NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1C H 4.7606 8.4449 117.8321 56.4024 30.0217 172.4948 1D H 4.6684 8.6416 115.4380 55.7270 29.8766 172.9296 1E H 5.0872 7.7143 115.4978 53.6041 33.5363 171.9790 1F H 4.6175 8.9415 117.0693 55.9987 28.9471 174.3000 1G F 4.9757 8.3939 119.4368 57.8387 39.8314 174.1017 2 N 4.6772 8.4224 117.2343 52.2601 39.3240 174.5761 3 L 4.7737 8.0765 123.1456 52.0257 44.1582 174.6031 4 P 4.5131 0.0000 0.0000 61.4903 32.3407 174.1249 5 P 4.4105 0.0000 0.0000 62.2114 32.4075 175.3380 6 G 3.9458 8.4964 105.5481 44.5778 0.0000 172.2248 7 N 4.5814 8.0472 115.8444 51.2454 40.3586 173.7336 8 Y 4.7800 8.0155 112.6756 57.8196 38.3837 176.9731 9 K 4.0547 8.3848 122.2402 58.8676 32.2434 177.0504 10 K 4.7360 7.5849 114.8803 53.2035 35.6847 173.6909 11 P 4.7409 0.0000 0.0000 63.3134 32.2275 175.3603 12 K 4.8906 9.3852 118.8569 55.1700 37.1254 175.4143 13 L 5.0588 9.0921 121.8813 53.5541 44.5029 176.1461 14 L 5.1530 8.5862 121.0864 53.4208 44.3477 174.4501 15 Y 4.8396 9.2661 126.6612 56.5268 40.6374 173.5990 16 C 4.6284 8.7990 127.9488 56.5031 32.9026 174.3859 17 S 3.9583 8.2379 120.9466 59.4065 63.2750 174.7451 18 N 4.2248 7.9509 120.1696 56.3621 38.5160 175.3880 19 G 3.9777 7.5966 101.6521 44.3631 0.0000 172.2868 20 G 3.8310 7.7386 106.6871 44.9376 0.0000 173.1243 21 H 5.0587 7.5247 115.1165 53.5970 32.4430 173.8874 22 F 5.2626 8.9984 120.2567 55.9872 41.0034 175.2685 23 L 4.5477 9.0689 125.9785 55.2479 43.3186 175.5923 24 R 4.9089 9.3803 126.1112 54.5850 33.6567 173.8642 25 I 4.7549 8.2117 126.0678 59.5091 39.2138 175.6218 26 L 4.1771 8.8732 128.1787 53.2473 42.3912 176.8095 27 P 4.1631 0.0000 0.0000 65.4757 31.3242 177.1107 28 D 4.5524 8.0240 115.3610 53.3071 39.7695 177.1832 29 G 4.0502 8.5236 109.7374 45.4363 0.0000 173.9038 30 T 4.3813 8.2780 117.5006 63.1860 69.1381 173.7330 31 V 4.8721 7.9531 124.2529 61.2283 34.6121 174.4123 32 D 4.5862 8.4691 124.9777 53.0332 42.7427 174.1373 33 G 4.5629 8.7097 104.9800 45.3310 0.0000 172.5241 34 T 5.0144 8.8716 115.2041 60.4955 70.9471 174.7410 35 R 4.3460 8.8632 124.2420 57.0428 31.0725 176.4666 36 D 4.5761 8.1330 118.5620 53.6607 39.9109 176.6031 37 R 3.7482 8.5713 123.1467 57.4721 29.6619 177.5200 38 S 4.4325 7.8706 112.4096 58.1435 63.6366 174.0243 39 D 4.3654 7.7498 121.6085 55.1922 41.2814 175.7799 40 Q 4.4426 8.4563 123.3068 56.4292 29.2248 175.6311 41 H 4.9713 9.2951 115.5556 55.4628 29.7200 174.8241 42 I 4.5278 7.2010 110.6455 60.1008 38.4136 175.4620 43 Q 4.2123 7.9354 121.0173 55.7854 29.1386 175.1815 44 L 4.8451 9.0553 125.2096 52.8013 45.0709 175.4909 45 Q 4.7515 8.9376 125.3950 54.6581 30.3275 174.4682 46 L 5.2117 8.5613 126.7894 54.0150 43.6126 176.3084 47 S 4.4621 8.5426 114.6286 56.8759 66.8604 172.4412 48 A 5.0083 8.0693 123.1350 50.1915 19.8590 175.7943 49 E 4.1083 9.0274 124.5962 56.0796 30.6108 176.6063 50 S 4.8093 7.7012 112.3407 55.9165 66.0812 174.0626 51 V 3.7675 8.2926 121.3568 65.0380 31.4464 176.5529 52 G 3.9924 9.2015 114.8003 45.2091 0.0000 171.9549 53 E 5.1010 8.3530 120.2259 54.7839 31.9917 175.6215 54 V 4.8856 8.9908 116.2606 59.9696 36.7788 173.8673 55 Y 5.1700 8.8657 119.9498 56.4954 41.2271 175.3235 56 I 4.3984 8.5506 122.2554 59.6420 40.5569 173.9146 57 K 4.8608 8.6617 129.4990 54.3027 34.3656 176.6201 58 S 4.7057 8.6211 122.9295 57.4279 64.2712 174.2449 59 T 3.7948 8.2294 110.0684 64.7999 68.4617 175.4630 58 T 4.5857 8.4611 120.8295 60.9279 70.2712 174.3449 