NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4321 8.3049 120.3496 54.8154 33.4178 175.2948 2 K 3.9589 8.5938 125.3291 56.0579 33.0084 174.1362 3 E 4.2761 9.4155 121.0540 56.7847 31.8032 176.2314 4 K 5.1336 8.5831 122.0090 54.6550 34.7531 175.6039 5 F 5.0470 9.2732 124.2076 56.5395 42.9851 173.4497 6 V 4.4239 8.0426 126.0320 60.9467 33.5997 173.7607 7 L 4.7073 8.5420 130.5967 53.3553 44.3395 174.7666 8 I 4.7376 8.8430 127.9404 59.8959 39.3493 174.7153 9 I 5.1492 8.7130 128.3627 59.7427 40.2763 174.9515 10 T 5.3945 8.4819 115.9976 60.1136 73.3109 172.5755 11 H 4.6154 9.9263 119.6424 56.5881 29.2969 176.8706 12 G 3.8992 9.2799 111.6834 47.0862 0.0000 174.1913 13 D 4.7956 8.5636 123.8170 54.5993 41.3253 177.9756 14 F 4.4866 8.4391 123.5278 61.5701 39.2706 177.4469 15 G 3.3029 8.2923 105.5817 47.4391 0.0000 175.3398 16 K 3.9187 8.0190 121.8032 59.3324 32.1582 178.9819 17 G 3.5845 8.3710 106.2574 47.4922 0.0000 175.4039 18 L 3.8451 8.1716 123.0838 57.7591 41.9491 178.8916 19 L 3.8138 7.9107 120.2845 58.0848 42.1184 178.4565 20 S 4.1546 8.0777 113.3141 61.5818 62.2422 176.4502 21 G 3.6044 8.3340 107.9839 47.9166 0.0000 175.3236 22 A 4.1166 8.1881 123.8785 54.9565 18.3844 179.5968 23 E 4.1626 8.3908 118.3985 58.5688 29.2503 179.5204 24 V 3.6063 7.5072 117.9173 65.9187 31.5558 177.9058 25 I 4.0118 7.1569 117.3443 63.5165 37.2792 176.9869 26 I 4.2566 7.8456 109.3527 59.9784 37.6072 176.3011 27 G 3.9757 8.2455 107.4462 44.8823 0.0000 173.0630 28 K 4.2511 8.2982 119.8733 56.5649 32.5966 175.9732 29 Q 4.5249 9.1717 125.5938 54.6655 29.9238 175.0353 30 E 4.6071 8.3380 119.9993 55.5730 32.2202 175.7332 31 N 5.1634 8.8772 113.9933 54.2557 36.0492 173.6859 32 V 4.5842 7.4104 116.9941 61.3143 34.2671 174.2618 33 H 5.1667 8.9100 127.0450 54.4690 33.4660 171.8823 34 T 5.0234 8.1200 113.5243 59.8235 71.5202 173.3353 35 V 4.3611 9.0620 124.0196 61.1025 34.6851 174.1153 36 G 4.4626 8.6949 114.4987 43.5689 0.0000 172.3974 37 L 4.7336 9.0371 125.3726 53.7417 42.8078 175.8250 38 N 5.1826 9.3543 122.3647 51.1032 41.2890 175.1087 39 L 3.9063 8.4031 120.8611 56.8577 42.0502 178.1532 40 G 3.9849 9.0058 111.2909 45.1843 0.0000 173.0214 41 D 4.5434 7.6548 120.0682 53.5286 41.8535 176.1107 42 N 4.5731 8.6093 122.0224 53.1063 40.0078 175.9922 43 I 3.7672 8.4226 129.1507 64.5486 37.2735 178.1898 44 E 4.0023 8.7686 119.8347 59.0597 29.3608 179.4696 45 V 3.5705 7.8965 118.0721 65.9951 31.6487 178.1424 46 V 3.6114 7.8949 118.0566 65.8288 31.2529 177.9016 47 R 3.8726 8.3465 118.9127 59.5236 29.9558 178.7390 48 K 4.0597 8.2354 120.6892 59.9609 32.0568 179.9334 49 E 4.0072 8.1623 118.5886 60.9649 29.6751 182.0755 50 V 3.7808 8.0161 119.5443 65.8247 31.5826 177.7123 51 E 3.7991 8.4375 119.3653 59.0333 29.4686 178.4604 52 K 3.7780 8.0800 119.6197 59.8008 32.1851 178.7561 53 I 3.5951 7.5952 119.5919 64.2574 36.9777 178.5914 54 I 3.5329 7.6614 120.5588 64.1779 36.8906 178.4199 55 K 3.7410 7.8501 121.7812 60.2330 31.6933 179.6266 56 E 3.9079 7.6305 116.7554 61.2653 29.8538 180.9094 57 K 4.1208 7.7863 119.3991 58.8776 32.0813 179.4965 58 L 4.0248 8.3551 122.2490 58.5561 41.4121 180.1327 59 Q 4.3408 8.2648 118.9969 59.1055 27.9662 179.0221 60 E 4.5994 7.6397 116.5470 55.7868 30.0111 175.1031 61 D 4.4098 8.3589 117.3486 55.3856 40.1587 173.3794 62 K 4.7940 7.9302 114.9706 54.5945 34.6762 175.8833 63 E 4.5431 8.8983 124.3262 55.1893 31.5677 174.6736 64 I 5.1125 8.4005 126.9509 59.6860 40.1842 174.2282 65 I 4.8532 8.7079 127.7493 59.5927 39.8982 174.4634 66 I 4.7710 9.0217 128.3626 59.6540 39.3322 174.6663 67 V 4.8220 8.7075 127.5661 61.2838 33.5817 174.9098 68 V 5.5710 9.0004 120.2200 58.5125 35.4023 176.4552 69 D 4.7053 8.9565 122.4036 56.0759 40.6842 176.2986 70 L 4.6249 7.7060 119.1013 52.4684 45.0805 174.8897 71 F 3.0720 8.7065 128.3153 