NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9262 8.3549 109.7452 44.9905 0.0000 173.4718 2 L 4.2345 7.6588 119.0333 51.2001 43.0070 175.6441 3 S 4.4905 9.3660 118.5718 57.8630 66.1508 175.0619 4 D 4.6522 8.6992 121.8704 57.6223 40.6630 179.2903 5 G 3.6743 8.1042 105.6569 47.8412 0.0000 175.4268 6 E 3.9134 8.2117 120.9358 58.9575 29.4489 179.3773 7 W 4.4087 8.1257 118.9802 60.1333 29.1473 178.6433 8 Q 4.2363 8.3972 117.9116 58.8156 28.1950 178.8436 9 L 4.0651 7.9966 120.0904 57.6062 41.6614 179.5126 10 V 3.7139 8.1021 118.3402 66.3300 31.6922 178.2503 11 L 4.2470 8.6331 118.8287 57.6221 41.1538 179.3981 12 N 4.4341 8.2044 116.2054 56.4565 38.7305 177.5510 13 V 3.8141 7.9434 113.5972 63.9417 31.6601 178.4446 14 W 4.0127 8.6820 128.4349 60.1507 30.0228 177.9998 15 G 3.9136 8.1614 105.6916 47.7620 0.0000 175.7341 16 K 3.8761 7.8038 120.0500 58.9249 32.2588 179.3598 17 V 2.8038 6.8273 117.9899 65.7608 31.4827 177.8036 18 E 3.8789 8.0317 118.1888 59.0996 28.9963 178.9604 19 A 4.2329 7.3498 118.9671 53.7253 20.1664 177.5408 20 D 4.6245 7.9255 115.6355 52.4669 43.2957 175.7844 21 V 3.4829 7.7414 123.8794 65.9777 32.1273 176.8340 22 A 4.0651 7.9728 120.1603 55.0161 18.2941 179.6906 23 G 3.4712 8.2281 104.1845 48.1924 0.0000 175.6556 24 H 4.1071 8.2068 118.5901 58.4615 28.6810 178.0803 25 G 3.5802 8.2483 107.8116 47.7996 0.0000 175.4866 26 Q 3.8607 8.1478 122.1982 59.0020 29.1213 178.2718 27 E 3.8648 8.0923 119.6187 59.1724 29.3490 179.5230 28 V 3.5161 7.8671 118.4444 65.9069 31.5339 178.1660 29 L 3.4620 7.6675 118.6627 57.7550 41.4508 179.6385 30 I 3.6326 7.6862 119.7310 64.1255 36.8856 178.8591 31 R 3.8357 7.9251 119.1247 59.0065 29.8271 178.3907 32 L 3.8823 7.9307 120.4468 58.5240 41.8618 179.1349 33 F 4.5090 7.8509 117.4428 60.6905 38.6371 177.9678 34 K 4.1199 8.1259 117.3121 59.0485 31.9351 179.2147 35 G 3.7832 8.0642 105.1391 46.0256 0.0000 173.7765 36 H 4.6493 8.2099 117.9134 51.7205 29.7445 171.6378 37 P 4.4878 0.0000 0.0000 64.6691 31.2692 177.4007 38 E 4.1655 8.2068 115.6905 59.0997 29.4876 179.0286 39 T 3.7426 8.1613 111.4643 64.4022 68.8128 176.2418 40 L 3.4372 7.8461 123.0594 57.9654 41.7414 178.7331 41 E 4.1070 7.8166 117.5415 58.8455 29.4370 178.7106 42 K 4.4410 8.2121 116.9851 56.6498 32.7223 176.8051 43 F 4.4725 8.0294 119.2350 55.4013 39.2299 175.9589 44 D 4.3250 8.5103 126.8681 57.1129 40.8737 179.2443 45 K 3.8470 7.8633 118.3844 58.6787 32.1972 176.8890 46 F 5.0519 7.7853 116.8125 57.3316 39.0650 177.0299 47 K 4.2559 7.9083 119.8945 57.7626 31.9224 177.3346 48 H 4.6710 7.4667 113.3202 55.0536 29.2327 174.6616 49 L 4.3973 7.2796 121.5480 54.5688 41.0633 176.7019 50 K 4.4043 8.8275 123.3912 56.4517 33.1435 176.6701 51 S 4.5742 7.2718 113.2939 55.9972 66.9633 174.6509 52 E 3.9003 8.6148 121.8823 59.5209 29.4315 178.1543 53 D 4.3882 8.0941 118.4101 57.5926 40.7722 178.6220 54 E 3.9904 8.0748 