59 G 3.4048 8.4094 105.2684 48.0999 0.0000 175.6630 63 Q 4.4476 7.2179 118.3285 55.7211 30.6038 174.2079 64 Y 4.8192 8.9523 119.5961 55.8367 40.4713 175.2894 65 L 4.4403 8.9796 127.0605 55.5886 43.4118 175.5847 66 A 5.1405 8.7226 125.7322 50.9886 23.2921 174.3723 67 M 5.3297 8.5173 119.3335 53.8671 34.6964 175.7846 68 D 5.2606 9.4699 126.6794 52.5555 41.1735 176.8972 69 T 4.0248 8.5541 112.7582 64.7971 67.2624 174.1059 70 D 4.7779 8.7540 119.6612 53.9896 41.1697 177.1780 71 G 3.4274 8.6449 108.0673 45.0406 0.0000 172.8542 72 L 4.8117 7.7683 119.8088 53.2315 43.4226 176.1008 73 L 5.0546 8.5840 123.7074 55.1570 42.7969 175.5486 74 Y 4.9498 8.9658 119.6143 56.1333 42.1406 173.4152 75 G 4.3035 8.8139 107.9490 44.7940 0.0000 173.2319 76 S 5.0186 9.1741 121.7626 57.1655 63.7409 175.3384 77 Q 4.2854 9.0221 125.3068 58.0670 29.0045 176.4144 78 T 4.7503 7.5655 106.1160 58.5357 71.7548 171.5727 79 P 3.7979 0.0000 0.0000 62.3654 31.9561 175.1619 80 N 5.0497 8.1969 118.5422 50.6963 40.5857 174.6234 81 E 3.9039 8.6994 115.2738 58.9914 29.7730 177.6550 82 E 4.1489 8.9394 118.8058 57.6019 29.7715 177.3704 83 C 4.9804 7.9009 115.3829 59.0775 29.1341 173.3772 84 L 4.3016 7.2491 121.1157 53.6383 42.9636 175.6575 85 F 5.2019 8.7248 121.4184 55.5848 43.5087 174.2364 86 L 4.8552 9.1351 123.2384 53.7801 42.6361 175.3834 87 E 4.5111 8.9182 126.8447 55.3029 30.2968 175.7765 88 R 4.8321 8.6109 125.2367 54.0929 34.8441 174.5005 89 L 4.7140 8.6135 123.9266 55.1883 43.2133 175.8235 90 E 4.7019 8.9953 124.8291 55.2400 33.5681 174.9514 91 E 3.9831 9.7293 123.7847 57.6717 27.3395 174.9986 92 N 4.5193 8.6536 110.8872 54.2896 36.5494 173.8643 93 H 4.8019 7.9910 116.0687 57.8003 36.2102 173.5054 94 Y 4.6687 8.1353 116.5148 57.5684 39.8801 173.7421 95 N 5.5786 9.8236 118.0572 51.9199 41.4314 174.5293 96 T 5.2640 8.7674 112.4395 60.1582 72.9844 172.5168 97 Y 5.0073 8.6798 119.2977 56.6055 41.6215 174.1788 98 I 4.6565 8.4393 125.9339 59.1410 39.6177 175.4054 99 S 4.0702 8.9811 122.7023 58.4828 62.4376 174.0153 100 K 3.9618 8.6614 129.3547 59.3282 32.2600 178.8060 101 K 3.8158 7.8608 118.3436 58.9586 32.3548 176.6812 102 H 4.5195 7.8417 114.9927 55.0085 29.3324 176.3338 103 A 3.9545 7.6922 125.6536 55.2774 18.2404 180.8321 104 E 3.7139 7.9709 111.9839 58.4922 29.6202 177.6325 105 K 4.1600 7.6136 117.3656 55.4369 32.7812 175.7508 106 N 3.9985 7.8563 115.8778 53.9964 36.4731 174.5094 107 W 5.0451 7.7083 117.4596 55.8076 31.1440 177.3335 108 F 5.4758 9.3206 123.6813 55.4444 41.8449 175.3600 109 V 4.0136 9.1152 121.4042 62.9663 32.5491 175.1765 110 G 4.5201 8.6115 112.6974 45.1900 0.0000 171.4466 111 L 5.2849 8.5772 122.7090 52.3571 44.7457 177.0717 112 K 4.1538 8.9662 123.7142 55.6851 32.7475 178.3445 113 K 3.8896 8.4629 119.7508 59.1167 31.9472 177.8724 114 N 4.5517 8.0846 113.9489 52.7583 37.9149 175.8431 115 G 3.5337 8.3846 109.1452 45.1293 0.0000 173.5323 116 S 4.7431 8.3819 115.0692 57.0626 64.5150 173.5046 117 C 4.7452 8.2805 119.4570 59.8242 28.6736 173.1506 118 K 4.3355 8.7348 124.1504 55.6004 33.1460 176.4026 119 R 4.0678 8.4828 126.2259 55.7964 31.3515 176.9428 120 G 3.1806 8.6844 114.7762 48.3296 0.0000 174.2719 121 P 4.1850 0.0000 0.0000 64.2845 31.4216 177.7170 122 R 4.1745 7.6033 115.7495 56.9583 30.4208 176.5790 123 T 5.0304 7.1298 107.7970 60.4003 70.5228 173.7378 124 H 4.8098 7.9378 116.5880 54.9903 32.5561 173.3166 125 Y 3.8644 8.6148 120.0237 59.8617 38.1674 177.0199 126 G 4.0333 