NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8582 8.2048 120.4307 55.0633 33.3461 175.0571 2 L 3.9687 8.7249 126.7362 54.5510 42.4880 174.9830 3 N 4.9594 8.7859 121.1610 51.2986 42.5543 173.5528 4 V 3.9700 8.3169 120.7416 64.8867 31.7503 175.6458 5 G 4.0302 9.4717 115.0516 45.2333 0.0000 173.8867 6 A 4.3007 7.8360 121.4221 51.8751 19.8248 176.9957 7 T 4.4786 8.2775 116.5349 63.1264 69.5685 174.4294 8 A 4.0141 8.5763 128.6379 50.5208 19.2277 175.8029 9 P 4.0045 0.0000 0.0000 63.0234 31.8894 175.9705 10 D 4.4978 8.4765 122.3754 54.2113 42.2455 174.7560 11 F 5.1124 7.4868 117.0737 56.0807 41.6474 173.1524 12 T 5.2391 8.7535 115.8459 62.1229 71.1439 173.3171 13 L 5.0180 9.2464 126.2177 52.7103 46.5356 176.3639 14 R 4.8072 8.5900 120.6996 56.2544 31.7767 176.7553 15 D 5.6474 9.4881 123.4478 51.4980 41.7028 176.6879 16 Q 4.2365 8.6867 115.8743 58.4694 27.4602 176.2567 17 N 4.8079 9.3834 116.8490 53.0233 38.9284 175.3164 18 Q 3.6552 8.1457 115.1936 56.8438 26.8099 173.2702 19 Q 4.6224 7.5310 114.7401 54.7190 30.9688 174.8800 20 L 4.7800 8.3984 122.1264 54.3115 42.9396 176.3707 21 V 4.5347 9.1745 123.6450 61.3719 34.8135 174.1540 22 T 5.5986 8.2994 123.3352 60.4584 71.3050 174.7863 23 L 3.8931 8.0253 127.4989 58.2500 42.0622 178.9587 24 R 3.9170 8.1424 118.2530 59.4634 29.6506 178.3722 25 G 3.5030 7.6876 104.2166 47.0768 0.0000 174.2444 26 Y 4.3811 8.0612 117.7418 57.2978 38.4503 175.5300 27 R 4.1101 7.3530 120.9695 57.8650 30.4522 177.0112 28 G 3.9800 9.3832 112.5984 45.7655 0.0000 173.4734 29 A 4.6104 8.4106 120.5546 53.0303 20.8433 176.6112 30 K 4.9506 7.6723 111.6055 54.7499 36.5916 176.1485 31 N 4.7687 8.9842 120.2683 53.1450 40.3465 174.2891 32 V 4.6766 9.0046 122.1479 60.9777 34.7450 173.8498 33 L 4.7958 8.9039 130.6608 53.7732 43.7376 174.8360 34 L 4.7683 8.9398 127.4211 53.1759 43.8306 175.8088 35 V 3.9709 8.2977 125.7359 60.9729 32.4214 174.5535 36 F 5.0136 9.1270 127.7099 57.1423 40.2543 174.9821 37 F 5.0033 8.6811 116.8612 54.8355 40.6089 172.6230 38 P 4.4346 0.0000 0.0000 64.4606 31.6607 176.1339 39 L 4.6727 7.5625 118.4421 51.5475 45.6782 176.3798 40 A 2.5955 8.4251 125.5031 52.7938 18.7017 176.6398 41 F 3.7343 5.4600 115.7063 58.4880 36.4839 175.3922 42 T 4.7367 7.2672 109.2584 59.2595 71.6625 174.6553 43 G 3.9635 8.9847 110.3625 48.4681 0.0000 175.8757 44 I 3.7859 7.7831 122.3333 64.0929 37.2920 178.1073 45 C 4.6038 8.1567 113.7859 60.2607 29.7382 175.3903 46 Q 4.4414 8.1996 123.4567 59.4887 28.8283 178.0708 47 G 3.7019 8.0767 106.3041 47.8259 0.0000 175.4448 48 E 4.1269 8.1979 120.8910 59.4121 29.5293 179.5435 49 L 3.8378 8.2424 119.0332 57.3652 41.5019 179.2537 50 D 4.6255 8.3600 119.3769 57.3395 40.8280 178.7318 51 Q 4.0360 8.0807 118.5965 58.8342 28.5238 178.3889 52 L 3.9944 7.4567 119.5448 58.1630 42.3352 178.6124 53 R 4.3131 8.4542 118.8914 59.8904 29.9157 178.2919 54 D 4.5671 8.2785 116.6427 56.4574 40.8915 176.8480 55 H 4.8767 7.9247 115.9431 55.1613 29.8297 175.3917 56 L 4.1085 7.9628 124.8137 58.0466 41.8652 177.7094 57 P 4.5652 0.0000 0.0000 65.0240 31.3379 176.9308 58 E 4.0462 7.9248 116.2310 57.0400 29.7404 177.0068 59 F 4.7977 7.6645 115.7177 57.3079 41.1121 174.7105 60 E 4.7829 8.6423 121.3309 54.0849 29.5920 174.2122 61 N 4.8452 8.7909 124.3425 51.9118 39.5676 175.2650 62 D 4.1295 8.8720 116.0269 57.1871 41.3001 176.5943 63 D 4.9018 8.9191 117.6191 54.2014 42.5474 175.7203 64 S 5.3352 7.9118 114.1533 56.7976 67.8702 172.8680 65 A 5.0661 8.8325 122.4788 50.1182 22.6959 174.8365 66 A 4.9302 8.5214 121.1158 49.9575 21.8459 175.5714 67 L 4.7316 8.9127 122.1772 52.7937 45.3162 175.5720 68 A 4.9635 8.9493 126.1999 50.8285 21.1257 175.9470 69 I 5.0002 8.7692 121.9011 