NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4312 8.3044 120.3299 55.2364 33.4078 173.8913 2 E 4.0210 8.4309 120.0873 55.0700 30.5353 175.4069 3 A 4.0480 9.3064 129.0654 52.9150 19.7143 177.4648 4 L 3.9980 8.4872 121.4321 55.7373 42.1007 178.3525 5 G 3.8656 9.5450 104.9783 45.3794 0.0000 172.5696 6 A 4.7320 7.4913 117.8847 50.6416 22.2464 176.3112 7 D 4.7273 9.0535 121.7975 53.4352 42.4674 175.8577 8 V 4.6375 8.4250 122.5909 61.4401 34.4684 175.4258 9 T 4.3807 8.3968 123.6141 61.1778 68.5474 173.3038 10 Q 3.8069 8.4755 123.9177 56.5791 28.9534 177.9092 11 G 4.0626 8.8095 108.6396 46.0843 0.0000 172.8288 12 L 5.0465 8.2976 120.7986 52.9249 45.5033 175.1650 13 E 5.1086 8.8951 119.1797 53.9331 34.3322 175.4369 14 K 3.9865 8.6797 123.4512 58.1811 32.4618 177.1334 15 G 4.0658 8.9749 115.3193 45.1756 0.0000 174.0608 16 S 4.3000 8.2993 116.7865 58.6533 64.1605 173.2671 17 L 5.1616 8.4381 123.5681 53.3173 43.1343 175.5874 18 I 4.6851 8.9364 117.3102 59.2322 41.8442 174.1007 19 T 4.5483 8.5796 118.4103 62.7935 70.1579 174.4902 20 C 4.8398 8.7136 126.9029 57.4563 31.2674 174.0835 21 A 4.5227 8.7431 134.1244 49.7716 15.7725 174.4285 22 D 5.0772 7.6056 120.2923 53.0878 42.5743 176.9721 23 N 4.9455 8.2941 113.5632 53.0079 37.9375 177.2171 24 T 3.6155 7.9464 111.3902 63.7469 68.9621 175.0533 25 G 3.9557 7.7606 108.7336 45.0151 0.0000 172.8166 26 A 4.7291 7.4809 123.4407 51.2743 19.6305 176.4064 27 R 4.3398 8.5810 123.3032 57.0424 31.5056 175.3387 28 E 4.9719 7.8875 118.8979 54.6065 32.1780 174.1137 29 L 5.1820 9.1189 126.0385 52.7530 45.7509 175.2162 30 K 4.9523 8.5372 122.7491 54.3188 34.8455 175.5116 31 V 3.8921 8.8953 128.9865 63.5648 31.9696 176.0591 32 I 4.3262 8.2995 127.8035 62.8610 39.4161 175.7157 33 S 4.6618 7.7318 114.9740 57.5809 68.1135 173.4929 34 V 4.5703 8.1739 120.8382 61.0282 33.6567 174.4539 35 H 4.2521 9.1364 128.7936 57.6361 30.1224 175.3063 36 G 3.8721 8.5276 113.1183 46.0461 0.0000 172.2409 37 Y 4.6701 7.7274 120.3560 55.5996 40.2090 175.1048 38 S 4.3541 7.3639 120.2282 56.4920 66.7239 172.8041 39 G 4.1891 7.7582 120.5166 44.4901 0.0000 175.0648 40 T 4.2422 8.5332 116.4334 60.4014 69.6907 171.6571 41 K 4.0533 8.4564 126.4564 57.7759 32.4137 176.5813 42 N 4.4699 8.9923 122.1065 53.5450 37.1528 174.3163 43 R 4.0565 8.1496 119.6322 55.5501 30.3285 175.8581 44 L 4.1558 8.5067 126.5702 53.6099 42.2130 174.9727 45 P 4.6000 0.0000 0.0000 63.5778 31.8254 175.2573 46 K 5.0074 8.0483 123.0450 55.2166 34.8286 175.5201 47 A 4.6944 8.9752 123.2525 50.7179 23.1445 175.9207 48 G 3.8748 9.4945 108.1674 44.0155 0.0000 171.2033 49 L 3.9873 8.7259 121.9547 56.9143 42.0642 178.1504 50 G 4.0618 9.1572 114.9664 45.1384 0.0000 172.8158 51 D 4.8416 7.9586 120.0117 53.3871 42.9339 175.2507 52 K 4.9227 8.6481 123.2191 55.0783 33.8827 175.1650 53 I 5.0492 8.4875 120.3101 59.3718 41.3899 174.8125 54 T 4.6705 8.6872 120.0499 63.3146 70.3642 174.0490 55 V 5.0040 8.9466 123.2041 61.7666 35.9099 173.2826 56 S 5.2389 8.7050 118.1628 56.4249 66.6368 173.2540 57 V 4.2651 8.2741 122.3734 62.5685 31.7233 176.5798 58 T 4.0897 8.5106 125.7425 65.8453 69.0408 175.5658 59 K 4.5616 8.4990 118.7078 54.9917 36.7182 176.5388 60 G 3.5992 8.7191 107.7635 44.2292 0.0000 173.2724 61 T 3.9823 8.2653 110.8387 60.9314 68.3961 173.3193 62 P 4.2010 0.0000 0.0000 66.1353 31.1104 178.4343 63 E 4.1511 8.1131 115.4816 59.7952 29.8481 178.7733 64 M 4.1962 8.4074 118.6584 56.7116 32.4101 177.2058 65 R 4.1977 6.6531 117.2340 57.9196 30.6786 177.4639 66 R 4.0511 8.6469 118.7563 56.5461 29.3365 176.8521 67 Q 4.1556 7.6825 117.2197 55.8349 30.1949 175.6175 68 V 5.2628 8.1918 122.7565 60.9461 31.1254 174.8603 69 L 4.5776 7.9441 126.8677 53.0286 44.8289 174.1104 70 E 5.0504 8.4430 119.4391 55.0639 32.6758 174.2876 71 A 4.8020 8.7210 125.6038 51.0333 23.7508 174.7779 72 V 4.6488 8.1749 117.1557 61.1378 35.2440 174.9328 73 V 