118.4613 59.6706 29.2170 179.3739 55 M 3.9940 7.8071 117.8384 58.2847 32.0785 178.7021 56 K 4.0577 8.4001 117.9744 59.1548 32.2839 178.8405 57 A 4.2704 7.7677 119.5244 52.7857 18.6710 177.5759 58 S 4.1526 7.4115 114.2194 58.2480 62.8275 174.7012 59 E 4.1033 8.8201 126.8241 59.1336 29.7450 178.5608 60 D 4.4884 8.1687 119.7350 56.8987 40.8650 178.1798 61 L 3.4510 8.0800 121.2175 57.8355 42.0352 178.9248 62 K 3.8701 7.7019 119.6584 59.4713 32.0709 178.7787 63 K 3.9698 8.2719 118.8339 59.7924 31.9160 178.8426 64 H 4.3572 8.5622 118.6115 59.2333 29.8629 177.4740 65 G 3.6015 8.3745 107.8225 47.7700 0.0000 175.0845 66 N 4.3073 8.3575 119.3743 56.7599 39.1224 177.0277 67 T 3.8672 8.1010 117.2246 66.6883 68.5848 175.8507 68 N 4.2938 8.2255 118.8396 57.0317 39.0251 176.9781 69 L 4.2227 8.2285 120.1925 57.8739 41.6832 179.5915 70 T 3.9600 8.3298 116.0521 66.6595 68.4110 176.3757 71 A 3.9782 7.9821 122.2488 54.9616 18.3430 179.3485 72 L 3.6833 8.0720 119.0126 58.1467 42.1461 179.2955 73 G 3.4112 8.2734 105.7488 47.8435 0.0000 175.8021 74 G 3.6485 7.8056 107.0152 47.3494 0.0000 175.6696 75 I 3.8426 7.4725 121.9353 64.2680 37.1243 178.4894 76 L 3.9192 7.7891 120.1136 57.6904 41.1609 179.7588 77 K 3.8742 7.6793 117.1711 58.7272 32.0026 178.5504 78 K 4.0135 7.5933 116.4432 55.6322 32.7657 179.0361 79 K 2.0000 8.9059 120.8889 57.4046 31.9736 175.9836 80 G 4.0678 8.7443 116.2661 47.2453 0.0000 173.8903 81 H 4.5110 7.0600 117.6693 54.7840 26.8519 174.9600 82 H 5.0785 7.5475 112.1169 54.0446 29.8629 176.0915 83 E 3.9240 8.5466 122.4243 60.2170 28.9644 178.8472 84 A 4.0418 7.9412 118.4984 54.9369 17.3938 178.9016 85 E 4.1408 7.9816 116.7937 59.1055 29.7680 178.8332 86 L 4.1429 8.7011 120.8816 58.5184 42.1916 178.5735 87 T 3.9056 8.0475 115.8399 66.6580 68.4868 174.2643 88 P 4.3785 0.0000 0.0000 66.1334 31.0119 178.0896 89 L 4.0770 7.6017 119.6554 57.9353 41.9800 178.8056 90 A 4.2430 8.4372 120.8883 54.8894 18.2833 179.6563 91 Q 3.9475 8.5764 117.6237 59.3223 28.8803 179.1220 92 S 4.0520 8.2041 115.1505 61.8356 63.0202 176.1435 93 H 4.1649 8.6774 119.6417 58.1467 28.2332 177.5295 94 A 3.0546 7.8360 122.5227 54.7211 18.3163 178.4886 95 T 3.8449 7.3745 107.1088 63.4322 69.3705 176.4997 96 K 3.9449 7.4940 122.7461 58.6574 32.5163 178.1485 97 H 4.4356 7.7600 112.8261 55.0968 29.6934 175.0598 98 K 3.5030 7.5811 117.5205 57.2905 28.9487 176.0786 99 I 4.3179 7.5949 118.9926 58.8937 38.4210 175.0766 100 P 4.5475 0.0000 0.0000 61.9614 32.4815 177.4376 101 V 3.4034 8.3966 118.6476 66.0662 31.1706 177.9117 102 K 3.6130 7.9445 118.7845 59.9395 31.7872 178.1525 103 Y 4.2905 8.0055 116.7249 60.9277 37.7624 178.1891 104 L 4.1307 7.8761 119.7217 57.8461 41.6963 179.4178 105 E 4.0398 7.9001 118.2032 59.2396 29.4480 179.1913 106 F 4.4852 7.7297 117.6465 60.7519 38.9495 177.6510 107 I 3.8528 8.3705 118.5568 64.0134 37.7632 178.0519 108 S 4.2182 