NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3016 8.3044 118.1841 54.3693 31.4679 172.1590 2 N 4.1192 8.2254 123.6955 53.6417 38.1914 173.0584 3 K 3.8351 8.5847 123.9162 56.8888 33.4545 176.8324 4 G 4.0848 8.3307 111.3282 47.0129 0.0000 175.6310 5 Q 4.1188 7.6975 115.9756 56.6513 28.5085 177.7780 6 R 3.9243 8.1336 122.2301 60.1845 29.8948 177.7886 7 H 4.2794 8.1237 115.4664 58.9385 28.7586 177.4890 8 I 3.7342 8.4575 122.2673 63.9866 36.8167 178.3090 9 K 3.8532 7.8574 120.0711 59.4506 32.0252 178.6431 10 I 3.5623 7.6542 119.9041 64.5359 36.6154 178.2641 11 R 3.8766 7.9619 118.8550 59.7327 29.8595 178.6470 12 E 3.8120 8.0692 118.0342 58.8836 29.6028 178.9010 13 I 3.6814 7.8381 120.5068 64.2330 37.0997 177.9942 14 I 4.0302 7.9655 111.1119 62.7190 37.6600 176.9343 15 T 4.3737 7.2048 116.2032 64.3850 69.3600 175.8059 16 S 4.6200 7.7676 115.4446 57.9653 64.1820 173.5159 17 N 4.9897 7.6235 116.7458 51.2687 41.6692 173.8722 18 E 4.3960 8.5554 119.1454 55.1482 29.6842 175.8317 19 I 4.3766 8.1724 125.7810 59.6891 38.3766 176.1868 20 E 4.3959 9.0638 125.5200 55.3226 30.8512 175.5409 21 T 4.6865 7.0898 108.4525 59.5154 71.0596 174.7504 22 Q 4.3962 8.7556 122.9835 57.7430 29.7193 176.7084 23 D 4.6108 7.9150 115.3196 57.4075 41.7116 177.8050 24 E 3.9933 8.3698 119.1489 59.2750 29.2913 179.2908 25 L 3.9241 7.8805 119.9809 57.9821 42.2075 178.8773 26 V 3.5300 7.7155 117.6843 66.2429 31.6897 177.3820 27 D 4.3178 8.2519 117.4703 57.1732 40.6790 178.0076 28 M 3.9696 7.5008 117.9445 58.5183 32.5709 177.6630 29 L 3.9638 7.9933 119.1871 57.9114 41.9117 179.6841 30 K 4.9491 8.4012 122.2816 59.8768 31.8398 179.7907 31 Q 4.2896 7.9044 118.3130 58.9321 28.0393 178.8707 32 D 5.1269 8.1003 117.5168 54.4679 41.2048 176.5640 33 G 3.9553 8.3241 107.0172 46.3632 0.0000 173.2368 34 Y 4.4995 8.1035 115.9375 55.6210 40.6787 175.2935 35 K 4.6421 8.5580 123.7811 55.0001 32.0269 175.4323 36 V 4.6352 7.9889 116.4117 59.2564 35.5276 175.5700 37 T 4.7824 7.9139 115.3295 61.0957 73.3932 175.0718 38 Q 3.9512 8.7290 121.1035 59.4756 28.1779 178.9340 39 A 4.0628 7.9065 122.3341 55.0388 18.6346 179.6010 40 T 3.8505 7.6618 113.8722 66.7169 68.6041 177.0134 41 V 3.6964 8.0418 120.6941 66.0750 31.6715 178.1187 42 S 4.1180 8.0091 116.2375 62.0679 62.6083 177.5106 43 R 3.8958 7.6271 124.0989 61.3482 29.1492 181.1577 44 D 4.6679 8.1253 120.1602 57.3413 40.9180 178.9960 45 I 3.4771 7.8524 120.3749 64.4245 37.2297 178.4077 46 K 3.9946 7.8939 119.5724 59.1274 31.7697 178.6389 47 E 3.9980 7.9332 118.2317 58.3257 29.5638 178.0437 48 L 4.1725 7.8458 116.8916 53.9352 42.5125 175.9523 49 H 4.0613 7.3921 114.2116 56.5569 26.6770 175.0483 50 L 4.3650 7.5387 117.3624 55.2630 42.6017 177.5988 51 V 4.4487 8.9134 113.7032 59.6972 36.4063 174.3605 52 K 5.1608 8.4376 120.6612 55.0511 34.0077 176.5782 53 V 4.7555 8.8649 117.0521 58.6732 35.8735 173.4503 54 P 3.8032 0.0000 0.0000 63.4092 32.2594 175.6602 55 T 4.6427 7.8377 119.1714 61.4427 71.9485 174.7050 56 N 4.4148 8.8779 118.3701 55.2749 38.4431 173.8692 57 N 5.0656 7.6316 115.5149 51.1974 42.4553 174.5881 58 G 3.9880 8.4262 108.6424 45.5120 0.0000 173.6473 59 S 4.9410 7.7120 112.8596 56.4171 66.4575 172.6383 60 Y 5.1275 8.9128 119.5257 56.2691 40.6052 174.7956 61 K 4.6274 8.7833 121.9049 55.0331 36.1374 174.9642 62 Y 4.8864 8.9514 118.7694 58.5004 38.8390 174.9694 63 S 4.5942 8.6734 114.6640 57.7684 66.9144 175.0795 64 L 4.4518 8.1575 122.7643 53.6295 42.1966 176.6888 65 P 4.1045 0.0000 0.0000 65.7826 31.3316 177.6772 66 A 4.2614 7.9070 117.4959 52.7801 18.3406 176.8797 67 D 4.5300 7.7771 116.7774 54.3501 41.8594 176.5659 68 Q 4.1623 