59.7040 41.6484 174.7224 70 S 4.5915 8.2390 119.0307 57.1920 66.2768 175.1135 71 V 4.1207 8.4285 111.1533 62.0436 31.2458 176.8552 72 G 3.7585 7.8121 110.5984 44.2716 0.0000 172.1148 73 P 4.0828 0.0000 0.0000 61.0388 33.5781 175.6073 74 P 4.2507 0.0000 0.0000 65.5603 31.1542 177.0343 75 P 4.2993 0.0000 0.0000 65.8178 31.2275 178.7269 76 T 4.0292 7.7750 113.8947 67.2403 68.4366 176.3118 77 H 4.5444 8.0680 117.5591 58.6135 28.5860 177.9340 78 K 3.9741 8.6986 121.9838 59.5304 32.0245 178.8780 79 I 3.7720 8.0096 120.0856 64.2656 37.0391 178.1999 80 W 4.4279 8.4338 128.8610 60.4921 30.4098 177.7326 81 A 3.5670 8.4039 120.9865 55.3777 17.4499 179.7824 82 T 3.6976 8.1580 114.4921 66.9903 68.3475 177.1193 83 Q 3.8516 8.1672 118.7612 58.3028 28.8068 177.9890 84 S 4.0915 7.5841 114.3650 57.4872 63.1686 174.6557 85 G 3.5823 6.9797 109.2488 46.2114 0.0000 174.3862 86 F 4.3136 7.4333 120.5944 56.3307 37.4254 175.8797 87 T 4.1689 8.0812 114.3692 61.4231 69.3258 175.0502 88 F 4.8326 6.5991 117.1878 54.6008 40.1364 173.4076 89 P 4.6803 0.0000 0.0000 62.6731 32.4753 175.4520 90 L 5.1230 9.6623 124.8713 53.1266 44.1925 175.4330 91 L 5.0241 9.1504 124.6627 53.2778 44.3759 176.2489 92 S 4.9947 8.7112 119.3326 56.2438 63.4187 174.9609 93 D 4.6610 8.5178 131.3682 53.5013 38.8385 177.3248 94 F 4.2595 8.0922 124.2386 59.4927 40.5081 174.9257 95 W 4.8208 7.9242 130.9250 55.4154 31.8674 171.8285 96 P 3.2687 0.0000 0.0000 62.7425 30.8640 174.9993 97 H 4.2531 7.8574 120.5749 56.7276 29.6663 174.5200 98 G 3.5183 9.0626 115.3643 46.5547 0.0000 174.6845 99 A 3.7544 7.5590 123.0423 54.9251 18.2719 180.8312 100 V 3.6450 8.0054 115.9363 66.3867 31.7672 177.9874 101 S 4.0163 9.2456 115.4035 61.9374 62.5954 176.9353 102 Q 4.0211 8.2950 120.6072 58.9092 28.2380 178.6456 103 A 3.9389 7.7467 120.3464 54.6281 18.6995 178.2424 104 Y 4.0615 8.0408 113.8661 57.1707 37.6675 176.4241 105 G 3.9069 8.3360 108.9531 46.8016 0.0000 174.6798 106 V 4.2908 7.8610 111.3733 60.6319 33.1270 174.6756 107 F 5.0092 8.4188 122.4423 56.6636 41.2676 174.6920 108 N 4.4191 8.4176 125.8478 51.9364 38.4322 174.9931 109 E 4.1648 8.6083 128.0140 58.8513 30.2426 178.0487 110 Q 4.0121 7.9980 118.7399 58.3947 29.3306 176.2997 111 A 4.2394 7.7785 118.2347 52.0019 19.6177 177.2545 112 G 3.8450 8.5042 104.1621 46.1274 0.0000 173.1305 113 I 4.9056 6.7474 110.4908 58.4678 41.3364 173.9409 114 A 4.7387 8.5111 124.2773 51.9480 19.7775 177.0471 115 N 4.5057 9.2039 119.3150 52.4018 40.0109 176.8846 116 R 4.6430 7.8636 120.0139 55.3207 27.6312 176.2291 117 G 4.1386 8.0733 109.1406 44.8747 0.0000 170.4451 118 T 5.3222 8.4393 117.5679 61.7243 73.0823 173.1613 119 F 6.1264 9.0047 122.1283 55.4366 44.3152 173.4997 120 V 4.8832 8.8530 120.4189 61.1899 34.4986 174.0857 121 V 4.9677 8.8523 128.2438 61.1465 33.9432 175.5241 122 D 5.6140 8.8465 127.4510 51.8557 40.9456 177.0581 123 R 4.0663 8.6005 116.6112 58.3653 29.9481 178.2406 124 S 4.5234 8.3161 112.6084 58.0403 63.7713 174.7417 125 G 3.8952 8.6846 109.7878 45.7261 0.0000 172.7536 126 I 4.6707 8.3334 120.6388 59.1343 38.9626 175.0885 127 I 4.4629 9.0138 126.3101 61.7461 37.3447 176.6460 128 R 4.6463 9.3292 125.9471 56.2303 32.2653 176.2088 129 F 5.0595 8.1879 120.8338 56.6394 43.1121 172.7906 130 A 4.7992 7.7629 126.2843 50.1614 22.0047 174.7540 131 E 4.3681 8.6456 122.5078 54.9116 33.8075 174.8105 132 M 4.9425 8.2954 125.2799 54.5811 34.3581 174.7736 133 K 4.3139 8.5001 123.3234 55.0314 33.6632 177.3904 134 Q 4.1855 8.3095 118.3370 55.3389 29.1574 174.2375 135 P 4.4603 0.0000 0.0000 64.1912 31.7522 177.4389 136 G 3.9069 8.8383 109.3195 45.5142 0.0000 172.6762 137 E 4.5090 7.8306 121.0459 54.1447 30.6255 176.0583 138 V 4.0220 