NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3776 8.3044 120.3494 54.8244 33.4160 174.8764 2 I 3.5979 8.3594 125.8531 60.8743 38.6943 173.3077 3 Q 4.8683 8.5541 126.2664 54.0559 32.5732 174.1608 4 S 5.2101 8.6806 117.3528 56.6753 66.1972 173.3786 5 Q 4.7369 8.8402 120.5688 54.9496 30.0336 175.8825 6 I 4.4854 8.3481 111.3018 59.9752 39.2809 174.5671 7 N 4.8979 7.8592 120.4182 51.1360 40.8869 174.8220 8 R 4.0776 8.6049 123.5200 59.3036 29.4084 178.4018 9 N 4.3773 8.6019 117.2982 55.8217 38.2862 177.3655 10 I 3.6850 7.3446 120.2359 64.6323 37.2823 178.6707 11 R 4.0243 7.8950 118.1911 58.9770 29.9784 178.9380 12 L 4.1625 8.1568 119.1250 57.6219 41.5838 179.1377 13 D 4.3434 8.4444 119.4146 57.1330 40.7705 178.4614 14 L 3.8823 7.7772 120.3503 58.0761 42.0615 178.5026 15 A 4.3336 8.2759 122.4534 54.8554 18.2682 179.3550 16 D 4.3125 8.1380 116.7265 57.3209 40.8849 178.8374 17 A 3.9393 7.9442 121.1146 55.3109 18.4608 179.3740 18 I 3.6434 8.1971 118.5127 64.9456 37.3854 178.6086 19 L 4.1467 8.3345 119.7179 57.5739 41.2915 179.5249 20 L 3.9396 7.9432 120.3921 58.0133 42.0165 178.5496 21 S 4.0224 8.0411 113.0959 61.4482 62.3089 175.7475 22 K 3.6768 8.4831 122.1857 59.8098 31.8949 178.4166 23 A 3.9428 7.8219 120.0699 54.9742 18.0921 179.5706 24 K 3.8542 8.1092 116.3661 59.6113 32.3233 179.0691 25 K 4.1407 8.1026 115.5047 55.8459 32.5628 176.1833 26 D 4.3295 7.5765 117.2889 55.0630 40.0470 173.3396 27 L 5.2090 7.9587 115.9672 53.0583 43.2765 177.6619 28 S 4.5189 8.3344 116.3185 57.3271 66.0790 175.4498 29 F 4.1659 8.4357 121.3511 60.4264 38.4910 177.4198 30 A 4.1156 8.2805 119.6324 55.6294 17.8665 179.1708 31 E 4.1099 8.2557 115.5272 59.3914 29.5897 179.2214 32 I 3.7647 7.5961 119.8971 64.0620 37.4110 177.7494 33 A 4.3308 8.2552 121.0404 52.8258 18.1943 176.7699 34 D 4.3979 7.1375 116.8081 56.2473 41.3467 176.5310 35 G 4.0458 9.1366 115.5103 45.4312 0.0000 173.7350 36 T 4.0636 7.5291 108.6410 62.1808 69.3673 176.1910 37 G 3.9721 8.5739 109.4116 45.2195 0.0000 172.8437 38 L 4.7453 7.4425 118.0324 51.4921 45.3147 176.9791 39 A 4.0536 8.5860 123.6957 52.4667 19.7496 178.1858 40 E 3.8773 9.1189 124.3126 59.8547 29.6759 179.4546 41 A 3.9419 7.9729 119.9335 54.7719 18.5128 179.3486 42 F 3.9145 8.0279 118.8644 61.5440 39.8037 177.5401 43 V 3.6469 8.3226 118.3439 66.1343 31.3315 178.1584 44 T 3.7775 8.1225 115.4734 66.5686 68.2611 176.4461 45 A 3.8565 7.7284 122.1879 54.9516 18.2330 179.6524 46 A 4.2725 7.3377 120.0755 54.9356 18.3796 179.8234 47 L 3.9930 7.7414 116.9985 57.5342 41.3961 178.7565 48 L 4.6220 7.5685 116.4415 54.0999 41.6705 177.1013 49 G 3.8580 7.9886 106.6604 46.4366 0.0000 174.5828 50 Q 4.5358 8.3285 116.0568 55.3118 30.1509 175.3128 51 Q 4.4334 7.4126 115.8724 54.4256 32.8831 172.6997 52 A 5.0183 8.3137 121.2005 50.6824 20.8375 176.5057 53 L 4.7279 8.8094 122.0669 52.7308 43.8256 174.9893 54 P 4.4744 0.0000 0.0000 62.3928 32.4799 177.0809 55 A 3.9840 8.9998 123.9585 55.8632 18.0714 180.0349 56 D 4.2637 8.0885 116.1308 57.5009 40.9837 178.6168 57 A 4.0099 8.0737 120.4916 55.2474 18.3682 179.3439 58 A 3.9893 8.3839 119.5292 55.4605 18.3625 180.1572 59 R 3.8951 8.4840 117.0601 59.0274 30.0854 178.8261 60 L 3.9411 8.3392 120.6640 58.4807 42.1680 179.5451 61 V 3.7456 8.3801 112.7779 64.0780 31.4138 178.5980 62 G 3.7599 8.2969 105.5276 47.9370 0.0000 175.1391 63 A 3.9965 8.1820 123.8728 54.9725 18.2135 179.7150 64 K 3.8703 7.9451 115.2214 58.9847 32.2360 178.4331 65 L 4.4479 7.7185 115.7093 52.9881 43.5878 175.4070 66 D 4.3059 7.6591 117.0674 55.0480 39.5959 172.9473 67 L 4.5701 7.9459 119.2264 53.4676 43.9494 177.7507 68 D 4.7192 8.1951 121.8986 52.8536 42.1350 177.1800 69 E 4.0737 8.5392 118.0238 59.3579 29.3413 179.1682 70 D 4.4075 8.1305 118.7554 