NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4209 8.1844 120.6405 54.8506 43.3428 175.5086 8 H 4.8349 8.6047 121.2820 53.7320 32.3884 170.7710 9 K 4.6293 9.2951 127.2498 55.6586 34.1755 175.4512 10 E 4.9081 9.0989 123.9263 53.6646 33.2883 173.7779 11 P 5.0038 0.0000 0.0000 63.0478 32.5233 174.9079 12 A 5.0024 8.6342 122.2542 51.1726 23.1509 175.3075 13 T 4.6474 8.5394 115.0384 61.2896 71.8840 174.0427 14 L 4.2700 8.7089 128.0538 55.9180 42.3624 175.6461 15 I 4.3796 8.1436 125.2557 62.0395 39.4225 175.8424 16 K 4.3615 8.0502 119.1252 55.6579 36.1495 173.8051 17 A 4.6212 8.8007 129.9504 51.7437 19.5237 177.1600 18 I 4.2813 8.1187 122.5318 62.2096 39.6361 174.8357 19 D 4.4934 7.4812 117.5459 53.2100 43.8364 175.9453 20 G 3.7580 8.8487 109.9087 47.8368 0.0000 174.0532 21 D 4.8342 8.0367 116.7656 53.1231 40.5931 175.4153 22 T 5.1966 7.6932 116.2493 62.2194 72.5991 173.3479 23 V 4.7674 8.8758 118.3833 59.4593 36.5700 174.2139 24 K 5.0276 9.2942 125.6587 55.1145 33.8186 175.2191 25 L 5.3236 9.3411 127.0692 53.0901 46.2774 175.2540 26 M 4.8184 9.1123 122.1356 54.9299 33.6257 174.2876 27 Y 5.0667 9.1205 128.1065 56.0782 42.0537 175.6011 28 K 3.7807 9.5316 127.2893 57.4285 29.7691 176.0300 29 G 4.0005 8.3850 105.9108 45.0407 0.0000 173.2106 30 Q 4.8642 7.8257 121.2400 53.3745 31.7127 173.2807 31 P 5.0181 0.0000 0.0000 63.4288 32.7359 175.0723 32 M 4.3983 8.5987 117.3251 55.3766 36.4476 173.4989 33 T 4.9762 8.0853 121.6153 62.5545 70.9252 173.5883 34 F 5.1535 9.3201 124.2198 55.6359 42.7817 173.8475 35 R 4.9785 8.9010 123.9761 54.3719 31.8567 175.2655 36 L 4.3073 8.6612 127.5845 54.7906 41.7547 177.2769 37 L 3.8807 8.7066 125.1261 55.5395 42.7984 177.9400 38 L 4.2607 8.8262 120.7576 55.2768 39.0431 173.8687 39 V 4.9411 7.2479 110.7425 59.6142 34.9987 175.0478 40 D 4.9146 9.2839 124.3321 52.8835 42.9307 175.1513 41 I 4.7445 8.1493 124.1336 58.4272 40.2510 174.2321 42 P 4.3011 0.0000 0.0000 62.7695 31.8672 175.7742 43 E 4.8350 9.7089 123.5469 55.4021 30.9335 177.0078 44 T 4.2564 8.1480 109.3516 62.1988 69.8803 175.3098 45 K 4.3310 8.2777 120.8412 55.1919 33.5321 173.5941 46 H 4.2263 8.7777 114.6686 53.6208 29.7977 173.7161 47 P 4.4114 0.0000 0.0000 64.8618 31.1778 176.7514 48 K 4.5799 7.7307 115.4062 55.8892 35.3881 174.5699 49 K 4.2234 8.8688 119.6353 55.7292 31.8087 180.6266 50 G 3.5548 7.9553 101.5890 46.0577 0.0000 177.3217 51 V 3.8360 8.7066 126.0536 62.8382 29.9445 174.0835 52 E 4.3721 8.4114 126.4926 53.5311 31.1944 175.7489 53 K 3.7490 8.2181 119.0768 59.6284 32.3044 176.7152 54 Y 4.5168 7.9278 120.9415 58.9967 35.7990 171.0609 55 G 4.3408 8.1150 107.6018 47.9355 0.0000 174.1521 56 P 4.3528 0.0000 0.0000 64.5064 31.3664 178.8291 57 E 4.0043 8.0700 117.2520 59.2086 29.4395 178.8857 58 A 3.9685 8.8186 121.0542 55.1058 18.4972 179.3509 59 A 4.0173 8.1773 119.1007 55.4586 18.4195 179.7577 60 A 3.9791 8.2906 119.2185 55.1299 18.4186 179.6219 61 F 3.9968 8.5145 119.2505 61.7879 39.5065 177.4808 62 T 3.9101 8.4088 115.6132 66.4543 68.1854 176.3615 63 K 3.8435 8.0638 121.4946 59.5844 32.2116 178.6858 64 K 3.8603 8.0994 119.7313 59.5615 31.8574 178.3856 65 M 3.8307 7.7181 117.6182 58.6287 32.3230 178.1775 66 V 3.8845 7.8982 111.7333 63.2550 31.7122 178.3296 67 E 4.0981 8.2133 118.1804 58.9138 29.4643 177.5055 68 N 4.5408 7.9978 113.6642 53.6169 39.1078 175.2428 69 A 4.8266 7.5343 120.1149 50.8826 19.3057 177.6364 70 K 4.2887 8.8116 119.0138 57.4311 33.9060 176.8407 71 K 4.5889 8.2882 119.4059 54.6589 35.7774 175.1423 72 I 4.9476 8.4059 125.7400 59.7098 39.6637 174.5928 73 E 5.2240 9.3340 125.5604 54.6303 33.7197 175.0759 74 V 4.6147 8.9468 115.8193 59.4707 34.9906 174.5913 75 E 5.1365 9.1509 124.8667 53.3133 32.0412 175.1302 76 F 4.6506 8.9939 125.7788 57.6561 40.1368 175.7123 77 D 5.0473 8.5732 120.9925 53.4599 43.1447 175.7994 78 K 4.4610 8.9368 116.8680 57.1376 33.7950 177.0844 79 G 4.2509 7.8552 110.4015 44.1086 0.0000 173.3554 80 Q 4.0991 8.5845 119.8791 56.5844 29.3169 176.3182 81 R 4.8386 8.5734 