8.1618 119.7583 61.1216 32.4204 176.3665 139 R 4.0650 8.7722 122.5717 56.0631 30.7115 177.5128 140 D 4.3571 8.3109 120.6615 53.3502 41.0704 176.9397 141 Q 2.5200 7.6842 126.4646 58.2265 28.8723 178.2383 142 R 3.9216 7.5643 120.2042 58.5475 29.8803 178.6239 143 L 3.9857 7.7271 120.8127 57.7549 42.0194 178.9006 144 W 4.0066 7.7251 118.7537 60.0043 29.0276 178.4938 145 T 3.9541 8.1828 109.6948 64.6864 68.1065 176.1921 146 D 4.2454 7.9939 120.4895 56.9217 41.0354 177.9752 147 A 3.9152 7.8252 120.3944 55.2469 18.6614 179.2533 148 L 4.0535 8.2194 117.6022 57.9787 41.4840 179.7271 149 A 4.0251 8.2149 119.7021 54.8650 18.3254 179.1616 150 A 4.1758 7.8000 118.4609 54.1327 18.4909 177.8219 151 L 4.6187 7.4344 116.6243 54.7420 42.4609 177.2248 152 T 4.5138 7.5720 110.7554 61.1072 70.2849 173.2831 153 A 4.1032 6.0812 126.5155 53.1818 20.3961 177.0067 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 8.20 4.86 0.00 2.07 2.07 0.00 0.00 0.00 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.59 0.00 2 L 8.72 3.97 0.00 1.54 1.55 0.43 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 3 N 8.79 4.96 0.00 2.78 2.69 0.00 0.00 6.78 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 4 V 8.32 3.97 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 0.94 0.00 0.00 1.02 0.00 0.00 5 G 9.47 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 6 A 7.84 4.30 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 7 T 8.28 4.48 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 8 A 8.58 4.01 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 9 P 0.00 4.00 0.00 1.88 1.90 0.00 2.20 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.70 0.00 10 D 8.48 4.50 0.00 2.59 2.53 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 11 F 7.49 5.11 0.00 3.17 3.23 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 12 T 8.75 5.24 4.32 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 1.28 0.00 0.00 13 L 9.25 5.02 0.00 1.58 1.52 0.45 1.12 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 14 R 8.59 4.81 0.00 1.80 1.89 0.00 3.38 0.00 0.00 3.44 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.63 0.00 15 D 9.49 5.65 0.00 2.92 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 Q 8.69 4.24 0.00 2.32 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 7.31 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 17 N 9.38 4.81 0.00 2.88 2.84 0.00 0.00 6.92 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 Q 8.15 3.66 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.35 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.33 0.00 19 Q 7.53 4.62 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.12 6.97 0.00 0.00 0.00 0.00 0.00 2.48 2.50 0.00 20 L 8.40 4.78 0.00 1.56 1.65 0.95 0.87 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 21 V 9.17 4.53 2.34 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 1.32 0.00 0.00 1.03 0.00 0.00 22 T 8.30 5.60 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 1.26 0.00 0.00 23 L 8.03 3.89 0.00 0.39 1.19 0.86 0.81 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 24 R 8.14 3.92 0.00 2.28 1.86 0.00 3.21 0.00 0.00 3.52 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 25 G 7.69 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.06 4.38 0.00 3.15 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 27 R 7.35 4.11 0.00 1.85 1.89 0.00 3.33 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 28 G 9.38 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.41 4.61 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 30 K 7.67 4.95 0.00 1.77 1.71 0.00 1.96 0.00 0.00 1.96 0.00 0.00 3.19 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.58 