59.9921 39.3408 175.4313 72 G 3.7908 6.1493 114.3891 46.6827 0.0000 172.6544 73 G 4.0911 8.6867 105.9116 44.7134 0.0000 174.9825 74 S 4.1326 8.7135 114.4180 61.0236 62.7543 175.2330 75 P 4.2240 0.0000 0.0000 65.5201 31.1172 178.3763 76 F 4.1597 8.2161 118.9314 61.4184 39.3785 176.7338 77 N 4.2330 8.4895 116.2407 56.1926 38.2806 177.4626 78 I 3.6285 8.0760 121.2945 64.2854 37.2501 178.2206 79 A 3.9332 7.9257 121.4873 55.2209 18.1025 179.6351 80 L 3.7190 7.9115 118.0149 57.8706 41.6306 179.9839 81 S 4.0698 8.0013 114.1560 61.6647 62.8747 176.4995 82 M 4.2955 8.0321 122.3884 58.2548 31.6804 178.3580 83 M 4.1391 8.1094 118.6659 58.1979 32.1611 178.0837 84 K 3.8489 8.0760 119.3951 59.5285 32.4384 178.1341 85 E 4.0205 7.7892 116.6417 58.2615 29.7611 177.5125 86 Y 4.6574 8.4389 116.5077 57.1257 38.9507 176.6017 87 D 4.8218 7.9762 117.0518 54.1363 37.8437 179.6054 88 V 4.1424 7.2183 113.3036 62.2380 32.8216 175.6120 89 K 4.7610 8.5042 120.0178 54.9522 34.9780 176.0548 90 V 4.9988 8.1975 121.3528 61.3596 34.7089 174.3155 91 I 4.9037 8.7325 126.7783 59.5309 41.6567 174.0531 92 T 4.9861 8.7116 117.6790 60.4174 71.7637 173.7444 93 G 3.9705 8.8146 107.0693 46.9433 0.0000 173.6246 94 I 3.7128 7.5254 119.6738 61.1526 38.4538 174.6297 95 N 5.2655 8.3631 123.0883 50.6212 40.7937 174.5174 96 M 4.0022 8.7265 116.1925 58.4216 32.2727 176.2766 97 P 4.2368 0.0000 0.0000 66.1007 31.2937 178.2063 98 M 4.0228 7.9711 117.8854 58.2172 31.9631 178.3643 99 L 3.9557 7.9008 120.4445 57.9165 42.2249 179.1130 100 V 3.5461 8.0253 118.4872 65.9753 31.2970 177.5990 101 E 3.9228 7.9726 117.6909 59.0819 29.5296 178.0973 102 L 4.1095 8.2604 120.7274 58.4267 41.9997 179.0504 103 L 4.1076 7.9860 117.0832 56.8521 41.7055 178.4073 104 T 4.4830 7.6951 107.9589 61.7315 69.4446 175.0995 105 S 4.7286 7.6473 115.1620 57.9080 64.0708 175.6730 106 I 3.6771 7.9883 122.3268 64.0133 37.7632 176.1982 107 N 4.6800 7.9974 115.1234 53.6812 39.2720 176.0937 108 V 3.6438 7.8982 118.3891 64.6368 31.9180 175.5176 109 Y 4.8282 7.4713 114.7945 55.6881 40.5846 175.5916 110 D 4.6947 8.4136 121.7961 53.4077 41.7866 177.5205 111 T 3.8811 8.4302 116.8741 67.0781 68.5141 176.9416 112 T 3.8682 7.8802 117.0938 66.7695 68.5675 176.1676 113 E 3.9142 9.2620 121.4966 58.8521 29.6348 178.3102 114 L 3.7883 8.2036 120.8288 58.4000 42.1764 179.1866 115 L 4.0339 8.0350 118.6382 57.6427 41.5861 179.3931 116 E 3.9575 8.1080 118.5199 59.2886 29.4042 178.8943 117 N 4.1785 8.3713 117.1914 56.4878 38.6326 177.5186 118 I 3.8342 7.8301 114.0253 63.4949 37.7663 178.0285 119 S 4.0509 8.0955 115.2898 61.2561 62.2201 176.1042 120 K 3.9245 7.9125 121.9856 59.6464 32.0332 178.9133 121 I 3.8582 7.9314 120.3065 64.0440 36.7398 178.6940 122 G 3.5951 8.2739 106.3179 47.7892 0.0000 175.6658 123 K 4.1532 7.9912 121.3934 59.2632 31.8985 179.3476 124 D 4.5466 8.1391 117.8853 56.8036 40.7816 178.2551 125 G 3.9992 7.7498 104.0276 44.5879 0.0000 173.3850 126 I 4.3205 7.2326 122.3915 59.6644 37.4943 175.4115 127 K 4.5566 8.1988 124.2575 54.4754 35.8331 176.1681 128 V 3.9758 8.3394 123.2506 62.0483 32.3470 175.7920 129 I 4.0237 8.2893 126.7759 61.5891 37.1180 175.5621 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 M 8.30 4.43 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.59 0.00 2 K 8.59 3.96 0.00 1.89 1.75 0.00 2.02 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.46 1.51 7.81 3 E 9.42 4.28 0.00 1.66 1.83 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 2.31 1.91 0.00 4 K 8.58 5.13 0.00 1.66 1.79 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.40 1.45 7.81 5 F 9.27 5.05 0.00 3.02 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 6 V 8.04 4.42 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 0.80 0.00 0.00 0.84 0.00 0.00 7 L 8.54 4.71 0.00 1.75 1.46 1.13 