NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- -1 G 3.9280 8.3393 109.7392 45.4967 0.0000 174.9565 0 S 4.2076 7.7129 114.6088 57.7161 65.0029 173.4923 1 M 4.1210 8.9309 123.7892 58.4913 32.0290 180.1800 2 A 3.9739 7.9103 120.5473 55.1195 18.6919 179.4679 3 S 4.0716 8.3720 111.9114 61.5610 62.4412 176.4983 4 I 3.7235 7.9240 122.5302 64.2056 36.8542 177.8788 5 F 4.0535 8.4273 121.6256 61.9164 39.1660 177.3037 6 T 4.0585 8.3883 115.1543 66.7858 68.2835 176.8102 7 K 4.0094 8.1913 120.3153 59.3053 32.0201 179.5512 8 I 3.7944 8.0425 121.7529 63.8506 36.7860 178.6237 9 I 3.7849 7.1480 112.3743 63.6919 37.4752 177.0089 10 N 4.6063 8.0911 115.4693 52.2169 38.9462 174.8959 11 R 3.8051 7.6684 118.5192 57.6510 28.2246 176.6037 12 E 4.5640 8.5855 115.8489 56.2405 30.9103 176.6821 13 L 4.8584 7.3467 117.9288 51.7344 45.6624 174.0358 14 P 4.4384 0.0000 0.0000 62.7311 31.8490 176.1491 15 G 3.9961 8.4433 109.9677 43.8270 0.0000 173.0436 16 R 4.5308 7.9571 119.5252 54.6265 29.9415 175.5305 17 F 4.8488 8.7733 121.6165 57.4233 39.6972 175.5361 18 V 4.5771 9.0338 113.8261 61.5111 33.7321 175.1524 19 Y 4.7804 8.0258 120.2990 56.7436 42.2399 173.0712 20 E 4.9734 7.4470 125.3184 55.1641 31.4857 173.6904 21 D 4.9106 8.9437 125.9910 51.8982 42.3016 175.5337 22 D 4.6631 8.8603 117.2291 57.0750 41.1207 176.8909 23 D 4.9345 8.1252 116.3686 54.1686 43.2617 175.9394 24 V 5.1066 8.8430 118.5608 61.1790 35.3133 174.8396 25 V 5.3924 9.2267 119.2662 59.7038 35.9656 174.3780 26 A 5.7383 9.7038 123.6187 49.3896 22.6091 175.2034 27 F 5.1820 7.6915 114.7464 55.0645 41.6829 173.5372 28 L 4.5599 8.6456 120.8376 54.7945 41.9654 177.4716 29 T 4.0886 8.0604 117.9772 61.9900 67.8156 174.4331 30 I 4.1055 8.2228 118.7495 61.7645 38.7410 175.7722 31 E 5.2972 7.9590 119.5263 53.2650 29.5554 173.8002 32 P 4.3120 0.0000 0.0000 62.5311 32.9027 178.4314 33 M 3.7674 8.7453 121.9514 57.9326 32.3744 176.5179 34 T 4.5404 6.9669 106.3178 59.0670 72.1815 172.6324 35 Q 3.9585 8.2195 123.6826 57.6042 29.2976 176.4767 36 G 3.5427 8.6581 113.0481 44.6944 0.0000 172.4993 37 H 4.4494 8.0284 120.5370 57.0926 30.7358 174.1134 38 T 4.9019 9.4040 122.8811 61.7233 72.2175 173.0605 39 L 4.8976 8.5703 125.0900 53.1183 43.9930 175.4685 40 V 4.6638 8.6172 124.6844 61.2461 33.5726 174.6876 41 V 4.9309 9.1303 127.8904 60.3215 34.7346 172.7434 42 P 4.8750 0.0000 0.0000 63.1042 31.4613 176.7361 43 R 4.3695 9.1337 122.8573 59.2775 30.4966 177.7577 44 E 4.0477 8.2048 115.4437 55.9919 30.1923 176.4822 45 E 4.0767 8.6318 122.6870 56.0403 29.3587 175.3528 46 I 4.8001 7.9754 119.5597 59.2620 41.6329 173.4909 47 D 4.7218 8.3981 120.5387 54.3612 45.1799 171.6794 48 N 4.3625 8.9040 120.0298 52.3757 34.7155 174.7149 49 W 4.3609 8.4211 119.2130 59.3973 28.4010 179.5670 50 Q 2.9684 6.2079 115.1161 57.5509 28.0306 176.3093 51 D 4.5075 7.3754 116.5031 54.3143 41.6019 177.2564 52 V 3.8537 7.0430 112.9482 60.4473 32.3503 176.1151 53 D 4.4789 8.6005 121.3112 54.7114 42.8513 177.7556 54 S 4.2530 8.7539 120.8141 61.5578 63.1154 176.5457 55 A 4.0068 8.1016 123.6901 54.8270 18.1820 179.3161 56 A 3.9696 8.6290 119.3984 55.3107 18.4594 179.4942 57 F 4.3068 8.6117 119.5056 61.8504 39.4117 177.1472 58 N 4.2103 8.8834 116.2879 56.0775 38.2364 177.7073 59 R 3.8733 8.0655 119.6637 59.2297 30.2241 179.1611 60 V 3.5498 7.7094 117.9454 66.4330 31.4930 178.0526 61 M 3.9826 8.1359 118.7822 57.7787 31.5275 179.0101 62 G 3.5103 8.1117 106.3312 47.9038 0.0000 175.9760 63 V 3.3574 7.6270 121.2734 65.4893 31.4465 178.2059 64 S 4.0212 7.9757 114.9806 61.5002 62.5057 176.6028 65 Q 3.9123 8.1275 120.8783 58.8694 28.4798 178.7194 66 L 3.8798 7.5729 120.9636 58.1390 42.0202 179.0871 67 I 3.7823 7.8113 119.9132 64.2279 37.1054 178.5292 68 G 3.5935 8.4591 106.9164 47.8672 0.0000 175.7352 69 K 3.9426 8.2725 121.0607 59.0651 32.0291 179.3378 70 A 3.9945 7.9988 120.9478 55.3187 18.3523 180.1922 71 V 3.9779 8.2032 111.3113 64.5832 31.5991 178.4861 72 C 4.2080 7.9886 