8.7385 124.5409 59.1906 28.9624 178.2453 69 R 4.1351 9.0942 114.6409 57.1160 30.0710 175.8714 70 F 4.7734 7.8077 121.4328 57.3972 41.3090 175.1338 71 N 3.7831 8.3029 128.0523 53.5758 37.0639 172.6732 72 P 4.1367 0.0000 0.0000 65.6202 31.9585 177.8154 73 L 3.8531 7.8491 118.2846 58.5969 41.7981 179.1192 74 S 4.0507 7.9224 112.0758 61.3966 62.3139 176.0668 75 K 3.9604 7.8773 120.8196 59.2099 31.7327 179.1118 76 L 3.8976 8.0897 120.8589 57.9105 42.0093 178.7695 77 K 3.9284 8.1107 122.0451 60.2975 32.2173 179.6028 78 R 3.9093 7.8034 120.5670 61.2988 29.4014 180.2745 79 A 4.2191 8.2463 122.2848 55.1156 18.4177 179.8204 80 L 4.0822 8.5458 117.7040 58.2785 41.4764 179.6315 81 M 4.1883 7.9130 117.6834 58.3006 31.9436 177.9351 82 D 4.6231 8.0077 116.9601 55.2594 41.5412 177.0584 83 A 4.6081 8.1426 120.4700 51.6720 21.1554 175.8379 84 F 4.0097 8.4663 118.3399 59.3555 39.7840 173.9202 85 V 4.1913 7.4796 126.4515 63.8827 33.2364 175.3717 86 K 4.3469 6.5977 118.3204 55.4894 35.3340 173.5238 87 I 5.1333 8.2217 123.8848 59.7243 41.4228 173.3968 88 D 5.0206 8.8238 125.6180 53.0699 45.1650 173.9221 89 S 5.1738 8.5787 116.1011 57.0002 66.1655 173.2546 90 A 4.9360 8.5713 125.8882 51.0212 21.0357 175.0314 91 S 3.4156 7.5620 102.2806 60.3175 63.9492 174.7288 92 H 5.3401 8.2049 118.0939 54.3657 31.9296 173.9446 93 M 5.1393 8.0007 118.1115 54.0262 34.4450 174.9784 94 I 4.9201 8.7390 122.5748 59.5271 41.1214 174.7110 95 V 4.6871 8.9320 127.3442 61.2769 33.4244 173.7693 96 L 4.9682 8.7715 131.5285 53.3363 44.0770 175.0496 97 K 4.9522 9.0280 126.8312 55.3416 34.0446 175.8999 98 T 4.9415 8.2249 113.8604 59.6393 72.2967 173.3219 99 M 4.2874 8.3060 120.7440 54.4444 33.1595 175.0118 100 P 4.2740 0.0000 0.0000 64.4348 31.9144 176.6856 101 G 3.9276 9.0829 110.4850 46.3743 0.0000 173.7334 102 N 4.9273 7.8251 113.0737 51.6336 40.9958 176.6486 103 A 3.9195 7.9137 120.0689 55.1924 18.4749 178.9851 104 Q 3.8537 8.1769 117.3137 59.6238 29.0256 178.2036 105 A 3.9534 8.0118 120.6770 55.6583 18.4347 179.3051 106 I 3.7469 7.7311 117.4094 64.6126 37.1298 179.0160 107 G 3.5655 8.4283 106.4653 47.6158 0.0000 175.7281 108 A 4.0112 7.8541 122.3107 54.8181 18.6636 179.4057 109 L 4.0223 7.8437 117.4769 58.2827 41.8120 179.6544 110 M 3.7906 7.7672 118.0996 58.2764 31.6598 178.0353 111 D 4.5739 7.6383 116.4732 55.6385 40.9333 177.0429 112 N 4.8721 7.7806 116.3602 52.8288 39.2893 176.1484 113 L 3.6876 7.3636 121.3934 55.1555 42.1547 176.0265 114 D 4.2835 7.2368 113.4054 55.0832 39.6071 174.2662 115 W 4.9221 7.7207 119.1482 54.8853 30.1643 177.0665 116 D 4.4170 8.9802 124.2287 57.1976 41.1037 177.3427 117 E 4.2271 8.3831 118.4002 59.4604 30.6359 177.0724 118 M 4.7869 8.3511 119.3171 55.3638 32.2190 176.7128 119 M 4.3114 9.4316 123.1421 55.3307 33.9693 176.2060 120 G 4.1445 7.3400 104.4595 46.7911 0.0000 171.3396 121 T 5.3591 8.1484 108.5732 60.2334 71.9878 173.4006 122 I 4.4787 8.6871 124.8980 59.9587 39.6382 174.2803 123 C 5.2052 8.8481 124.6629 56.9060 30.5557 174.5379 124 G 4.1172 8.8034 109.9299 46.2162 0.0000 174.7148 125 D 4.7536 8.8218 122.2287 54.7535 42.7710 176.6013 126 D 4.9856 7.8171 115.7698 52.9788 41.6459 174.9064 127 T 5.1870 7.8407 114.3254 62.6978 73.3827 172.6691 128 I 4.8464 8.8676 125.6351 59.4304 41.2796 174.1380 129 L 4.8714 9.0759 129.7683 53.7080 43.5414 174.8620 130 I 4.7926 8.8235 128.9701 60.0839 39.2338 174.9855 131 I 4.6137 8.4853 128.4338 60.0918 38.6894 174.9915 132 C 5.0827 8.5759 125.0225 58.1327 29.9820 174.4282 133 R 4.2202 8.7485 122.0103 59.3466 30.0941 176.7033 134 T 4.9395 7.7220 106.6397 58.2474 72.4655 172.5706 135 P 4.9641 0.0000 0.0000 65.3024 