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.84 4.74 1.75 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.29 0.76 0.00 0.00 9 I 8.71 5.15 1.88 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 1.29 1.24 0.91 0.00 0.00 10 T 8.48 5.39 4.76 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 1.23 0.00 0.00 11 H 9.93 4.62 0.00 3.19 3.31 0.00 5.96 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 12 G 9.28 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 0.00 0.00 0.00 13 D 8.56 4.80 0.00 2.76 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 14 F 8.44 4.49 0.00 3.09 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 15 G 8.29 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 K 8.02 3.92 0.00 1.80 1.97 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.49 7.81 17 G 8.37 3.58 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 0.00 0.00 0.00 18 L 8.17 3.85 0.00 1.18 1.45 0.88 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 19 L 7.91 3.81 0.00 1.76 1.72 0.86 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 20 S 8.08 4.15 0.00 3.92 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 21 G 8.33 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.19 4.12 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 23 E 8.39 4.16 0.00 2.14 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 2.52 2.31 0.00 24 V 7.51 3.61 2.27 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 0.83 0.00 0.00 0.99 0.00 0.00 25 I 7.16 4.01 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 1.58 0.81 0.91 0.00 0.00 26 I 7.85 4.26 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 1.43 0.66 0.91 0.00 0.00 27 G 8.25 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.30 4.25 0.00 1.71 1.73 0.00 1.86 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.53 7.81 29 Q 9.17 4.52 0.00 2.13 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.50 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 30 E 8.34 4.61 0.00 2.12 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 0.00 2.30 1.86 0.00 31 N 8.88 5.16 0.00 2.98 3.19 0.00 0.00 6.18 7.68 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 32 V 7.41 4.58 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 0.65 0.00 0.00 0.84 0.00 0.00 33 H 8.91 5.17 0.00 3.51 3.27 0.00 5.77 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.12 5.02 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 1.13 0.00 0.00 35 V 9.06 4.36 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 0.96 0.00 0.00 0.99 0.00 0.00 36 G 8.69 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 0.00 0.00 0.00 0.00 37 L 9.04 4.73 0.00 1.53 1.62 0.92 0.54 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 38 N 9.35 5.18 0.00 2.86 2.73 0.00 0.00 6.61 6.43 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 39 L 8.40 3.91 0.00 1.65 1.64 0.93 1.00 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 40 G 9.01 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 D 7.65 4.54 0.00 2.83 2.62 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 42 N 8.61 4.57 0.00 2.76 2.70 0.00 0.00 7.22 7.98 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 43 I 8.42 3.77 1.88 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 1.65 0.84 0.92 0.00 0.00 44 E 8.77 4.00 0.00 2.08 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 2.33 2.46 0.00 45 V 7.90 3.57 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.94 0.00 0.00 46 V 7.89 3.61 2.20 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 1.02 0.00 0.00 0.94 0.00 0.00 47 R 8.35 3.87 0.00 2.06 2.06 0.00 3.16 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 48 K 8.24 4.06 0.00 1.97 1.85 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.74 1.60 7.81 49 E 8.16 4.01 0.00 2.01 