117.8048 62.0942 27.7180 176.2059 73 K 3.8667 7.9448 120.3548 59.5581 31.6264 178.7964 74 A 3.6098 8.1888 120.1196 54.0136 18.2294 178.0794 75 F 4.5967 7.8637 115.1265 57.1587 40.0447 176.2221 76 R 3.9170 7.4671 117.5666 57.8959 26.5730 180.4621 77 T 4.8034 7.6976 109.3391 59.9454 71.7719 175.2849 78 E 3.9761 8.7970 123.8263 58.4879 30.2648 176.7235 79 R 4.8236 7.7445 115.5863 54.1724 34.6030 174.3760 80 S 4.8972 8.5593 114.8432 56.5178 65.0151 173.5962 81 G 3.5318 8.1516 113.8980 45.0043 0.0000 172.2803 82 L 5.7008 7.9795 122.0328 52.3689 45.4882 175.5364 83 I 4.7958 8.3551 125.0061 59.7866 41.8235 173.7471 84 I 4.5075 8.4454 126.3960 59.8128 38.8090 173.5052 85 A 4.5027 9.3252 128.1550 50.6949 21.5958 176.6375 86 G 4.0507 8.1185 101.9859 44.7988 0.0000 174.9850 87 L 4.0205 7.5198 118.7251 56.9267 42.0664 177.8306 88 E 4.2027 8.0269 116.9282 57.3666 30.2662 176.5923 89 V 4.1633 7.0722 115.0068 60.4392 34.1131 174.1101 90 P 4.7130 0.0000 0.0000 61.3360 30.8081 176.2163 91 H 4.8862 7.4603 116.1364 54.7556 32.9130 171.8715 92 L 4.2140 8.8103 129.3121 56.4425 42.2974 176.0630 93 H 5.1817 8.6855 119.5035 54.6209 31.5167 172.6987 94 V 4.3218 8.7927 122.1336 61.5592 33.7521 174.1164 95 H 5.1314 9.3105 126.1334 55.3673 30.2840 174.5358 96 V 4.8636 8.9445 123.2252 61.0268 34.7068 174.1148 97 F 5.2232 7.9909 121.5993 54.6710 41.4564 171.9084 98 P 4.7459 0.0000 0.0000 63.2064 32.1004 175.3494 99 T 4.9142 8.4581 115.8524 60.7557 69.8555 173.6596 100 R 4.6335 9.7945 125.3371 56.3761 32.9185 176.0482 101 S 4.7894 7.9175 110.2316 56.2472 66.3344 174.7845 102 L 4.1515 8.7006 121.6435 57.9618 41.5402 179.8730 103 S 4.3065 8.0930 111.9249 60.7633 63.1752 175.0594 104 D 4.2896 8.1110 121.0339 56.9339 40.6895 176.9397 105 F 4.0109 8.0078 118.0737 57.3378 39.3504 174.4170 106 G 3.7088 8.0580 110.6900 44.5983 0.0000 173.0559 107 F 4.5455 8.4889 115.1966 57.2734 40.6821 177.3599 108 A 4.1582 8.5169 125.8156 55.5609 18.1850 179.4278 109 N 5.0072 7.6954 110.6332 51.8820 38.5478 177.3178 110 V 3.6583 7.5982 112.0137 61.9005 32.6199 175.9100 111 D 4.4194 8.8922 125.3428 54.6128 40.6688 177.7043 112 R 4.3769 8.4696 124.5793 56.9758 30.4115 172.9157 113 N 5.0821 8.2432 115.4029 52.7360 39.3090 172.5432 114 P 4.5579 0.0000 0.0000 62.3100 33.0441 177.7801 115 S 4.3557 7.9687 116.8806 57.5955 64.9969 173.7569 116 P 4.2444 0.0000 0.0000 66.2217 31.0049 178.3827 117 E 3.9701 8.1742 118.8323 58.9107 29.5454 178.5991 118 S 4.2097 8.1207 114.4434 61.6249 62.8376 176.6689 119 L 4.0156 7.9692 122.4196 57.4239 41.4142 179.0014 120 D 4.3823 8.5083 119.3507 57.4193 40.7060 178.5871 121 E 3.9482 8.8676 119.8105 59.1468 29.6309 178.5720 122 A 4.3792 8.3695 121.1152 55.3513 18.4644 179.3248 123 Q 3.9520 8.3860 117.8301 59.4485 29.1714 178.5051 124 A 4.0320 8.1993 121.7524 55.0782 18.3619 179.8227 125 K 3.8671 8.3658 117.3131 59.4821 32.0273 179.7422 126 I 3.6929 7.9934 120.2147 64.3344 37.0720 178.5766 127 K 4.0041 8.2821 119.1442 59.4302 31.8609 179.2541 128 A 3.9705 8.2068 120.7895 55.0504 18.3185 179.5454 129 A 4.0562 8.1442 119.3753 55.3584 18.4877 179.8268 130 L 3.9691 8.4144 117.7233 57.9068 41.4481 179.6407 131 A 4.0411 7.9609 119.8497 55.3305 18.3847 179.4559 132 Q 4.0882 7.9405 115.6982 58.9677 28.8279 178.5394 133 L 4.1401 7.9758 119.2287 57.2342 41.7614 177.4734 134 A 4.3177 7.9309 124.4863 52.5506 18.4918 176.9551 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 G 8.34 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 0 S 7.71 4.21 0.00 4.15 4.02 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 1 M 8.93 4.12 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.58 0.00 2 A 7.91 3.97 1.35 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 0.00 0.00 0.00 3 S 8.37 4.07 0.00 3.92 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 4 I 7.92 3.72 1.93 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 1.43 0.62 0.92 0.00 0.00 5 F 8.43 4.05 0.00 3.24 