57.1814 40.8328 178.8060 71 S 4.0853 8.6629 116.0006 61.8079 62.7351 176.4967 72 I 3.7150 7.4903 121.0524 64.5688 37.2430 177.9514 73 L 4.3626 7.9250 122.3043 57.4716 41.8691 178.8252 74 L 4.0120 8.1816 119.3404 57.9067 41.5533 179.4684 75 L 3.9782 8.4355 119.0391 57.3313 41.2747 178.5920 76 Q 4.7145 7.6974 117.1758 54.9792 29.1228 175.3199 77 M 4.6034 7.3813 120.4360 54.7113 33.4067 176.3432 78 I 4.0467 8.5443 123.5856 60.6162 37.9972 174.3320 79 P 4.6507 0.0000 0.0000 62.3893 32.6538 176.4284 80 L 4.3228 8.3086 123.2513 54.1625 41.4692 176.4699 81 R 4.1642 8.3157 124.9128 55.6898 30.9535 175.1309 82 G 3.0380 8.6330 107.4962 44.9403 0.0000 173.3717 83 C 4.3596 8.1727 122.1440 58.1112 30.7759 174.1857 84 I 4.0984 7.4880 122.1030 60.3248 37.6598 175.0440 85 D 4.4401 8.8635 125.4414 57.1027 41.7031 176.3253 86 D 4.6388 7.2625 115.1052 53.1844 41.3768 174.0644 87 R 4.1353 8.1312 127.1814 56.9228 29.3544 177.1084 88 I 3.9792 7.1738 116.3226 58.3564 38.8822 173.9385 89 P 4.4580 0.0000 0.0000 62.7838 31.8189 176.6079 90 T 4.1539 8.3625 111.5587 63.3090 69.8029 175.1109 91 D 4.5794 7.9423 122.4382 52.9837 42.4639 174.6369 92 P 4.2532 0.0000 0.0000 66.2786 31.1235 178.8526 93 T 3.9568 7.9611 113.1329 66.9829 68.5234 176.3725 94 M 4.5098 8.2065 120.8317 58.4309 31.9863 178.0982 95 Y 4.0316 8.9213 120.3058 60.7533 39.0065 178.4231 96 K 4.0808 8.0636 118.8868 59.2877 31.8718 179.3344 97 F 4.1975 7.7052 118.1347 60.3485 38.8081 176.9742 98 Y 3.8936 7.9223 118.7910 60.6873 38.5720 177.5787 99 E 3.6690 8.0041 120.5071 59.3788 29.5622 178.3572 100 M 4.0794 7.9726 118.7056 58.8162 32.0102 178.8587 101 L 3.9773 7.4932 118.6232 57.8176 41.5414 179.5959 102 Q 3.7853 7.4847 117.1425 58.2897 28.5896 178.4042 103 V 3.6612 7.6402 118.6436 64.9060 32.0739 176.7561 104 Y 4.7384 8.0518 114.1161 57.3347 38.5086 177.5025 105 G 3.9332 8.1729 108.7220 48.7022 0.0000 176.0277 106 T 4.0117 7.8292 112.0126 64.0306 68.7913 176.7047 107 T 3.9384 7.8584 118.5343 66.4613 68.6061 176.4678 108 L 3.9755 8.2535 121.2504 57.7881 41.6305 179.1027 109 K 3.7116 8.1018 119.0873 59.8356 32.1717 178.3698 110 A 4.0197 8.4139 120.9103 55.2899 18.2387 179.5638 111 L 4.0540 8.2893 117.5662 57.5144 41.7421 179.5402 112 V 3.7810 8.0670 118.5790 66.6116 31.2862 177.9135 113 H 5.0602 8.3093 117.2315 58.2608 28.2936 177.4839 114 E 3.9219 7.9628 120.1837 59.3100 29.6161 178.6998 115 K 3.9505 8.2331 117.4325 58.2551 32.2697 177.7560 116 F 4.0685 8.4765 116.3452 59.2413 40.8148 174.1884 117 G 3.9742 7.9523 104.4347 43.2992 0.0000 171.5226 118 D 4.6799 9.0743 119.4306 52.9749 42.0979 176.7628 119 G 4.1375 7.7694 113.7624 46.6915 0.0000 170.7010 120 I 4.8137 7.7181 114.2115 59.4064 41.8287 174.4554 121 I 4.7354 8.1205 123.4307 59.9103 38.5971 175.8813 122 S 4.2290 8.9329 122.1504 58.2615 63.3160 174.1796 123 A 3.8930 8.4799 128.0009 51.9025 19.2850 176.7919 124 I 4.2473 7.6374 116.3855 63.4650 39.2916 176.5605 125 N 4.7647 8.5545 124.0075 52.3466 37.7845 172.8798 126 F 5.4297 8.2678 123.6718 57.0555 42.7742 172.3164 127 K 4.5822 7.6575 121.6425 55.5540 36.0719 174.4880 128 L 5.7446 8.3175 120.3406 53.0440 43.7451 175.0227 129 D 4.9354 8.4478 118.6809 51.7001 43.5538 173.9407 130 V 4.8351 8.3669 119.0968 61.1388 33.7561 174.7175 131 K 4.6373 8.8820 126.9823 54.3070 35.5718 175.2361 132 K 4.6104 8.8087 126.7766 56.0762 32.8603 175.8497 133 V 4.5508 8.5703 127.6067 60.6725 34.3489 174.6194 134 A 4.3924 8.5769 129.0008 51.9457 19.4292 176.3211 135 D 4.5966 9.1931 122.2459 52.4170 42.1123 175.3599 136 P 4.2413 0.0000 0.0000 65.9353 31.3854 177.0215 137 E 4.1667 8.1608 114.5905 55.9562 29.8235 176.1152 138 G 4.0092 8.6256 107.9904 45.1695 0.0000 176.0752 139 G 3.8535 8.9053 110.7069 44.7602 0.0000 171.6585 140 E 5.1786 