31.1653 178.9217 136 E 4.0008 8.0617 116.9459 59.4810 29.5129 178.8624 137 D 4.4201 8.1698 118.8778 57.4079 40.7989 179.1234 138 T 3.9004 8.0934 116.6420 66.8122 68.4198 176.6559 139 E 4.1342 8.1664 120.1590 59.1120 29.3018 179.9082 140 G 3.4675 8.0114 105.9822 47.8895 0.0000 176.1194 141 V 3.6483 7.9670 121.4745 65.2025 31.5387 178.0454 142 K 4.0104 8.1845 119.5282 59.7306 32.1305 178.6817 143 N 4.3886 7.9882 116.6271 56.2174 38.2076 177.4769 144 R 3.9051 8.0303 119.5342 59.2359 30.2351 178.2864 145 L 4.2857 7.9757 118.6747 57.6286 41.6614 179.3074 146 L 3.8318 7.7651 118.4918 57.5088 41.3061 179.2285 147 E 4.0528 8.0160 117.6912 58.8567 29.3926 178.8569 148 L 4.1718 7.3839 118.5819 57.0462 41.7543 176.9174 149 L 4.0808 7.3129 122.5413 54.9383 41.4850 176.6995 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 4.30 0.00 2.09 2.12 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.42 0.00 2 N 8.23 4.12 0.00 2.77 2.83 0.00 0.00 7.31 5.80 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 3 K 8.58 3.84 0.00 1.81 1.88 0.00 1.90 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.36 1.18 7.81 4 G 8.33 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 7.70 4.12 0.00 2.35 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.75 0.00 0.00 0.00 0.00 0.00 2.43 2.72 0.00 6 R 8.13 3.92 0.00 2.14 2.04 0.00 3.12 0.00 0.00 3.41 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 7 H 8.12 4.28 0.00 3.20 3.28 0.00 5.69 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.46 3.73 2.00 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 0.94 0.91 0.00 0.00 9 K 7.86 3.85 0.00 1.69 1.57 0.00 1.53 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 0.84 7.81 10 I 7.65 3.56 1.96 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.57 0.80 0.00 0.00 11 R 7.96 3.88 0.00 2.03 2.00 0.00 3.12 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 12 E 8.07 3.81 0.00 2.04 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 2.28 2.33 0.00 13 I 7.84 3.68 1.95 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 1.52 0.77 0.88 0.00 0.00 14 I 7.97 4.03 1.92 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 1.82 0.52 0.94 0.00 0.00 15 T 7.20 4.37 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 1.21 0.00 0.00 16 S 7.77 4.62 0.00 3.78 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 17 N 7.62 4.99 0.00 2.78 2.70 0.00 0.00 6.93 7.24 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 18 E 8.56 4.40 0.00 1.94 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 2.30 0.00 19 I 8.17 4.38 2.04 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 1.35 0.80 1.19 0.00 0.00 20 E 9.06 4.40 0.00 1.87 1.92 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 2.16 2.37 0.00 21 T 7.09 4.69 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 22 Q 8.76 4.40 0.00 2.20 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 23 D 7.92 4.61 0.00 2.82 2.65 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 24 E 8.37 3.99 0.00 2.25 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 2.35 2.35 0.00 25 L 7.88 3.92 0.00 1.76 1.62 0.85 0.65 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 26 V 7.72 3.53 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 1.00 0.00 0.00 27 D 8.25 4.32 0.00 2.76 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 28 M 7.50 3.97 0.00 2.11 2.22 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.59 0.00 29 L 7.99 3.96 0.00 1.83 1.63 0.84 0.81 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 30 K 8.40 4.95 0.00 1.80 1.90 0.00 1.69 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.64 1.51 7.81 31 Q 7.90 4.29 0.00 2.18 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 7.13 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 32 D 8.10 5.13 0.00 2.74 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 33 G 8.32 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 34 Y 8.10 4.50 0.00 3.07 2.