119.2618 56.4348 31.8481 175.6195 82 T 5.2291 7.7402 108.2998 60.1036 72.4720 173.5768 83 D 5.0442 8.5632 123.2384 52.0570 42.1892 176.7653 84 K 4.0571 8.6450 116.2230 59.1450 32.8054 176.9175 85 Y 4.3396 8.0336 116.2142 57.9357 38.0696 176.1561 86 G 3.9544 8.2721 108.5543 45.0708 0.0000 173.7898 87 R 4.3542 8.4660 119.8190 54.9811 31.6436 176.4852 88 G 3.7714 8.5707 111.3132 46.3756 0.0000 172.4796 89 L 5.2867 8.9824 124.0281 53.1653 43.0319 175.5708 90 A 4.4924 8.3363 124.7683 50.7842 23.6787 173.9354 91 Y 4.8261 8.5267 117.0368 57.1673 39.8620 175.1482 92 I 4.7553 8.5222 124.4840 59.6957 40.0686 174.0363 93 Y 5.0265 9.2622 124.5330 56.0914 40.7972 174.5681 94 A 4.8429 9.1587 126.4116 50.0523 21.3286 176.4854 95 D 4.3805 10.0147 125.7124 56.0947 39.0263 176.0918 96 G 4.0287 8.4142 105.9392 44.9788 0.0000 173.0972 97 K 4.5275 7.8370 121.3869 54.5183 34.0870 174.7411 98 M 4.0216 8.4338 125.3593 54.9381 32.9485 176.9396 99 V 3.6048 8.5535 127.6662 66.1238 31.6051 177.5100 100 N 4.3072 8.0481 115.6887 56.4552 38.4695 176.7815 101 E 3.8876 8.0772 119.7093 59.0583 29.8362 178.1131 102 A 4.0653 8.0993 120.9374 55.6280 18.3909 179.6989 103 L 3.4966 8.1199 117.1289 57.7275 41.5664 180.0460 104 V 3.6023 7.5023 118.3797 65.8902 31.2818 178.1240 105 R 4.0384 8.3578 117.9240 59.1958 30.0121 177.4213 106 Q 4.2311 7.8908 116.6258 55.5984 29.4621 175.6298 107 G 3.9611 8.2012 107.1050 47.6767 0.0000 174.7828 108 L 4.5338 7.9997 117.8115 54.1411 42.5194 176.1258 109 A 4.7107 7.6282 119.1337 50.7004 22.6684 175.3354 110 K 4.7141 9.0039 118.6179 54.4006 35.7824 175.8884 111 V 4.3728 8.9772 122.4713 62.8312 31.8803 175.9267 112 A 4.5101 8.6580 130.4596 50.7317 20.2058 176.5124 113 Y 4.0698 8.6047 116.8890 57.8803 38.3824 176.8368 114 V 3.6964 8.4687 123.6546 63.2467 31.7757 174.7344 115 Y 4.3331 8.8135 129.4572 58.4357 39.6099 175.5034 116 K 3.6513 9.3871 126.7692 57.4569 29.8051 176.0776 117 G 3.9418 8.3996 104.4064 45.6259 0.0000 174.2308 118 N 4.8203 8.1906 118.6697 51.9669 37.4999 174.5271 119 N 5.1491 8.3119 116.9801 53.1701 39.0256 176.8984 120 T 3.8434 8.4649 118.1808 67.2975 68.7427 174.7829 121 H 4.8827 8.0619 116.1026 55.6940 29.1631 176.5309 122 E 4.0062 8.3445 123.7254 59.4880 29.3476 178.6993 123 Q 3.9138 8.0103 119.1585 58.9133 29.1807 177.2225 124 L 3.9194 8.0193 120.9914 58.5924 41.9397 179.0064 125 L 4.0800 8.0339 118.4864 57.7137 41.5604 179.6843 126 R 3.9322 8.2525 118.4422 58.8059 29.7654 178.8702 127 K 3.8626 8.5474 119.9039 59.4901 32.1755 178.7403 128 A 3.9681 7.8205 120.7594 55.0237 18.3001 179.2402 129 E 3.8555 8.4208 117.7838 59.3406 29.7494 178.9119 130 A 3.7208 7.9097 120.8603 54.9209 18.4108 179.3361 131 Q 3.7602 7.7060 117.8352 59.4114 29.1718 178.5501 132 A 4.0181 7.8837 121.6281 54.7752 18.2979 179.8464 133 K 3.1188 7.4702 117.1332 59.3610 31.8497 179.4012 134 K 3.8058 8.0651 118.5581 59.0556 32.0865 177.5296 135 E 4.3018 7.8922 115.9460 54.8424 30.5306 175.8487 136 K 4.1595 7.6806 117.2357 56.1571 30.4505 175.3275 137 L 4.5061 8.0495 118.1399 55.0940 44.9417 178.0609 138 N 3.7608 9.1791 119.2592 53.9566 38.1929 177.2778 139 I 3.0820 5.4200 122.7747 63.4737 37.7245 177.0582 140 W 4.7816 8.0663 120.7595 56.3644 29.2368 176.1871 141 S 4.4315 8.1154 119.6809 58.6367 61.7399 173.7204 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 7 L 8.18 4.42 0.00 1.73 1.87 1.18 0.87 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 8 H 8.60 4.83 0.00 3.28 3.21 0.00 5.85 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.30 4.63 0.00 1.55 1.57 0.00 1.44 0.00 0.00 1.08 0.00 0.00 2.26 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.07 1.27 7.81 10 E 9.10 4.91 0.00 2.11 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 2.26 2.24 0.00 11 P 0.00 5.00 0.00 2.10 2.06 0.00 3.79 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 2.02 1.99 0.00 12 A 8.63 5.