8.5382 118.3009 54.6540 33.2989 175.7304 141 R 4.7907 9.3289 120.8107 54.4059 33.8373 174.5724 142 A 4.9961 8.5355 123.4834 50.4840 20.9670 176.4657 143 V 4.1534 8.7915 124.0230 61.6446 33.0103 174.4676 144 I 4.9220 8.3632 129.2369 59.9215 39.1816 175.3003 145 T 4.5469 8.6334 124.1219 61.7469 70.8569 173.1682 146 L 4.7785 8.5499 126.7044 53.1346 43.8345 176.0683 147 D 4.6259 8.4611 123.9242 51.9681 42.4456 174.2654 148 G 5.0031 8.4230 110.1227 42.6745 0.0000 169.3066 149 K 4.6000 8.4035 121.4092 55.0482 34.2012 174.8728 150 Y 4.6755 8.6223 128.4691 57.5398 39.6876 174.4848 151 L 4.4198 8.3004 127.6345 51.9754 43.6760 174.3114 152 P 4.6224 0.0000 0.0000 62.8249 32.2029 175.9024 153 T 4.5975 8.6412 119.4641 62.3689 69.7909 174.2996 154 K 4.6073 8.4825 124.6193 54.1037 35.7744 174.2627 155 P 4.4627 0.0000 0.0000 62.7607 32.0422 176.5292 156 F 4.5166 7.6135 113.4398 57.3049 37.9078 174.4686 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 4.38 0.00 1.98 2.03 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.36 3.60 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 1.42 1.05 0.91 0.00 0.00 3 Q 8.55 4.87 0.00 1.98 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.55 0.00 0.00 0.00 0.00 0.00 2.53 2.26 0.00 4 S 8.68 5.21 0.00 3.82 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 5 Q 8.84 4.74 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 6 I 8.35 4.49 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 1.29 0.66 0.91 0.00 0.00 7 N 7.86 4.90 0.00 2.76 2.67 0.00 0.00 6.93 7.65 0.00 0.00 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 R 8.60 4.08 0.00 2.06 2.33 0.00 3.08 0.00 0.00 3.32 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.71 0.00 9 N 8.60 4.38 0.00 2.85 2.91 0.00 0.00 6.86 6.67 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 10 I 7.34 3.68 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 1.52 1.68 0.91 0.00 0.00 11 R 7.90 4.02 0.00 1.81 1.96 0.00 3.28 0.00 0.00 3.48 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.16 4.16 0.00 1.69 1.71 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.44 4.34 0.00 2.90 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 L 7.78 3.88 0.00 1.72 1.87 0.92 1.46 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 15 A 8.28 4.33 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 16 D 8.14 4.31 0.00 2.91 2.74 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 17 A 7.94 3.94 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 18 I 8.20 3.64 2.13 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 1.53 0.50 0.95 0.00 0.00 19 L 8.33 4.15 0.00 1.80 1.75 0.98 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 20 L 7.94 3.94 0.00 1.78 1.79 0.92 0.84 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 21 S 8.04 4.02 0.00 3.93 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.48 3.68 0.00 1.76 1.94 0.00 1.09 0.00 0.00 1.17 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.25 1.27 7.81 23 A 7.82 3.94 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 24 K 8.11 3.85 0.00 1.89 1.88 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.62 7.81 25 K 8.10 4.14 0.00 1.68 1.82 0.00 1.83 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.41 7.81 26 D 7.58 4.33 0.00 2.80 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 27 L 7.96 5.21 0.00 1.55 1.48 0.87 0.74 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 28 S 8.33 4.52 0.00 4.06 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.44 4.17 0.00 3.23 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 A 8.28 4.12 1.39 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 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.26 4.11 0.00 2.23 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 