8.3930 116.4038 61.4923 62.6332 176.2446 109 E 4.0089 8.3665 121.7223 59.2766 29.3646 178.7608 110 A 4.3438 8.0478 122.2136 54.5583 18.4042 179.5952 111 I 3.6545 8.1982 118.7646 64.6612 37.1695 178.6218 112 I 3.8285 7.8692 120.4291 64.6698 36.5136 178.5518 113 Q 4.0293 8.6089 119.2216 58.8663 28.4721 179.0607 114 V 3.6740 8.0394 120.9611 65.3899 31.5056 177.9050 115 L 3.7491 7.7841 118.6935 57.8077 41.1110 179.4280 116 Q 4.2550 7.9974 118.3967 59.3333 29.2615 178.1098 117 S 4.2467 8.3276 115.5744 61.2551 62.9234 176.2614 118 K 3.9988 8.1656 121.0510 57.3432 33.1104 176.6456 119 H 5.0347 8.3741 116.8726 53.7697 29.7604 173.1082 120 P 4.3750 0.0000 0.0000 66.2025 31.3368 178.5289 121 G 3.8114 8.3261 107.0740 47.8635 0.0000 173.6906 122 D 4.6710 7.9714 116.3113 54.3245 41.9214 176.4490 123 F 5.0729 8.0921 121.6659 56.7569 39.0413 174.4538 124 G 3.8614 7.5300 110.2900 43.7689 0.0000 171.4304 125 A 3.8787 8.3413 120.6847 55.4724 18.3532 179.6859 126 D 4.2407 7.9844 116.6126 57.3479 40.9552 178.7189 127 A 4.0257 7.8366 120.8724 55.0524 18.3509 179.4487 128 Q 3.2688 7.7370 116.6576 58.7755 28.7656 179.3655 129 G 3.5016 7.8789 106.2731 47.8086 0.0000 175.5785 130 A 3.8735 7.9657 123.7913 54.8391 18.3463 179.3943 131 M 4.0153 8.6010 117.1320 58.8369 32.2654 178.4314 132 S 4.1645 8.4014 115.6694 61.7467 63.0130 176.8837 133 K 3.8620 8.0449 120.6743 59.4292 31.6828 179.2532 134 A 3.9066 7.9451 121.0201 55.1538 18.1952 179.7478 135 L 4.0558 8.2095 117.6440 57.7111 41.6130 179.2364 136 E 3.9349 8.5673 119.7996 59.1250 29.4997 178.6458 137 L 3.9557 8.4030 120.8151 58.0340 42.2096 178.4761 138 F 4.1574 8.5311 120.7842 61.5339 39.3198 177.2903 139 R 3.4790 8.2649 117.5624 59.2528 29.8304 178.7251 140 N 4.2313 8.3007 116.4566 56.6355 38.5693 177.2872 141 D 4.3255 8.2669 120.1360 57.2456 40.7855 178.8498 142 M 3.7915 7.6219 119.2949 58.0073 31.8944 178.4833 143 A 3.5974 8.0972 121.0003 55.0638 18.5565 179.5218 144 A 3.9495 8.0750 119.3915 55.1554 18.4081 179.8286 145 K 3.9531 8.0569 118.1439 59.7941 32.3188 178.5596 146 Y 4.3770 8.5116 117.5017 61.2248 37.8036 178.9428 147 K 4.6400 8.2002 120.4914 59.2209 31.9869 179.0867 148 E 3.9789 7.9487 117.4194 59.5499 29.5090 179.0368 149 L 4.2706 7.8548 116.7449 55.6317 41.8265 177.8956 150 G 3.6645 7.9750 107.4816 45.0755 0.0000 172.9071 151 F 4.8642 8.3987 118.3178 54.8738 41.7889 174.6456 152 Q 4.4785 8.7351 121.2215 55.6689 28.9226 176.8871 153 G 3.7741 8.7355 111.2016 45.8014 0.0000 173.1105 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 G 8.35 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 2 L 7.66 4.23 0.00 0.61 0.71 0.55 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.37 4.49 0.00 4.06 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 4 D 8.70 4.65 0.00 2.85 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 5 G 8.10 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 