9.0144 111.5544 45.4240 0.0000 173.9193 127 Q 4.2645 7.4271 118.8399 55.1103 29.8783 177.1458 128 K 3.8187 8.3025 119.1337 58.6930 32.7707 179.4350 129 A 3.9796 8.0802 121.2774 53.9357 18.3311 178.4588 130 I 4.4199 7.1508 105.8676 60.3476 38.3681 175.2615 131 L 4.3353 7.2684 123.3031 54.0299 42.6039 175.7830 132 F 5.2901 9.4536 122.5893 55.5671 43.3338 174.1868 133 L 5.2137 9.1443 121.7264 52.2796 44.4039 174.1807 134 P 5.1006 0.0000 0.0000 62.8054 32.3606 175.7299 135 L 5.0076 9.0570 122.4016 52.1650 46.1400 174.4073 136 P 4.6500 0.0000 0.0000 62.5104 32.3913 177.0855 137 V 3.7630 8.1617 114.2159 61.7851 31.6335 176.3571 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 1C H 8.44 4.76 0.00 3.12 3.30 0.00 5.65 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1D H 8.64 4.67 0.00 3.19 3.17 0.00 5.64 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1E H 7.71 5.09 0.00 3.18 3.32 0.00 5.71 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1F H 8.94 4.62 0.00 3.33 3.40 0.00 5.66 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1G F 8.39 4.98 0.00 2.89 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 2 N 8.42 4.68 0.00 2.97 2.78 0.00 0.00 6.85 6.74 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 3 L 8.08 4.77 0.00 1.45 1.39 0.57 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 4 P 0.00 4.51 0.00 2.19 2.08 0.00 3.68 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.91 0.00 5 P 0.00 4.41 0.00 2.17 2.07 0.00 3.71 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 6 G 8.50 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 N 8.05 4.58 0.00 2.66 2.68 0.00 0.00 5.93 7.55 0.00 0.00 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 Y 8.02 4.78 0.00 3.04 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 8.38 4.05 0.00 1.89 1.91 0.00 1.64 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.51 1.45 7.81 10 K 7.58 4.74 0.00 1.70 1.68 0.00 1.75 0.00 0.00 1.76 0.00 0.00 3.05 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.39 7.81 11 P 0.00 4.74 0.00 2.06 2.05 0.00 3.73 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.99 0.00 12 K 9.39 4.89 0.00 1.64 1.83 0.00 1.70 0.00 0.00 1.67 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.56 1.63 7.81 13 L 9.09 5.06 0.00 1.70 1.73 0.55 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 14 L 8.59 5.15 0.00 1.53 1.58 0.31 0.82 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 15 Y 9.27 4.84 0.00 3.26 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 16 C 8.80 4.63 0.00 2.29 2.47 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 17 S 8.24 3.96 0.00 4.06 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 18 N 7.95 4.22 0.00 2.60 2.66 0.00 0.00 6.76 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 19 G 7.60 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 20 G 7.74 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 21 H 7.52 5.06 0.00 3.04 3.17 0.00 5.80 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 22 F 9.00 5.26 0.00 3.16 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 23 L 9.07 4.55 0.00 1.80 1.51 0.94 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 24 R 9.38 4.91 0.00 1.91 2.04 0.00 3.17 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.79 0.00 25 I 8.21 4.75 1.83 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.74 0.88 0.00 0.00 26 L 8.87 4.18 0.00 1.80 1.51 0.92 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.16 0.00 1.99 2.10 0.00 3.50 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.96 0.00 28 D 8.02 4.55 0.00 2.79 2.76 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 29 G 8.52 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 30 T 8.28 4.38 4.