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 T 8.54 4.65 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 1.23 0.00 0.00 14 L 8.71 4.27 0.00 1.63 1.57 0.92 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.14 4.38 2.06 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 1.27 0.88 0.94 0.00 0.00 16 K 8.05 4.36 0.00 1.79 1.59 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.26 1.30 7.81 17 A 8.80 4.62 1.25 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 0.00 0.00 18 I 8.12 4.28 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 1.19 0.57 0.90 0.00 0.00 19 D 7.48 4.49 0.00 2.61 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 20 G 8.85 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 D 8.04 4.83 0.00 2.84 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 22 T 7.69 5.20 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 1.27 0.00 0.00 23 V 8.88 4.77 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 0.73 0.00 0.00 0.93 0.00 0.00 24 K 9.29 5.03 0.00 1.82 1.80 0.00 1.60 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.61 7.81 25 L 9.34 5.32 0.00 1.78 1.57 0.45 0.62 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 26 M 9.11 4.82 0.00 2.17 2.01 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 2.61 2.56 0.00 27 Y 9.12 5.07 0.00 3.29 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 28 K 9.53 3.78 0.00 1.27 1.61 0.00 1.51 0.00 0.00 0.61 0.00 0.00 2.77 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.16 1.10 7.81 29 G 8.38 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 30 Q 7.83 4.86 0.00 2.21 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 31 P 0.00 5.02 0.00 2.14 2.08 0.00 3.63 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 2.02 2.11 0.00 32 M 8.60 4.40 0.00 2.12 1.98 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.11 0.00 33 T 8.09 4.98 4.20 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 1.21 0.00 0.00 34 F 9.32 5.15 0.00 3.01 2.78 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 35 R 8.90 4.98 0.00 1.89 1.77 0.00 3.28 0.00 0.00 3.13 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.59 0.00 36 L 8.66 4.31 0.00 1.53 1.60 0.89 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.71 3.88 0.00 1.13 1.24 0.31 0.41 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 38 L 8.83 4.26 0.00 2.03 1.90 1.16 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.25 4.94 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 0.75 0.00 0.00 0.93 0.00 0.00 40 D 9.28 4.91 0.00 2.52 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 41 I 8.15 4.74 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 1.33 0.58 0.96 0.00 0.00 42 P 0.00 4.30 0.00 2.23 2.15 0.00 3.58 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 43 E 9.71 4.84 0.00 2.41 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 2.27 2.25 0.00 44 T 8.15 4.26 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 45 K 8.28 4.33 0.00 2.06 1.75 0.00 1.70 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.64 1.50 7.81 46 H 8.78 4.23 0.00 3.25 3.54 0.00 5.72 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 47 P 0.00 4.41 0.00 2.17 2.19 0.00 3.66 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 48 K 7.73 4.58 0.00 1.83 1.77 0.00 1.58 0.00 0.00 1.73 0.00 0.00 3.01 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.30 1.46 7.81 49 K 8.87 4.22 0.00 1.51 2.05 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.23 1.35 7.81 50 G 7.96 3.55 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.71 3.84 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 0.79 0.00 0.00 0.91 0.00 0.00 52 E 8.41 4.37 0.00 2.00 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 2.13 2.36 0.00 53 K 8.22 3.75 0.00 1.78 1.77 0.00 1.60 0.00 0.00 1.78 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.53 7.81 54 Y 7.93 4.52 0.00 3.14 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 55 G 8.12 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 56 P 0.00 4.35 0.00 2.15 2.10 0.00 3.55 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.14 0.00 57 E 8.07 4.00 0.00 2.34 