4.2157 8.5057 127.5482 62.6548 31.5746 176.1809 74 V 3.9497 8.8943 129.3438 64.2037 33.2491 175.6938 75 R 4.0687 7.4446 117.4133 54.5610 34.9162 174.0925 76 Q 4.9951 8.0149 117.8647 55.2139 31.3705 175.7586 77 R 4.2771 9.3195 121.2923 58.6668 30.4280 177.7360 78 K 4.1987 7.8659 118.5460 55.5245 32.7564 175.2186 79 P 5.1143 0.0000 0.0000 62.5364 32.3269 175.1101 80 I 4.7574 8.1216 112.5810 59.5958 41.4833 173.5051 81 R 4.9936 9.0634 124.1518 54.8903 32.3286 175.3138 82 R 4.7917 8.5704 124.7550 53.9157 32.3022 175.5676 83 P 4.1712 0.0000 0.0000 65.9224 31.3989 176.7156 84 D 4.6923 8.0542 115.5601 53.3469 39.7396 176.3738 85 G 4.3404 8.3460 113.3984 46.7174 0.0000 175.1415 86 T 3.8427 7.0038 114.9650 63.4290 69.1644 172.9587 87 R 5.1956 8.2390 122.7044 54.7325 33.0170 175.7544 88 V 4.5195 8.7109 120.9302 61.1051 34.8536 174.3812 89 K 4.9531 8.3644 125.3882 55.4326 35.5121 175.3548 90 F 4.7273 8.8712 120.3093 55.6946 41.6188 176.4820 91 E 4.0813 9.0280 120.1496 58.7432 29.6717 175.0204 92 D 4.7044 7.7378 115.7237 52.9738 42.6614 173.6367 93 N 5.1124 8.7167 115.1821 51.6850 40.7446 174.2615 94 A 5.2129 9.0187 124.8550 50.3508 23.3203 174.4803 95 A 5.0971 9.3204 121.1574 50.2753 23.8327 175.2006 96 V 4.5599 8.3353 118.6166 60.7183 34.3200 175.2219 97 I 4.1559 8.0900 128.1835 62.3123 38.1318 175.2891 98 V 4.8253 8.8837 124.4995 61.8788 35.2378 174.5515 99 D 4.9612 8.1235 124.1507 52.1240 41.6513 176.7063 100 E 3.9733 8.7509 116.8289 59.6746 28.2812 177.3373 101 N 4.6903 9.8225 115.9077 52.5760 38.6317 175.3087 102 E 3.8565 7.8580 115.6709 57.3384 27.8635 173.6917 103 D 5.1494 7.7696 118.2817 51.2265 42.0415 174.5688 104 P 4.6445 0.0000 0.0000 62.9620 31.6484 176.1770 105 R 3.8837 8.5364 123.8068 59.1428 30.0954 177.0115 106 G 3.9614 7.7040 104.9542 45.1451 0.0000 172.8960 107 T 4.3150 8.3804 114.3477 64.5169 69.5064 175.4519 108 E 4.7023 9.3728 120.7963 54.4657 34.0922 175.0474 109 L 4.7102 8.4008 123.7197 52.4275 42.2150 176.5626 110 K 4.1071 8.7241 123.6713 56.0630 33.2606 177.3462 111 G 3.6480 8.7085 109.5188 45.5685 0.0000 170.5270 112 P 4.8795 0.0000 0.0000 62.7797 32.6421 175.5176 113 I 4.7467 8.1970 117.5773 59.5072 41.5634 174.9949 114 A 4.8430 8.2148 125.8830 51.8705 19.2764 179.1993 115 R 3.9050 8.9567 118.7160 59.5348 28.8537 179.1360 116 E 4.0232 8.3808 118.8949 59.3605 29.3038 179.3972 117 V 3.7192 7.6630 116.9304 65.2677 31.4999 177.8838 118 A 3.9656 8.4940 121.3762 55.3313 18.1654 179.4169 119 Q 3.9512 7.2157 115.7266 58.3588 28.9238 178.9480 120 R 4.2500 7.3203 117.0779 56.2675 32.4442 176.8060 121 F 4.9237 7.7179 121.5076 54.7927 39.1107 176.1669 122 G 3.7457 8.5655 111.8337 47.9269 0.0000 172.5943 123 S 3.8335 8.0995 118.0038 59.5394 62.4927 176.4830 124 V 3.6479 7.6639 121.6240 65.5529 31.5967 177.3073 125 A 4.1213 8.5058 121.0299 55.0164 18.2959 180.8670 126 S 4.6404 9.0214 113.1481 58.0474 62.6949 175.4357 127 A 4.6582 7.6149 119.7476 52.9725 22.2087 177.0916 128 A 4.2928 8.1896 120.3526 51.8799 19.3107 178.0308 129 T 4.0693 8.6660 120.1256 66.4778 68.7022 174.7182 130 M 4.9001 7.8323 120.0401 53.4723 35.7797 174.8154 131 I 4.7393 8.2832 121.8838 59.8069 40.7986 175.4851 132 V 4.0188 8.8582 127.1250 62.8671 31.5365 175.5170 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 2.13 0.00 0.00 0.00 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.59 0.00 2 E 8.43 4.02 0.00 1.95 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 0.00 2.21 2.33 0.00 3 A 9.31 4.05 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 4 L 8.49 4.00 0.00 1.64 1.73 0.96 0.90 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 5 G 9.55 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 A 7.49 4.73 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 7 D 9.05 4.73 0.00 2.61 2.60 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 8 V 8.42 4.64 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 