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 K 8.56 4.64 0.00 1.71 1.78 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.36 1.42 7.81 36 V 7.99 4.64 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 0.96 0.00 0.00 37 T 7.91 4.78 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 1.25 0.00 0.00 38 Q 8.73 3.95 0.00 2.24 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 39 A 7.91 4.06 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 40 T 7.66 3.85 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 1.28 0.00 0.00 41 V 8.04 3.70 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 1.06 0.00 0.00 0.96 0.00 0.00 42 S 8.01 4.12 0.00 4.04 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 0.00 43 R 7.63 3.90 0.00 1.81 1.97 0.00 3.28 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 44 D 8.13 4.67 0.00 2.78 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 45 I 7.85 3.48 1.92 0.00 0.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 1.08 0.73 0.00 0.00 46 K 7.89 3.99 0.00 1.82 1.89 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.41 1.47 7.81 47 E 7.93 4.00 0.00 1.96 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 0.00 2.30 2.55 0.00 48 L 7.85 4.17 0.00 1.45 1.60 0.79 1.22 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 49 H 7.39 4.06 0.00 3.40 3.33 0.00 5.66 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 50 L 7.54 4.36 0.00 1.48 1.60 0.58 0.66 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 51 V 8.91 4.45 1.09 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 -0.14 0.00 0.00 0.62 0.00 0.00 52 K 8.44 5.16 0.00 1.60 1.74 0.00 1.32 0.00 0.00 1.36 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.29 1.24 7.81 53 V 8.86 4.76 2.12 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 0.91 0.00 0.00 0.99 0.00 0.00 54 P 0.00 3.80 0.00 1.75 1.59 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 1.95 1.59 0.00 55 T 7.84 4.64 4.21 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 1.21 0.00 0.00 56 N 8.88 4.41 0.00 2.68 2.85 0.00 0.00 6.51 8.00 0.00 0.00 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 N 7.63 5.07 0.00 2.63 2.63 0.00 0.00 7.10 7.32 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 58 G 8.43 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 59 S 7.71 4.94 0.00 4.43 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 60 Y 8.91 5.13 0.00 2.83 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 K 8.78 4.63 0.00 1.88 1.88 0.00 1.31 0.00 0.00 1.64 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.39 7.81 62 Y 8.95 4.89 0.00 2.87 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 63 S 8.67 4.59 0.00 3.87 3.64 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 64 L 8.16 4.45 0.00 1.75 1.56 0.91 0.96 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 65 P 0.00 4.10 0.00 2.06 2.15 0.00 3.67 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 2.04 2.31 0.00 66 A 7.91 4.26 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 67 D 7.78 4.53 0.00 2.86 2.68 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 0.00 0.00 0.00 0.00 68 Q 8.74 4.16 0.00 2.13 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.32 0.00 69 R 9.09 4.14 0.00 1.90 2.02 0.00 3.15 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 70 F 7.81 4.77 