7.81 31 N 8.98 4.77 0.00 2.66 2.73 0.00 0.00 6.56 7.27 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 32 V 9.00 4.68 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 0.59 0.00 0.00 0.59 0.00 0.00 33 L 8.90 4.80 0.00 1.61 1.31 0.30 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.94 4.77 0.00 1.72 1.32 0.86 0.54 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 35 V 8.30 3.97 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 0.90 0.00 0.00 0.03 0.00 0.00 36 F 9.13 5.01 0.00 3.21 2.93 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 37 F 8.68 5.00 0.00 3.08 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 38 P 0.00 4.43 0.00 2.24 2.32 0.00 3.57 0.00 0.00 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 39 L 7.56 4.67 0.00 1.61 1.54 0.95 0.80 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 40 A 8.43 2.60 0.45 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 41 F 5.46 3.73 0.00 3.05 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 42 T 7.27 4.74 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 1.32 0.00 0.00 43 G 8.98 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 44 I 7.78 3.79 1.95 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.44 0.98 0.00 0.00 45 C 8.16 4.60 0.00 3.25 3.39 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 46 Q 8.20 4.44 0.00 2.73 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.56 2.76 0.00 47 G 8.08 3.70 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 0.00 0.00 0.00 48 E 8.20 4.13 0.00 2.26 2.13 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 2.37 2.52 0.00 49 L 8.24 3.84 0.00 1.18 0.33 0.03 0.76 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 50 D 8.36 4.63 0.00 2.98 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 51 Q 8.08 4.04 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.78 0.00 0.00 0.00 0.00 0.00 2.36 2.65 0.00 52 L 7.46 3.99 0.00 1.50 1.68 0.50 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.45 4.31 0.00 2.27 2.31 0.00 3.19 0.00 0.00 3.45 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.01 0.00 54 D 8.28 4.57 0.00 2.86 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 55 H 7.92 4.88 0.00 3.54 3.25 0.00 5.65 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 7.96 4.11 0.00 2.05 1.79 1.04 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.57 0.00 2.03 2.08 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 58 E 7.92 4.05 0.00 1.16 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 2.13 2.08 0.00 59 F 7.66 4.80 0.00 3.00 2.94 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 60 E 8.64 4.78 0.00 1.90 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 2.27 2.27 0.00 61 N 8.79 4.85 0.00 2.93 3.00 0.00 0.00 6.87 7.65 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 62 D 8.87 4.13 0.00 2.70 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 63 D 8.92 4.90 0.00 2.64 2.67 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 64 S 7.91 5.34 0.00 3.76 3.70 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 65 A 8.83 5.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.52 4.93 0.95 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 67 L 8.91 4.73 0.00 1.40 1.50 1.03 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 68 A 8.95 4.96 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 69 I 8.77 5.00 0.86 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.33 0.60 0.00 0.00 70 S 8.24 4.59 0.00 3.11 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 71 V 8.43 4.12 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 1.09 0.00 0.00 1.05 0.00 0.00 72 G 7.81 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 