0.83 0.00 0.00 0.95 0.00 0.00 9 T 8.40 4.38 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 1.22 0.00 0.00 10 Q 8.48 3.81 0.00 1.96 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.84 0.00 0.00 0.00 0.00 0.00 2.24 2.46 0.00 11 G 8.81 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 0.00 0.00 0.00 12 L 8.30 5.05 0.00 1.66 1.50 0.88 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 13 E 8.90 5.11 0.00 1.83 1.76 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 2.18 2.20 0.00 14 K 8.68 3.99 0.00 1.70 1.74 0.00 1.79 0.00 0.00 1.73 0.00 0.00 2.88 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.46 1.63 7.81 15 G 8.97 4.07 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 0.00 0.00 0.00 16 S 8.30 4.30 0.00 3.80 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 17 L 8.44 5.16 0.00 1.51 1.59 0.96 0.76 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 18 I 8.94 4.69 2.03 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.86 0.89 0.00 0.00 19 T 8.58 4.55 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 1.20 0.00 0.00 20 C 8.71 4.84 0.00 2.96 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 21 A 8.74 4.52 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 22 D 7.61 5.08 0.00 2.65 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 23 N 8.29 4.95 0.00 2.77 3.05 0.00 0.00 5.68 7.22 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 24 T 7.95 3.62 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 1.26 0.00 0.00 25 G 7.76 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 0.00 0.00 0.00 26 A 7.48 4.73 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 27 R 8.58 4.34 0.00 1.85 1.91 0.00 3.10 0.00 0.00 3.09 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 28 E 7.89 4.97 0.00 2.03 1.78 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 2.28 2.45 0.00 29 L 9.12 5.18 0.00 1.53 1.49 0.89 0.60 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 30 K 8.54 4.95 0.00 1.79 1.62 0.00 1.63 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.30 1.33 7.81 31 V 8.90 3.89 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.94 0.00 0.00 32 I 8.30 4.33 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 1.23 0.95 0.92 0.00 0.00 33 S 7.73 4.66 0.00 3.76 3.75 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 34 V 8.17 4.57 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 0.83 0.00 0.00 35 H 9.14 4.25 0.00 3.19 3.33 0.00 6.12 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 G 8.53 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 Y 7.73 4.67 0.00 2.94 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 38 S 7.36 4.35 0.00 3.77 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 39 G 7.76 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 0.00 0.00 0.00 0.00 40 T 8.53 4.24 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 1.23 0.00 0.00 41 K 8.46 4.05 0.00 1.75 1.73 0.00 1.91 0.00 0.00 1.70 0.00 0.00 2.80 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.52 7.81 42 N 8.99 4.47 0.00 2.95 3.01 0.00 0.00 7.07 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 43 R 8.15 4.06 0.00 1.78 2.01 0.00 3.36 0.00 0.00 3.37 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.66 0.00 44 L 8.51 4.16 0.00 1.86 1.62 1.01 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.60 0.00 2.18 2.46 0.00 3.72 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.06 0.00 46 K 8.05 5.01 0.00 1.63 1.73 0.00 1.47 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.00 1.03 7.81 47 A 8.98 4.69 1.11 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 0.00 0.00 0.00 0.00 0.00 48 G 9.49 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 8.73 3.99 0.00 1.72 1.62 1.