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 31 V 7.95 4.87 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 0.88 0.00 0.00 0.94 0.00 0.00 32 D 8.47 4.59 0.00 2.96 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 G 8.71 4.56 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 T 8.87 5.01 4.33 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 1.42 0.00 0.00 35 R 8.86 4.35 0.00 1.90 2.01 0.00 3.24 0.00 0.00 3.11 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 36 D 8.13 4.58 0.00 2.84 2.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 R 8.57 3.75 0.00 1.74 1.88 0.00 3.08 0.00 0.00 3.37 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 38 S 7.87 4.43 0.00 4.01 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 39 D 7.75 4.37 0.00 2.85 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.46 4.44 0.00 1.82 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 7.18 0.00 0.00 0.00 0.00 0.00 2.25 2.24 0.00 41 H 9.30 4.97 0.00 3.27 3.43 0.00 5.78 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 I 7.20 4.53 1.88 0.00 0.00 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 1.40 0.90 1.03 0.00 0.00 43 Q 7.94 4.21 0.00 1.90 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.72 0.00 0.00 0.00 0.00 0.00 2.31 2.39 0.00 44 L 9.06 4.85 0.00 1.57 1.45 0.80 0.44 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 45 Q 8.94 4.75 0.00 2.12 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.36 0.00 46 L 8.56 5.21 0.00 1.79 1.57 0.88 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.54 4.46 0.00 3.88 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 48 A 8.07 5.01 1.23 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 0.00 0.00 49 E 9.03 4.11 0.00 1.80 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 2.24 2.38 0.00 50 S 7.70 4.81 0.00 4.13 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 51 V 8.29 3.77 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 0.96 0.00 0.00 1.03 0.00 0.00 52 G 9.20 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 53 E 8.35 5.10 0.00 2.04 1.71 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 2.21 2.27 0.00 54 V 8.99 4.89 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 0.74 0.00 0.00 1.22 0.00 0.00 55 Y 8.87 5.17 0.00 2.98 3.03 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 0.00 0.00 0.00 56 I 8.55 4.40 1.74 0.00 0.00 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.72 0.68 0.00 0.00 57 K 8.66 4.86 0.00 1.39 1.53 0.00 1.36 0.00 0.00 1.07 0.00 0.00 2.77 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.05 0.92 7.81 58 S 8.62 4.71 0.00 3.95 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 59 T 8.23 3.79 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 1.31 0.00 0.00 58 T 8.46 4.59 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 1.21 0.00 0.00 59 G 8.41 3.40 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 63 Q 7.22 4.45 0.00 1.97 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.68 6.82 0.00 0.00 0.00 0.00 0.00 2.57 2.36 0.00 64 Y 8.95 4.82 0.00 2.87 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 65 L 8.98 4.44 0.00 1.62 1.50 0.80 