73 P 0.00 4.08 0.00 1.72 0.49 0.00 3.61 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.59 0.00 74 P 0.00 4.25 0.00 2.14 2.32 0.00 3.43 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00 75 P 0.00 4.30 0.00 2.12 2.09 0.00 3.41 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 2.13 0.00 76 T 7.77 4.03 4.36 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 1.32 0.00 0.00 77 H 8.07 4.54 0.00 3.31 3.48 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 K 8.70 3.97 0.00 2.09 2.02 0.00 1.66 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.50 7.81 79 I 8.01 3.77 2.18 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.90 1.08 0.00 0.00 80 W 8.43 4.43 0.00 2.80 3.11 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 81 A 8.40 3.57 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 82 T 8.16 3.70 4.40 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 1.18 0.00 0.00 83 Q 8.17 3.85 0.00 2.14 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 84 S 7.58 4.09 0.00 2.72 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 85 G 6.98 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.43 4.31 0.00 2.46 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 0.00 0.00 0.00 87 T 8.08 4.17 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 1.19 0.00 0.00 88 F 6.60 4.83 0.00 3.11 3.12 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 89 P 0.00 4.68 0.00 2.20 2.12 0.00 3.93 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.23 0.00 90 L 9.66 5.12 0.00 1.74 1.56 0.81 0.72 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 91 L 9.15 5.02 0.00 1.39 1.51 0.97 0.66 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 92 S 8.71 4.99 0.00 3.83 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 93 D 8.52 4.66 0.00 2.74 2.58 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.09 4.26 0.00 3.08 3.13 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 95 W 7.92 4.82 0.00 2.79 2.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 P 0.00 3.27 0.00 1.94 1.71 0.00 3.61 0.00 0.00 3.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.77 0.00 97 H 7.86 4.25 0.00 3.21 3.21 0.00 5.68 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 98 G 9.06 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 A 7.56 3.75 1.20 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 0.00 0.00 100 V 8.01 3.64 2.27 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 1.11 0.00 0.00 0.96 0.00 0.00 101 S 9.25 4.02 0.00 4.11 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 0.00 102 Q 8.30 4.02 0.00 2.06 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.28 1.73 0.00 103 A 7.75 3.94 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 0.00 104 Y 8.04 4.06 0.00 2.66 2.71 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 0.00 105 G 8.34 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 V 7.86 4.29 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 0.85 0.00 0.00 0.23 0.00 0.00 107 F 8.42 5.01 0.00 2.87 2.94 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 0.00 108 N 8.42 4.42 0.00 2.77 2.52 0.00 0.00 6.52 7.62 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 0.00 109 E 8.61 4.16 0.00 2.02 1.97 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 2.35 2.42 0.00 110 Q 8.00 4.01 0.00 2.01 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 111 A 7.78 4.24 1.20 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 0.00 0.00 112 G 8.50 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 0.00 0.00 0.00 113 I 6.75 4.91 1.86 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 1.15 0.83 0.93 0.00 0.00 114 A 8.51 4.74 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 0.00 115 N 9.20 4.51 0.00 2.55 2.76 0.00 0.00 7.00 5.18 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 0.00 116 R 7.86 4.64 0.00 1.77 2.01 0.00 3.74 0.00 0.00 3.54 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.58 0.00 117 G 8.07 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 0.00 118 T 8.44 5.32 4.40 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 0.59 0.00 0.00 119 F 9.00 6.13 0.00 3.05 3.