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 50 G 9.16 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 0.00 0.00 0.00 51 D 7.96 4.84 0.00 2.79 2.60 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 52 K 8.65 4.92 0.00 1.86 1.69 0.00 1.48 0.00 0.00 1.68 0.00 0.00 2.61 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.34 1.44 7.81 53 I 8.49 5.05 1.99 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.89 0.89 0.00 0.00 54 T 8.69 4.67 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 1.26 0.00 0.00 55 V 8.95 5.00 2.05 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 0.99 0.00 0.00 0.95 0.00 0.00 56 S 8.71 5.24 0.00 3.90 3.89 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 57 V 8.27 4.27 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 0.96 0.00 0.00 0.91 0.00 0.00 58 T 8.51 4.09 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 1.29 0.00 0.00 59 K 8.50 4.56 0.00 1.73 1.63 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.40 1.40 7.81 60 G 8.72 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 61 T 8.27 3.98 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 62 P 0.00 4.20 0.00 2.17 2.18 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.21 0.00 63 E 8.11 4.15 0.00 1.93 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.35 0.00 64 M 8.41 4.20 0.00 1.97 2.17 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 2.69 2.71 0.00 65 R 6.65 4.20 0.00 1.96 1.88 0.00 3.24 0.00 0.00 3.22 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 66 R 8.65 4.05 0.00 1.98 2.11 0.00 3.15 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 67 Q 7.68 4.16 0.00 2.18 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 68 V 8.19 5.26 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 0.76 0.00 0.00 0.93 0.00 0.00 69 L 7.94 4.58 0.00 1.61 1.56 0.90 0.73 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 70 E 8.44 5.05 0.00 1.98 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 2.18 2.23 0.00 71 A 8.72 4.80 1.14 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 72 V 8.17 4.65 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 0.93 0.00 0.00 -0.03 0.00 0.00 73 V 8.51 4.22 2.26 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 0.90 0.00 0.00 0.94 0.00 0.00 74 V 8.89 3.95 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 0.79 0.00 0.00 0.90 0.00 0.00 75 R 7.44 4.07 0.00 1.50 1.39 0.00 3.25 0.00 0.00 3.60 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 1.26 0.00 76 Q 8.01 5.00 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.64 0.00 77 R 9.32 4.28 0.00 1.83 2.07 0.00 3.14 0.00 0.00 3.03 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.70 0.00 78 K 7.87 4.20 0.00 1.76 1.73 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.54 1.55 7.81 79 P 0.00 5.11 0.00 1.99 2.00 0.00 3.76 0.00 0.00 4.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.95 0.00 80 I 8.12 4.76 2.04 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.76 1.00 0.00 0.00 81 R 9.06 4.99 0.00 1.87 1.81 0.00 3.08 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.78 0.00 82 R 8.57 4.79 0.00 1.82 1.81 0.00 3.22 0.00 0.00 3.17 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 83 P 0.00 4.17 0.00 2.03 2.16 0.00 3.67 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 2.12 0.00 84 D 8.05 4.69 0.00 2.78 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 85 G 8.35 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 0.00 0.00 0.00 0.00 86 T 7.00 3.84 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 1.19 0.00 0.00 87 R 8.24 5.20 0.00 1.66 1.82 0.00 3.32 0.00 0.00 3.15 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.54 0.00 88 V 8.71 4.52 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 0.74 0.00 0.00 0.90 0.00 0.00 89 K 8.36 4.95 0.00 1.98 1.71 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.73 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.23 1.40 7.81 90 F 8.87 4.73 0.00 3.30 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 91 E 