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 6 T 8.39 4.06 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 1.29 0.00 0.00 7 K 8.19 4.01 0.00 1.94 1.84 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.64 7.81 8 I 8.04 3.79 1.41 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 1.17 -0.39 0.00 0.00 9 I 7.15 3.78 1.90 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.61 0.63 0.00 0.00 10 N 8.09 4.61 0.00 2.79 2.90 0.00 0.00 7.12 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 11 R 7.67 3.81 0.00 1.90 1.93 0.00 2.89 0.00 0.00 3.11 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.48 0.00 12 E 8.59 4.56 0.00 1.88 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 2.24 2.42 0.00 13 L 7.35 4.86 0.00 1.60 1.46 0.91 1.09 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 14 P 0.00 4.44 0.00 2.03 1.99 0.00 3.60 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 15 G 8.44 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 16 R 7.96 4.53 0.00 1.79 1.94 0.00 3.15 0.00 0.00 3.37 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.66 0.00 17 F 8.77 4.85 0.00 2.91 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 18 V 9.03 4.58 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 0.75 0.00 0.00 1.08 0.00 0.00 19 Y 8.03 4.78 0.00 3.07 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 E 7.45 4.97 0.00 1.88 1.61 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 2.11 2.09 0.00 21 D 8.94 4.91 0.00 2.88 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 22 D 8.86 4.66 0.00 2.72 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 23 D 8.13 4.93 0.00 2.74 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 24 V 8.84 5.11 2.25 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 1.16 0.00 0.00 1.01 0.00 0.00 25 V 9.23 5.39 2.59 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 0.78 0.00 0.00 1.33 0.00 0.00 26 A 9.70 5.74 1.26 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 0.00 0.00 0.00 27 F 7.69 5.18 0.00 2.55 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 8.65 4.56 0.00 1.56 1.64 1.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 29 T 8.06 4.09 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 0.00 0.00 30 I 8.22 4.11 1.88 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 1.46 0.75 0.93 0.00 0.00 31 E 7.96 5.30 0.00 1.98 1.91 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 2.23 2.18 0.00 32 P 0.00 4.31 0.00 2.28 2.08 0.00 3.83 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 2.00 1.92 0.00 33 M 8.75 3.77 0.00 1.37 1.04 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 34 T 6.97 4.54 4.10 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 1.09 0.00 0.00 35 Q 8.22 3.96 0.00 1.92 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.57 0.00 0.00 0.00 0.00 0.00 2.18 2.30 0.00 36 G 8.66 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 H 8.03 4.45 0.00 3.28 3.07 0.00 5.55 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 9.40 4.90 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 1.16 0.00 0.00 39 L 8.57 4.90 0.00 0.62 1.34 0.95 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 40 V 8.62 4.66 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 1.00 0.00 0.00 0.84 0.00 0.00 41 V 9.13 4.93 2.25 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 1.33 0.00 0.00 0.84 0.00 0.00 42 P 0.00 4.87 0.00 2.24 2.16 0.00 4.28 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.15 0.00 43 R 9.13 4.37 0.00 1.78 2.12 0.00 3.39 0.00 0.00 3.32 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.80 0.00 44 E 8.20 4.05 0.00 2.12 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 2.35 2.35 0.00 45 E 8.63 4.08 0.00 2.01 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 2.30 2.36 0.00 46 I 7.98 4.80 1.91 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.87 0.94 0.00 0.00 47 D 8.40 4.72 0.00 2.79 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 N 8.90 4.36 0.00 2.89 2.76 0.00 0.00 6.53 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 49 W 8.42 4.36 0.00 3.48 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 50 Q 6.21 2.97 0.00 1.26 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.90 0.00 0.00 0.00 0.00 0.00 1.82 1.79 0.00 51 D 7.38 4.51 0.00 2.67 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 V 7.04 3.85 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 0.76 0.00 0.00 1.10 0.00 0.00 53 D 8.60 4.48 0.00 2.81 2.59 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 54 S 8.75 4.25 0.00 4.19 4.