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 0.00 2.47 2.47 0.00 58 A 8.82 3.97 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 59 A 8.18 4.02 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 60 A 8.29 3.98 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 61 F 8.51 4.00 0.00 3.25 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 62 T 8.41 3.91 4.31 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 1.24 0.00 0.00 63 K 8.06 3.84 0.00 1.92 2.02 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.54 7.81 64 K 8.10 3.86 0.00 1.81 1.71 0.00 1.65 0.00 0.00 1.51 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.30 1.37 7.81 65 M 7.72 3.83 0.00 2.00 1.73 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.48 0.00 66 V 7.90 3.88 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 0.88 0.00 0.00 1.00 0.00 0.00 67 E 8.21 4.10 0.00 2.18 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 2.33 2.27 0.00 68 N 8.00 4.54 0.00 2.76 2.82 0.00 0.00 6.99 7.34 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 69 A 7.53 4.83 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 70 K 8.81 4.29 0.00 1.87 1.94 0.00 1.52 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.49 1.44 7.81 71 K 8.29 4.59 0.00 1.86 1.70 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 I 8.41 4.95 2.03 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 1.33 1.09 0.85 0.00 0.00 73 E 9.33 5.22 0.00 1.86 1.79 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 2.18 2.24 0.00 74 V 8.95 4.61 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 0.16 0.00 0.00 0.63 0.00 0.00 75 E 9.15 5.14 0.00 2.21 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 0.00 2.48 2.40 0.00 76 F 8.99 4.65 0.00 3.07 2.97 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 77 D 8.57 5.05 0.00 2.72 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.94 4.46 0.00 1.88 1.96 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.33 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.51 1.40 7.81 79 G 7.86 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 0.00 0.00 0.00 0.00 80 Q 8.58 4.10 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.90 6.77 0.00 0.00 0.00 0.00 0.00 2.31 2.27 0.00 81 R 8.57 4.84 0.00 1.59 1.59 0.00 2.93 0.00 0.00 3.01 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.78 0.00 82 T 7.74 5.23 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 83 D 8.56 5.04 0.00 2.77 2.78 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 84 K 8.65 4.06 0.00 1.62 1.84 0.00 1.37 0.00 0.00 1.60 0.00 0.00 2.71 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.93 0.51 7.81 85 Y 8.03 4.34 0.00 3.10 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 G 8.27 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 87 R 8.47 4.35 0.00 2.03 1.81 0.00 3.11 0.00 0.00 3.13 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.61 0.00 88 G 8.57 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 0.00 0.00 0.00 89 L 8.98 5.29 0.00 1.64 1.66 1.15 0.95 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 90 A 8.34 4.49 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.53 4.83 0.00 2.98 2.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 8.52 4.76 1.76 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.84 0.85 0.00 0.00 93 Y 9.26 5.03 0.00 2.85 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 94 A 9.16 4.84 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 D 10.01 4.38 0.00 2.80 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 G 8.41 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 97 K 7.84 4.53 0.00 1.85 1.81 0.00 1.55 0.00 0.00 1.60 0.00 0.00 3.00 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.39 7.81 98 M 8.43 4.02 0.00 1.92 1.59 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 2.41 0.00 99 V 8.55 3.60 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 1.03 0.00 0.00 0.92 0.00 0.00 100 N 8.05 4.31 0.00 2.89 2.93 0.00 0.00 6.76 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 