9.03 4.08 0.00 1.97 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 2.31 2.26 0.00 92 D 7.74 4.70 0.00 2.69 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 93 N 8.72 5.11 0.00 2.63 2.73 0.00 0.00 6.46 7.16 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 94 A 9.02 5.21 1.12 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 0.00 0.00 95 A 9.32 5.10 1.14 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 96 V 8.34 4.56 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 0.93 0.00 0.00 0.94 0.00 0.00 97 I 8.09 4.16 1.95 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 1.07 0.59 0.87 0.00 0.00 98 V 8.88 4.83 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 0.58 0.00 0.00 0.84 0.00 0.00 99 D 8.12 4.96 0.00 2.95 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 0.00 100 E 8.75 3.97 0.00 1.97 2.05 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 2.30 2.32 0.00 101 N 9.82 4.69 0.00 2.90 2.82 0.00 0.00 6.90 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 7.86 3.86 0.00 2.20 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 2.20 2.29 0.00 103 D 7.77 5.15 0.00 2.99 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.64 0.00 2.15 2.05 0.00 3.77 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 1.98 2.09 0.00 105 R 8.54 3.88 0.00 1.79 1.97 0.00 3.23 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 106 G 7.70 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 0.00 0.00 0.00 107 T 8.38 4.32 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 0.00 108 E 9.37 4.70 0.00 1.81 1.77 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 2.21 2.26 0.00 109 L 8.40 4.71 0.00 1.52 1.63 0.99 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 110 K 8.72 4.11 0.00 1.64 1.77 0.00 1.89 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.44 1.45 7.81 111 G 8.71 3.65 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 P 0.00 4.88 0.00 2.27 2.17 0.00 3.80 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.12 0.00 113 I 8.20 4.75 1.90 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 0.69 0.92 0.00 0.00 114 A 8.21 4.84 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 0.00 115 R 8.96 3.91 0.00 2.09 2.37 0.00 2.81 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 116 E 8.38 4.02 0.00 2.09 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 2.42 2.56 0.00 117 V 7.66 3.72 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 1.28 0.00 0.00 0.99 0.00 0.00 118 A 8.49 3.97 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 0.00 119 Q 7.22 3.95 0.00 2.32 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.69 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 120 R 7.32 4.25 0.00 1.27 0.66 0.00 2.82 0.00 0.00 2.79 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.36 0.00 121 F 7.72 4.92 0.00 3.13 2.88 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 0.00 0.00 0.00 122 G 8.57 3.75 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 0.00 0.00 0.00 123 S 8.10 3.83 0.00 4.07 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 0.00 124 V 7.66 3.65 2.41 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 1.07 0.00 0.00 0.94 0.00 0.00 125 A 8.51 4.12 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 0.00 126 S 9.02 4.64 0.00 3.97 4.11 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 0.00 0.00 0.00 127 A 7.61 4.66 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 0.00 128 A 8.19 4.29 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 0.00 129 T 8.67 4.07 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 0.00 130 M 7.83 4.90 0.00 1.96 1.95 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 131 I 8.28 4.74 1.90 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 1.26 0.63 0.95 0.00 0.00 132 V 8.86 4.02 2.17 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 0.85 0.00 0.00 0.97 0.00 0.00