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 A 8.10 4.01 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 56 A 8.63 3.97 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 57 F 8.61 4.31 0.00 3.24 3.32 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 58 N 8.88 4.21 0.00 2.79 2.84 0.00 0.00 7.08 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 59 R 8.07 3.87 0.00 2.10 2.00 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.81 0.00 60 V 7.71 3.55 2.19 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 1.02 0.00 0.00 1.06 0.00 0.00 61 M 8.14 3.98 0.00 1.74 1.69 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 1.39 1.52 0.00 62 G 8.11 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.63 3.36 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.00 0.00 0.78 0.00 0.00 64 S 7.98 4.02 0.00 3.92 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 65 Q 8.13 3.91 0.00 2.20 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.81 0.00 0.00 0.00 0.00 0.00 2.30 2.49 0.00 66 L 7.57 3.88 0.00 1.62 1.66 0.92 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 67 I 7.81 3.78 1.90 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 1.49 0.72 0.89 0.00 0.00 68 G 8.46 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 69 K 8.27 3.94 0.00 1.95 1.86 0.00 1.65 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.59 7.81 70 A 8.00 3.99 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 71 V 8.20 3.98 2.30 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 1.08 0.00 0.00 1.00 0.00 0.00 72 C 7.99 4.21 0.00 3.16 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 73 K 7.94 3.87 0.00 1.93 1.91 0.00 1.61 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.38 1.42 7.81 74 A 8.19 3.61 0.67 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 0.00 0.00 75 F 7.86 4.60 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 76 R 7.47 3.92 0.00 2.03 1.85 0.00 3.21 0.00 0.00 3.27 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.42 0.00 77 T 7.70 4.80 4.43 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 1.32 0.00 0.00 78 E 8.80 3.98 0.00 1.94 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 2.39 0.00 79 R 7.74 4.82 0.00 1.77 1.75 0.00 3.13 0.00 0.00 3.26 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 80 S 8.56 4.90 0.00 3.76 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 81 G 8.15 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 82 L 7.98 5.70 0.00 1.43 1.38 0.80 0.95 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 83 I 8.36 4.80 2.00 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 1.58 0.76 1.09 0.00 0.00 84 I 8.45 4.51 1.36 0.00 0.00 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 1.19 0.37 0.99 0.00 0.00 85 A 9.33 4.50 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 86 G 8.12 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 87 L 7.52 4.02 0.00 1.47 1.64 0.85 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 88 E 8.03 4.20 0.00 1.91 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 2.16 2.07 0.00 89 V 7.07 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 -0.02 0.00 0.00 0.74 0.00 0.00 90 P 0.00 4.71 0.00 2.21 2.07 0.00 3.30 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.89 0.00 91 H 7.46 4.89 0.00 3.10 2.96 0.00 5.78 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 L 8.81 4.21 0.00 1.83 1.82 1.17 