0.00 101 E 8.08 3.89 0.00 1.96 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 2.37 2.35 0.00 102 A 8.10 4.07 1.65 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 0.00 103 L 8.12 3.50 0.00 1.85 1.63 1.00 0.59 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 0.00 104 V 7.50 3.60 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 1.18 0.00 0.00 0.98 0.00 0.00 105 R 8.36 4.04 0.00 1.82 2.13 0.00 3.35 0.00 0.00 3.14 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 106 Q 7.89 4.23 0.00 2.02 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.36 0.00 0.00 0.00 0.00 0.00 2.13 2.31 0.00 107 G 8.20 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 0.00 108 L 8.00 4.53 0.00 1.29 1.49 0.39 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.63 4.71 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 K 9.00 4.71 0.00 1.70 1.99 0.00 1.67 0.00 0.00 1.49 0.00 0.00 2.79 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.18 1.11 7.81 111 V 8.98 4.37 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 0.74 0.00 0.00 0.99 0.00 0.00 112 A 8.66 4.51 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 0.00 113 Y 8.60 4.07 0.00 2.96 2.96 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 0.00 114 V 8.47 3.70 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 0.88 0.00 0.00 1.05 0.00 0.00 115 Y 8.81 4.33 0.00 3.06 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 0.00 116 K 9.39 3.65 0.00 1.62 1.53 0.00 1.46 0.00 0.00 1.24 0.00 0.00 2.28 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.30 0.41 7.81 117 G 8.40 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 0.00 0.00 0.00 118 N 8.19 4.82 0.00 2.93 2.87 0.00 0.00 6.67 7.96 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 0.00 119 N 8.31 5.15 0.00 2.95 3.01 0.00 0.00 6.13 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 0.00 120 T 8.46 3.84 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 1.05 0.00 0.00 121 H 8.06 4.88 0.00 2.80 3.04 0.00 5.62 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.34 4.01 0.00 2.18 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 2.34 2.37 0.00 123 Q 8.01 3.91 0.00 2.21 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.60 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 124 L 8.02 3.92 0.00 1.79 1.82 0.90 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.03 4.08 0.00 1.92 1.73 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.25 3.93 0.00 1.83 1.96 0.00 3.14 0.00 0.00 3.09 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.75 0.00 127 K 8.55 3.86 0.00 2.11 1.78 0.00 1.70 0.00 0.00 1.64 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.48 7.81 128 A 7.82 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 E 8.42 3.86 0.00 2.19 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 0.00 2.20 2.55 0.00 130 A 7.91 3.72 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 0.00 131 Q 7.71 3.76 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 132 A 7.88 4.02 1.49 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 0.00 0.00 133 K 7.47 3.12 0.00 1.37 1.39 0.00 0.61 0.00 0.00 0.74 0.00 0.00 2.13 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.53 0.21 7.81 134 K 8.07 3.81 0.00 1.74 1.86 0.00 1.74 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.42 7.81 135 E 7.89 4.30 0.00 1.98 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 2.27 2.49 0.00 136 K 7.68 4.16 0.00 1.90 1.89 0.00 1.90 0.00 0.00 1.57 0.00 0.00 3.23 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.51 7.81 137 L 8.05 4.51 0.00 1.80 1.69 0.98 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 138 N 9.18 3.76 0.00 2.66 1.47 0.00 0.00 6.87 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 0.00 139 I 5.42 3.08 1.22 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 -0.36 0.30 0.00 0.00 140 W 8.07 4.78 0.00 3.47 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 0.00 141 S 8.12 4.43 0.00 3.92 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