0.00 2.54 2.32 0.00 32 I 7.60 3.76 1.94 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.73 0.94 0.00 0.00 33 A 8.26 4.33 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 34 D 7.14 4.40 0.00 2.88 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 35 G 9.14 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 0.00 0.00 0.00 36 T 7.53 4.06 4.29 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 1.28 0.00 0.00 37 G 8.57 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 38 L 7.44 4.75 0.00 1.64 1.68 1.08 0.66 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 39 A 8.59 4.05 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 E 9.12 3.88 0.00 2.08 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.50 0.00 41 A 7.97 3.94 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 42 F 8.03 3.91 0.00 3.17 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.32 3.65 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 1.04 0.00 0.00 1.12 0.00 0.00 44 T 8.12 3.78 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 0.39 0.00 0.00 45 A 7.73 3.86 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 46 A 7.34 4.27 1.20 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 0.00 0.00 47 L 7.74 3.99 0.00 1.98 1.83 1.14 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.57 4.62 0.00 1.56 1.64 0.77 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 49 G 7.99 3.86 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 0.00 0.00 0.00 50 Q 8.33 4.54 0.00 1.96 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.07 6.62 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 51 Q 7.41 4.43 0.00 1.46 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.90 0.00 0.00 0.00 0.00 0.00 2.00 1.29 0.00 52 A 8.31 5.02 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 L 8.81 4.73 0.00 1.61 1.64 0.95 1.01 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 54 P 0.00 4.47 0.00 2.10 1.99 0.00 3.72 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 55 A 9.00 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 56 D 8.09 4.26 0.00 2.71 2.74 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 57 A 8.07 4.01 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 58 A 8.38 3.99 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 59 R 8.48 3.90 0.00 1.96 1.99 0.00 3.14 0.00 0.00 3.10 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 60 L 8.34 3.94 0.00 1.88 1.76 0.97 0.87 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 61 V 8.38 3.75 2.11 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 0.84 0.00 0.00 1.01 0.00 0.00 62 G 8.30 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 63 A 8.18 4.00 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 64 K 7.95 3.87 0.00 1.90 1.90 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.50 7.81 65 L 7.72 4.45 0.00 1.70 1.67 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.66 4.31 0.00 2.79 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 67 L 7.95 4.57 0.00 1.67 1.57 0.93 0.92 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 68 D 8.20 4.72 0.00 2.95 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 69 E 8.54 4.07 0.00 2.00 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 2.40 2.34 0.00 70 D 8.13 4.41 0.00 2.72 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 S 8.66 4.09 0.00 4.14 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 72 I 7.49 3.72 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 1.55 0.60 0.92 0.00 0.00 73 L 7.93 4.36 0.00 1.87 1.93 0.93 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 74 L 8.18 4.01 0.00 1.87 1.71 0.92 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.44 3.98 0.00 1.86 1.74 0.93 0.80 