0.00 2.92 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 71 N 8.30 3.78 0.00 1.75 1.96 0.00 0.00 7.18 7.71 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 72 P 0.00 4.14 0.00 2.10 1.98 0.00 3.60 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.39 0.00 73 L 7.85 3.85 0.00 1.68 1.68 0.96 0.93 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 74 S 7.92 4.05 0.00 3.89 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 K 7.88 3.96 0.00 2.00 1.83 0.00 1.78 0.00 0.00 1.59 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.55 7.81 76 L 8.09 3.90 0.00 1.67 1.82 0.90 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.11 3.93 0.00 1.89 1.97 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.67 7.81 78 R 7.80 3.91 0.00 1.81 1.92 0.00 3.33 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.52 0.00 79 A 8.25 4.22 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 80 L 8.55 4.08 0.00 1.68 1.80 0.97 1.05 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 81 M 7.91 4.19 0.00 2.01 2.27 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.96 2.57 0.00 82 D 8.01 4.62 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 83 A 8.14 4.61 1.29 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 0.00 0.00 0.00 84 F 8.47 4.01 0.00 3.08 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 85 V 7.48 4.19 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.91 0.00 0.00 86 K 6.60 4.35 0.00 1.72 1.41 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.34 1.39 7.81 87 I 8.22 5.13 2.22 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.14 1.18 0.00 0.00 88 D 8.82 5.02 0.00 2.76 2.43 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 89 S 8.58 5.17 0.00 3.86 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 90 A 8.57 4.94 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 91 S 7.56 3.42 0.00 3.92 3.94 0.00 0.00 0.00 0.00 0.00 0.00 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 H 8.20 5.34 0.00 3.08 3.55 0.00 5.88 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 M 8.00 5.14 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.63 0.00 94 I 8.74 4.92 1.92 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.79 0.97 0.00 0.00 95 V 8.93 4.69 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 0.92 0.00 0.00 0.93 0.00 0.00 96 L 8.77 4.97 0.00 1.82 1.51 0.87 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 97 K 9.03 4.95 0.00 1.58 1.58 0.00 1.62 0.00 0.00 1.72 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.31 1.44 7.81 98 T 8.22 4.94 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 1.17 0.00 0.00 99 M 8.31 4.29 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.84 0.00 100 P 0.00 4.27 0.00 2.03 1.99 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 101 G 9.08 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 0.00 102 N 7.83 4.93 0.00 2.92 2.78 0.00 0.00 6.92 7.44 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 0.00 103 A 7.91 3.92 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 0.00 104 Q 8.18 3.85 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.43 2.44 0.00 105 A 8.01 3.95 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 0.00 106 I 7.73 3.75 1.94 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 1.17 0.92 0.00 0.00 107 G 8.43 3.57 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 0.00 0.00 0.00 108 A 7.85 4.01 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 0.00 109 L 7.84 4.02 0.00 1.82 1.64 0.91 0.91 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 0.00 110 M 7.77 3.79 0.00 1.90 2.16 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.44 