 0.90 0.86 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 0.00 100 A 8.22 3.78 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 0.00 101 L 8.08 4.10 0.00 1.67 1.86 1.07 0.93 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 0.00 102 R 7.61 3.80 0.00 1.78 1.63 0.00 3.04 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 103 W 7.79 4.57 0.00 3.54 3.07 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 0.00 0.00 0.00 0.00 104 L 8.00 4.07 0.00 2.14 2.06 0.99 0.68 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 0.00 105 V 8.35 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 1.00 0.00 0.00 0.65 0.00 0.00 106 Q 8.45 3.99 0.00 2.30 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.65 0.00 0.00 0.00 0.00 0.00 2.46 2.71 0.00 107 A 9.00 4.16 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 A 8.24 4.02 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 0.00 109 N 8.18 4.57 0.00 2.88 2.90 0.00 0.00 7.06 7.36 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 0.00 110 Q 7.94 4.33 0.00 2.16 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.88 0.00 0.00 0.00 0.00 0.00 2.36 2.71 0.00 111 R 7.00 4.14 0.00 1.95 2.03 0.00 3.33 0.00 0.00 3.28 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 112 P 0.00 4.94 0.00 2.19 2.14 0.00 3.78 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 1.99 2.00 0.00 113 E 7.69 4.35 0.00 1.97 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 0.00 2.36 2.46 0.00 114 R 8.56 4.10 0.00 1.81 1.99 0.00 3.15 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 115 R 7.66 4.48 0.00 1.82 1.81 0.00 3.17 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 116 A 8.91 3.98 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 0.00 117 A 7.93 3.99 1.38 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 0.00 0.00 0.00 118 V 7.90 3.58 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.85 0.00 0.00 119 R 7.94 3.93 0.00 2.04 2.24 0.00 3.33 0.00 0.00 3.59 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.97 0.00 120 I 7.89 3.50 2.04 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 1.72 0.92 1.43 0.00 0.00 121 A 8.09 4.06 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 0.00 122 H 9.01 4.16 0.00 3.35 3.39 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 9.06 3.95 0.00 2.18 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 0.00 2.65 2.51 0.00 124 L 8.07 3.99 0.00 2.10 1.77 1.21 0.85 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 0.00 125 M 8.27 4.08 0.00 2.07 2.27 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 2.94 2.63 0.00 126 D 8.77 4.62 0.00 2.69 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 0.00 127 A 8.36 3.88 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 7.90 3.88 1.40 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 0.00 0.00 0.00 129 E 7.71 4.13 0.00 2.15 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 2.35 2.34 0.00 130 G 7.28 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 0.00 0.00 0.00 131 K 8.87 4.55 0.00 1.78 1.85 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.14 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.42 1.34 7.81 132 G 7.97 3.80 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 0.00 0.00 0.00 133 G 8.80 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 0.00 0.00 0.00 134 A 7.99 4.16 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 0.00 135 V 7.96 3.62 2.22 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 1.23 0.00 0.00 0.97 0.00 0.00 136 K 7.80 4.18 0.00 2.03 1.77 0.00 1.84 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.46 7.81 137 K 7.67 3.66 0.00 1.45 0.74 0.00 1.37 0.00 0.00 0.66 0.00 0.00 2.15 0.00 0.00 2.68 0.00 0.00 0.00 0.00 1.21 1.11 7.81 138 K 7.52 3.79 0.00 1.92 2.06 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.27 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.62 1.72 7.81 139 E 8.27 3.87 0.00 2.18 1.96 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 2.32 2.52 0.00 140 D 8.90 4.39 0.00 2.59 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 0.00 141 V 8.16 3.54 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 1.13 0.00 0.00 0.73 0.00 0.00 142 E 8.13 4.00 0.00 2.22 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 2.36 2.63 0.00 143 R 8.09 3.97 0.00 1.84 1.98 0.00 3.12 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.89 0.00 144 M 7.82 4.17 0.00 2.02 2.32 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.86 0.00 145 A 7.62 4.02 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 0.00 146 E 8.71 4.00 0.00 2.14 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.49 0.00 147 A 8.43 4.03 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 0.00 148 N 8.65 4.79 0.00 2.86 3.12 0.00 0.00 6.80 8.38 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 0.00 149 R 7.83 4.12 0.00 2.05 1.85 0.00 3.13 0.00 0.00 3.21 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 150 A 7.72 3.79 0.70 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 0.00 0.00 151 Y 7.21 4.51 0.00 3.22 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 0.00 152 A 7.84 4.18 1.38 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 0.00 0.00 0.00 153 H 8.26 4.77 0.00 3.28 3.32 0.00 5.48 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 7.65 5.08 0.00 3.26 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 0.00 155 R 7.57 4.03 0.00 1.86 2.16 0.00 3.46 0.00 0.00 3.41 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 156 W 8.40 4.47 0.00 3.59 3.06 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