1.46 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 93 H 8.69 5.18 0.00 3.24 3.42 0.00 5.55 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 94 V 8.79 4.32 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 0.98 0.00 0.00 0.93 0.00 0.00 95 H 9.31 5.13 0.00 3.30 3.33 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.94 4.86 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 0.77 0.00 0.00 0.85 0.00 0.00 97 F 7.99 5.22 0.00 2.85 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 P 0.00 4.75 0.00 2.13 2.36 0.00 3.63 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.55 0.00 99 T 8.46 4.91 4.17 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 100 R 9.79 4.63 0.00 1.75 1.93 0.00 3.19 0.00 0.00 3.29 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.53 0.00 101 S 7.92 4.79 0.00 3.97 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 0.00 102 L 8.70 4.15 0.00 1.76 1.79 0.89 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 103 S 8.09 4.31 0.00 3.98 4.02 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 0.00 104 D 8.11 4.29 0.00 2.64 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.01 4.01 0.00 3.14 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 0.00 106 G 8.06 3.71 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 0.00 0.00 0.00 107 F 8.49 4.55 0.00 3.04 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 0.00 108 A 8.52 4.16 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 109 N 7.70 5.01 0.00 2.73 2.67 0.00 0.00 6.68 7.67 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 0.00 110 V 7.60 3.66 2.19 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 0.73 0.00 0.00 0.99 0.00 0.00 111 D 8.89 4.42 0.00 2.60 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 R 8.47 4.38 0.00 1.87 1.81 0.00 3.30 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.18 0.00 113 N 8.24 5.08 0.00 2.60 2.69 0.00 0.00 7.14 7.26 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 0.00 114 P 0.00 4.56 0.00 2.20 2.00 0.00 3.81 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.00 0.00 115 S 7.97 4.36 0.00 4.26 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 0.00 116 P 0.00 4.24 0.00 2.29 2.36 0.00 3.70 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.03 0.00 117 E 8.17 3.97 0.00 2.03 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 2.39 2.32 0.00 118 S 8.12 4.21 0.00 4.11 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.97 4.02 0.00 1.90 1.77 0.92 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 120 D 8.51 4.38 0.00 2.86 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 0.00 121 E 8.87 3.95 0.00 2.29 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 0.00 2.38 2.36 0.00 122 A 8.37 4.38 1.53 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 0.00 123 Q 8.39 3.95 0.00 2.26 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.56 0.00 124 A 8.20 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 K 8.37 3.87 0.00 1.70 1.44 0.00 1.63 0.00 0.00 1.36 0.00 0.00 2.87 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.32 1.48 7.81 126 I 7.99 3.69 1.97 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.96 0.99 0.00 0.00 127 K 8.28 4.00 0.00 1.98 1.89 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.53 1.70 7.81 128 A 8.21 3.97 1.35 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 0.00 0.00 0.00 129 A 8.14 4.06 1.31 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 0.00 0.00 0.00 0.00 0.00 0.00 130 L 8.41 3.97 0.00 1.89 1.81 1.09 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 131 A 7.96 4.04 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 0.00 132 Q 7.94 4.09 0.00 2.20 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.95 0.00 0.00 0.00 0.00 0.00 2.38 2.54 0.00 133 L 7.98 4.14 0.00 1.78 1.73 0.94 0.64 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 0.00 134 A 7.93 4.32 1.35 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 0.00 0.00 0.00