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.85 4.88 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 1.07 0.00 0.00 0.81 0.00 0.00 121 V 8.85 4.97 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 0.98 0.00 0.00 1.05 0.00 0.00 122 D 8.85 5.61 0.00 2.96 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.60 4.07 0.00 1.92 2.04 0.00 3.12 0.00 0.00 3.36 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.68 0.00 124 S 8.32 4.52 0.00 4.00 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 0.00 125 G 8.68 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 0.00 0.00 0.00 126 I 8.33 4.67 2.18 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 1.31 1.02 1.00 0.00 0.00 127 I 9.01 4.46 2.04 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.84 1.23 0.00 0.00 128 R 9.33 4.65 0.00 1.75 2.05 0.00 3.37 0.00 0.00 3.36 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.74 0.00 129 F 8.19 5.06 0.00 3.16 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 0.00 130 A 7.76 4.80 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 0.00 131 E 8.65 4.37 0.00 1.58 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 132 M 8.30 4.94 0.00 1.84 1.86 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 2.44 2.41 0.00 133 K 8.50 4.31 0.00 1.79 1.76 0.00 1.78 0.00 0.00 1.76 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.40 7.81 134 Q 8.31 4.19 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 7.06 0.00 0.00 0.00 0.00 0.00 2.42 2.39 0.00 135 P 0.00 4.46 0.00 2.07 2.04 0.00 3.75 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 2.03 2.09 0.00 136 G 8.84 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 E 7.83 4.51 0.00 1.93 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 0.00 2.24 2.30 0.00 138 V 8.16 4.02 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 0.78 0.00 0.00 0.90 0.00 0.00 139 R 8.77 4.07 0.00 2.03 2.19 0.00 3.70 0.00 0.00 3.47 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.81 0.00 140 D 8.31 4.36 0.00 2.65 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 0.00 141 Q 7.68 2.52 0.00 1.68 1.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.68 0.00 0.00 0.00 0.00 0.00 2.13 2.22 0.00 142 R 7.56 3.92 0.00 1.90 1.95 0.00 3.07 0.00 0.00 3.02 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.50 0.00 143 L 7.73 3.99 0.00 1.86 1.74 1.12 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 144 W 7.73 4.01 0.00 3.64 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 0.00 145 T 8.18 3.95 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 1.02 0.00 0.00 146 D 7.99 4.25 0.00 2.86 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 0.00 147 A 7.83 3.92 0.95 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 0.00 148 L 8.22 4.05 0.00 1.84 1.74 1.15 0.87 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 0.00 149 A 8.21 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 0.00 150 A 7.80 4.18 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 0.00 151 L 7.43 4.62 0.00 1.77 1.70 1.00 0.85 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 0.00 152 T 7.57 4.51 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 1.32 0.00 0.00 153 A 6.08 4.10 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