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 76 Q 7.70 4.71 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.97 0.00 0.00 0.00 0.00 0.00 2.52 2.43 0.00 77 M 7.38 4.60 0.00 1.89 2.07 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.88 2.52 0.00 78 I 8.54 4.05 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 1.30 0.84 0.92 0.00 0.00 79 P 0.00 4.65 0.00 2.14 2.03 0.00 3.75 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 1.95 1.91 0.00 80 L 8.31 4.32 0.00 1.67 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.32 4.16 0.00 1.81 1.88 0.00 3.23 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.60 0.00 82 G 8.63 3.04 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 0.00 83 C 8.17 4.36 0.00 3.06 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 84 I 7.49 4.10 1.85 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 1.29 0.54 0.88 0.00 0.00 85 D 8.86 4.44 0.00 2.63 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 86 D 7.26 4.64 0.00 2.59 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 R 8.13 4.14 0.00 1.96 2.00 0.00 3.20 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.61 0.00 88 I 7.17 3.98 1.76 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.73 0.68 0.00 0.00 89 P 0.00 4.46 0.00 2.19 2.04 0.00 3.45 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 90 T 8.36 4.15 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 1.20 0.00 0.00 91 D 7.94 4.58 0.00 2.85 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 92 P 0.00 4.25 0.00 2.23 2.13 0.00 3.68 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.20 0.00 93 T 7.96 3.96 4.47 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 1.33 0.00 0.00 94 M 8.21 4.51 0.00 2.13 2.21 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 2.71 2.62 0.00 95 Y 8.92 4.03 0.00 3.20 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 96 K 8.06 4.08 0.00 1.54 1.61 0.00 1.71 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.63 1.61 7.81 97 F 7.71 4.20 0.00 3.32 3.09 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 98 Y 7.92 3.89 0.00 2.94 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 99 E 8.00 3.67 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 2.29 2.39 0.00 100 M 7.97 4.08 0.00 2.19 2.40 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.64 0.00 101 L 7.49 3.98 0.00 1.45 1.58 0.93 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 102 Q 7.48 3.79 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.90 0.00 0.00 0.00 0.00 0.00 1.76 2.38 0.00 103 V 7.64 3.66 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 0.16 0.00 0.00 0.83 0.00 0.00 104 Y 8.05 4.74 0.00 3.26 2.89 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 0.00 105 G 8.17 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 0.00 0.00 0.00 106 T 7.83 4.01 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 1.21 0.00 0.00 107 T 7.86 3.94 4.59 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 1.33 0.00 0.00 108 L 8.25 3.98 0.00 1.87 1.73 0.95 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.10 3.71 0.00 1.83 2.01 0.00 1.68 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.44 1.45 7.81 110 A 8.41 4.02 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 0.00 111 L 8.29 4.05 0.00 1.78 1.75 0.94 1.09 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 0.00 112 V 8.07 3.78 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 1.09 0.00 0.00 0.94 0.00 0.00 113 H 8.31 5.06 0.00 3.25 3.35 0.00 5.68 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 7.96 3.92 0.00 2.02 2.11 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 2.30 2.34 0.00 115 K 8.23 3.95 0.00 1.72 1.29 0.00 1.89 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.47 7.81 116 F 8.48 4.07 0.00 