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 0.00 2.24 2.18 0.00 50 V 8.02 3.78 2.23 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 0.93 0.00 0.00 0.98 0.00 0.00 51 E 8.44 3.80 0.00 2.10 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 2.31 2.36 0.00 52 K 8.08 3.78 0.00 2.09 1.88 0.00 1.56 0.00 0.00 1.63 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.40 1.50 7.81 53 I 7.60 3.60 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 1.41 0.47 0.89 0.00 0.00 54 I 7.66 3.53 1.60 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 1.50 0.63 0.53 0.00 0.00 55 K 7.85 3.74 0.00 1.67 1.80 0.00 1.75 0.00 0.00 1.66 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.28 7.81 56 E 7.63 3.91 0.00 2.09 1.88 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 2.27 2.24 0.00 57 K 7.79 4.12 0.00 1.60 1.55 0.00 0.92 0.00 0.00 1.23 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 0.21 7.81 58 L 8.36 4.02 0.00 1.73 1.71 0.96 1.03 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 59 Q 8.26 4.34 0.00 2.12 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.13 0.00 0.00 0.00 0.00 0.00 2.31 2.28 0.00 60 E 7.64 4.60 0.00 2.00 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 2.21 2.49 0.00 61 D 8.36 4.41 0.00 2.71 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 62 K 7.93 4.79 0.00 1.81 1.75 0.00 1.68 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.51 1.39 7.81 63 E 8.90 4.54 0.00 2.08 1.84 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 2.29 2.32 0.00 64 I 8.40 5.11 1.94 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 1.61 1.05 1.04 0.00 0.00 65 I 8.71 4.85 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 1.24 0.86 0.90 0.00 0.00 66 I 9.02 4.77 1.87 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 1.13 0.70 0.91 0.00 0.00 67 V 8.71 4.82 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 1.05 0.00 0.00 0.90 0.00 0.00 68 V 9.00 5.57 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 1.17 0.00 0.00 1.17 0.00 0.00 69 D 8.96 4.71 0.00 2.83 3.47 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 70 L 7.71 4.62 0.00 1.62 1.71 0.89 0.67 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 71 F 8.71 3.07 0.00 2.84 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 72 G 6.15 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 0.00 0.00 0.00 73 G 8.69 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 74 S 8.71 4.13 0.00 3.88 3.93 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 75 P 0.00 4.22 0.00 2.18 2.10 0.00 3.48 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.00 0.00 76 F 8.22 4.16 0.00 3.22 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 77 N 8.49 4.23 0.00 2.91 2.83 0.00 0.00 7.06 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 78 I 8.08 3.63 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 1.45 0.69 0.90 0.00 0.00 79 A 7.93 3.93 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 80 L 7.91 3.72 0.00 1.49 1.48 0.54 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 81 S 8.00 4.07 0.00 4.05 4.15 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 82 M 8.03 4.30 0.00 2.14 2.30 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.90 0.00 83 M 8.11 4.14 0.00 2.13 2.01 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.86 2.53 0.00 84 K 8.08 3.85 0.00 1.85 1.94 0.00 1.81 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.45 7.81 85 E 7.79 4.02 0.00 1.76 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 2.44 2.41 0.00 86 Y 8.44 4.66 0.00 3.07 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 87 D 7.98 4.82 0.00 2.86 2.62 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 88 V 7.22 4.14 2.23 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 0.86 0.00 0.00 0.97 0.00 0.00 89 K 8.50 4.76 0.00 1.71 1.70 0.00 