0.00 111 D 7.64 4.57 0.00 2.75 2.68 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 0.00 0.00 0.00 0.00 112 N 7.78 4.87 0.00 2.77 2.73 0.00 0.00 6.90 6.35 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 0.00 113 L 7.36 3.69 0.00 0.80 0.21 -0.58 0.55 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 0.00 114 D 7.24 4.28 0.00 2.89 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 0.00 115 W 7.72 4.92 0.00 3.38 3.27 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 0.00 116 D 8.98 4.42 0.00 2.68 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 0.00 117 E 8.38 4.23 0.00 2.14 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 2.36 2.41 0.00 118 M 8.35 4.79 0.00 1.93 2.16 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 2.65 0.00 119 M 9.43 4.31 0.00 1.85 2.24 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.50 0.00 120 G 7.34 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 0.00 121 T 8.15 5.36 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 0.00 122 I 8.69 4.48 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 0.99 0.91 0.00 0.00 123 C 8.85 5.21 0.00 2.82 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 0.00 124 G 8.80 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 0.00 0.00 0.00 125 D 8.82 4.75 0.00 2.65 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.82 4.99 0.00 2.88 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 0.00 127 T 7.84 5.19 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 1.19 0.00 0.00 128 I 8.87 4.85 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 1.10 0.73 0.91 0.00 0.00 129 L 9.08 4.87 0.00 1.67 1.55 0.93 0.89 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 0.00 130 I 8.82 4.79 1.92 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.64 0.96 0.00 0.00 131 I 8.49 4.61 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.66 0.92 0.00 0.00 132 C 8.58 5.08 0.00 3.07 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 0.00 133 R 8.75 4.22 0.00 1.84 2.21 0.00 3.26 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 134 T 7.72 4.94 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 0.00 135 P 0.00 4.96 0.00 2.13 2.06 0.00 3.87 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.67 0.00 136 E 8.06 4.00 0.00 2.05 1.98 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 2.39 2.44 0.00 137 D 8.17 4.42 0.00 2.98 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 0.00 138 T 8.09 3.90 4.44 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 1.28 0.00 0.00 139 E 8.17 4.13 0.00 2.18 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 2.50 2.47 0.00 140 G 8.01 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 V 7.97 3.65 2.18 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 1.26 0.00 0.00 1.10 0.00 0.00 142 K 8.18 4.01 0.00 2.02 1.97 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.49 1.55 7.81 143 N 7.99 4.39 0.00 2.71 2.82 0.00 0.00 6.72 8.88 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 0.00 144 R 8.03 3.91 0.00 1.81 1.93 0.00 2.21 0.00 0.00 2.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.45 0.00 145 L 7.98 4.29 0.00 2.23 1.77 1.14 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 146 L 7.77 3.83 0.00 1.81 1.62 0.92 0.76 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 0.00 147 E 8.02 4.05 0.00 2.09 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 2.31 2.63 0.00 148 L 7.38 4.17 0.00 1.81 1.72 1.06 1.11 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 0.00 149 L 7.31 4.08 0.00 1.59 1.45 0.20 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00