2.19 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 0.00 117 G 7.95 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 0.00 0.00 0.00 118 D 9.07 4.68 0.00 2.75 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 0.00 119 G 7.77 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 0.00 0.00 0.00 120 I 7.72 4.81 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.88 0.92 0.00 0.00 121 I 8.12 4.74 1.84 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.73 0.93 0.00 0.00 122 S 8.93 4.23 0.00 3.91 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 0.00 123 A 8.48 3.89 0.91 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 0.00 124 I 7.64 4.25 1.87 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.95 0.93 0.00 0.00 125 N 8.55 4.76 0.00 2.75 2.75 0.00 0.00 6.74 7.78 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 0.00 126 F 8.27 5.43 0.00 3.10 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 0.00 127 K 7.66 4.58 0.00 1.69 1.72 0.00 1.22 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.17 1.13 7.81 128 L 8.32 5.74 0.00 1.67 1.40 0.99 0.83 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 0.00 129 D 8.45 4.94 0.00 2.66 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 0.00 130 V 8.37 4.84 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 0.88 0.00 0.00 0.92 0.00 0.00 131 K 8.88 4.64 0.00 1.71 1.65 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.45 7.81 132 K 8.81 4.61 0.00 1.79 1.74 0.00 1.90 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.45 7.81 133 V 8.57 4.55 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 0.90 0.00 0.00 0.94 0.00 0.00 134 A 8.58 4.39 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 0.00 135 D 9.19 4.60 0.00 2.67 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 0.00 136 P 0.00 4.24 0.00 2.08 2.13 0.00 3.72 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 2.04 2.14 0.00 137 E 8.16 4.17 0.00 2.00 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 2.25 0.00 138 G 8.63 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 0.00 0.00 0.00 139 G 8.91 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 0.00 0.00 0.00 140 E 8.54 5.18 0.00 1.82 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 2.20 2.31 0.00 141 R 9.33 4.79 0.00 1.69 1.80 0.00 3.10 0.00 0.00 3.17 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.55 0.00 142 A 8.54 5.00 1.27 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 0.00 0.00 143 V 8.79 4.15 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 0.94 0.00 0.00 144 I 8.36 4.92 1.99 0.00 0.00 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 1.40 0.82 0.92 0.00 0.00 145 T 8.63 4.55 4.36 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 1.17 0.00 0.00 146 L 8.55 4.78 0.00 1.61 1.91 1.02 1.17 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 0.00 147 D 8.46 4.63 0.00 2.55 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 G 8.42 5.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.40 4.60 0.00 1.92 1.69 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.45 1.51 7.81 150 Y 8.62 4.68 0.00 2.61 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 0.00 151 L 8.30 4.42 0.00 1.47 1.43 0.87 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 152 P 0.00 4.62 0.00 2.04 1.98 0.00 3.46 0.00 0.00 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.90 0.00 153 T 8.64 4.60 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 1.26 0.00 0.00 154 K 8.48 4.61 0.00 1.83 1.75 0.00 1.62 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.47 7.81 155 P 0.00 4.46 0.00 2.02 1.93 0.00 3.65 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 156 F 7.61 4.52 0.00 3.05 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