1.63 0.00 0.00 1.60 0.00 0.00 2.79 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.37 7.81 90 V 8.20 5.00 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 0.81 0.00 0.00 0.90 0.00 0.00 91 I 8.73 4.90 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.63 0.94 0.00 0.00 92 T 8.71 4.99 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 1.44 0.00 0.00 93 G 8.81 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 94 I 7.53 3.71 1.93 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 1.32 0.74 1.10 0.00 0.00 95 N 8.36 5.27 0.00 2.94 2.96 0.00 0.00 5.90 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 96 M 8.73 4.00 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.66 0.00 97 P 0.00 4.24 0.00 2.31 2.30 0.00 3.69 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 2.08 2.07 0.00 98 M 7.97 4.02 0.00 2.09 2.33 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 2.70 2.88 0.00 99 L 7.90 3.96 0.00 1.74 1.63 0.86 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 100 V 8.03 3.55 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 0.94 0.00 0.00 0.97 0.00 0.00 101 E 7.97 3.92 0.00 2.00 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 0.00 2.31 2.37 0.00 102 L 8.26 4.11 0.00 1.84 1.86 0.93 0.50 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 0.00 103 L 7.99 4.11 0.00 1.65 1.84 0.88 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 104 T 7.70 4.48 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 1.25 0.00 0.00 105 S 7.65 4.73 0.00 4.26 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.99 3.68 2.04 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 1.43 0.72 0.93 0.00 0.00 107 N 8.00 4.68 0.00 2.73 2.83 0.00 0.00 6.83 7.68 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 0.00 108 V 7.90 3.64 1.80 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 -0.05 0.00 0.00 0.81 0.00 0.00 109 Y 7.47 4.83 0.00 2.98 2.82 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 0.00 110 D 8.41 4.69 0.00 2.91 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 0.00 111 T 8.43 3.88 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 1.24 0.00 0.00 112 T 7.88 3.87 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 1.22 0.00 0.00 113 E 9.26 3.91 0.00 2.07 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 0.00 2.08 2.26 0.00 114 L 8.20 3.79 0.00 2.06 1.88 1.02 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 115 L 8.03 4.03 0.00 1.75 1.71 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 116 E 8.11 3.96 0.00 2.22 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 2.33 2.22 0.00 117 N 8.37 4.18 0.00 2.67 2.66 0.00 0.00 6.82 7.18 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 0.00 118 I 7.83 3.83 1.86 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 1.66 1.17 0.95 0.00 0.00 119 S 8.10 4.05 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 0.00 120 K 7.91 3.92 0.00 1.92 2.01 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.50 7.81 121 I 7.93 3.86 1.95 0.00 0.00 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 1.45 0.85 0.91 0.00 0.00 122 G 8.27 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 K 7.99 4.15 0.00 1.83 1.86 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.60 7.81 124 D 8.14 4.55 0.00 2.70 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 0.00 125 G 7.75 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 0.00 0.00 0.00 126 I 7.23 4.32 1.99 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 1.30 0.78 0.90 0.00 0.00 127 K 8.20 4.56 0.00 1.67 1.64 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.33 1.40 7.81 128 V 8.34 3.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.92 0.00 0.00 129 I 8.29 4.02 1.87 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 1.27 0.96 0.91 0.00 0.00