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.72 5.14 0.62 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 67 M 8.52 5.33 0.00 2.28 2.26 0.00 0.00 0.00 0.00 0.00 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.72 0.00 68 D 9.47 5.26 0.00 2.92 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 69 T 8.55 4.02 4.33 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 1.26 0.00 0.00 70 D 8.75 4.78 0.00 2.79 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 71 G 8.64 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 L 7.77 4.81 0.00 1.87 1.63 0.91 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 73 L 8.58 5.05 0.00 1.57 1.62 0.91 0.96 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 74 Y 8.97 4.95 0.00 3.01 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 75 G 8.81 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 76 S 9.17 5.02 0.00 3.82 3.78 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 77 Q 9.02 4.29 0.00 2.15 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.54 0.00 0.00 0.00 0.00 0.00 2.44 2.34 0.00 78 T 7.57 4.75 4.19 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 1.23 0.00 0.00 79 P 0.00 3.80 0.00 1.58 0.49 0.00 3.51 0.00 0.00 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.44 0.00 80 N 8.20 5.05 0.00 2.91 2.92 0.00 0.00 6.01 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 81 E 8.70 3.90 0.00 2.03 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 2.24 2.25 0.00 82 E 8.94 4.15 0.00 2.31 2.33 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 2.39 2.34 0.00 83 C 7.90 4.98 0.00 3.22 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.25 4.30 0.00 1.32 1.29 0.77 0.11 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 85 F 8.72 5.20 0.00 3.04 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 86 L 9.14 4.86 0.00 1.51 1.61 0.88 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 87 E 8.92 4.51 0.00 2.14 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 2.20 1.93 0.00 88 R 8.61 4.83 0.00 1.76 1.79 0.00 3.15 0.00 0.00 2.92 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 89 L 8.61 4.71 0.00 1.61 1.60 0.98 0.86 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 90 E 9.00 4.70 0.00 2.23 1.86 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 2.28 2.42 0.00 91 E 9.73 3.98 0.00 2.52 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 0.00 2.38 2.39 0.00 92 N 8.65 4.52 0.00 2.87 2.90 0.00 0.00 6.85 8.16 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 93 H 7.99 4.80 0.00 2.95 2.95 0.00 5.94 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 Y 8.14 4.67 0.00 3.05 3.05 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 95 N 9.82 5.58 0.00 3.03 2.60 0.00 0.00 6.95 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 T 8.77 5.26 4.54 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 1.37 0.00 0.00 97 Y 8.68 5.01 0.00 2.79 2.76 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 98 I 8.44 4.66 1.67 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.20 0.59 0.00 0.00 99 S 8.98 4.07 0.00 4.06 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 0.00 100 K 8.66 3.96 0.00 1.67 1.64 0.00 1.66 0.00 0.00 1.44 0.00 0.00 2.77 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.28 7.81 101 K 7.86 3.82 0.00 1.75 1.58 0.00 1.71 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.14 1.32 7.81 102 H 7.84 4.52 0.00 3.04 2.25 0.00 5.69 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 7.69 3.95 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 0.00 104 E 7.97 3.71 0.00 1.77 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 0.00 2.10 2.13 0.00 105 K 7.61 4.16 0.00 0.94 1.49 0.00 1.48 0.00 0.00 1.45 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.01 7.81 106 N 7.86 4.00 0.00 3.02 3.09 0.00 0.00 6.89 8.43 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 0.00 107 W 7.71 5.05 0.00 3.30 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 0.00 108 F 9.32 5.48 0.00 2.80 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 0.00 109 V 9.12 4.01 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 0.62 0.00 0.00 0.44 0.00 0.00 110 G 8.61 4.52 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 0.00 111 L 8.58 5.28 0.00 1.46 1.47 1.03 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 112 K 8.97 4.15 0.00 1.96 1.68 0.00 1.63 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.40 1.36 7.81 113 K 8.46 3.89 0.00 1.71 1.85 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.65 1.40 7.81 114 N 8.08 4.55 0.00 2.79 2.91 0.00 0.00 6.25 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 G 8.38 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 0.00 0.00 0.00 116 S 8.38 4.74 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 0.00 117 C 8.28 4.75 0.00 2.88 2.91 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 0.00 118 K 8.73 4.34 0.00 1.84 1.65 0.00 1.73 0.00 0.00 1.56 0.00 0.00 2.78 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.35 1.32 7.81 119 R 8.48 4.07 0.00 1.82 1.59 0.00 3.27 0.00 0.00 3.24 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.48 0.00 120 G 8.68 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 P 0.00 4.19 0.00 1.90 2.17 0.00 3.06 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 122 R 7.60 4.17 0.00 1.86 1.91 0.00 3.28 0.00 0.00 3.25 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.63 0.00 123 T 7.13 5.03 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 0.00 124 H 7.94 4.81 0.00 3.16 3.24 0.00 5.63 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 Y 8.61 3.86 0.00 3.12 2.91 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 0.00 126 G 9.01 4.03 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 0.00 0.00 0.00 0.00 0.00 0.00 127 Q 7.43 4.26 0.00 1.88 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.93 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.42 0.00 128 K 8.30 3.82 0.00 1.78 1.64 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.74 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.27 7.81 129 A 8.08 3.98 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 0.00 130 I 7.15 4.42 1.65 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.81 0.56 0.00 0.00 131 L 7.27 4.34 0.00 1.11 0.64 0.28 0.77 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 0.00 132 F 9.45 5.29 0.00 3.37 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 0.00 133 L 9.14 5.21 0.00 1.86 1.70 1.11 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 134 P 0.00 5.10 0.00 2.16 2.20 0.00 3.79 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.08 0.00 135 L 9.06 5.01 0.00 1.68 1.60 1.06 1.29 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 0.00 136 P 0.00 4.65 0.00 1.93 1.98 0.00 3.68 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 2.12 0.00 137 V 8.16 3.76 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 0.62 0.00 0.00 0.91 0.00 0.00