E 8.21 3.91 0.00 1.98 1.70 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 2.21 2.26 0.00 7 W 8.13 4.41 0.00 3.53 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 Q 8.40 4.24 0.00 2.28 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.81 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 9 L 8.00 4.07 0.00 1.92 1.76 0.90 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 10 V 8.10 3.71 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.88 0.00 0.00 11 L 8.63 4.25 0.00 1.87 1.80 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 12 N 8.20 4.43 0.00 2.98 2.93 0.00 0.00 7.04 7.11 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 13 V 7.94 3.81 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 1.10 0.00 0.00 0.96 0.00 0.00 14 W 8.68 4.01 0.00 3.62 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 15 G 8.16 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 16 K 7.80 3.88 0.00 1.45 1.35 0.00 1.62 0.00 0.00 1.51 0.00 0.00 2.96 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.33 7.81 17 V 6.83 2.80 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.18 0.00 0.00 -0.07 0.00 0.00 18 E 8.03 3.88 0.00 2.07 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 2.43 2.44 0.00 19 A 7.35 4.23 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 20 D 7.93 4.62 0.00 2.67 2.52 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 21 V 7.74 3.48 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 1.08 0.00 0.00 0.93 0.00 0.00 22 A 7.97 4.07 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 23 G 8.23 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 24 H 8.21 4.11 0.00 3.26 3.23 0.00 5.82 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 G 8.25 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 26 Q 8.15 3.86 0.00 2.14 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.75 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 27 E 8.09 3.86 0.00 1.96 1.88 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 2.24 2.35 0.00 28 V 7.87 3.52 2.15 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 1.08 0.00 0.00 0.97 0.00 0.00 29 L 7.67 3.46 0.00 1.59 1.04 0.92 0.70 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 30 I 7.69 3.63 1.77 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 1.46 0.94 0.86 0.00 0.00 31 R 7.93 3.84 0.00 1.92 1.92 0.00 3.25 0.00 0.00 3.04 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.73 0.00 32 L 7.93 3.88 0.00 1.66 1.47 0.99 0.86 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 33 F 7.85 4.51 0.00 2.99 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 34 K 8.13 4.12 0.00 1.81 1.84 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.06 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.58 7.81 35 G 8.06 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 0.00 0.00 0.00 36 H 8.21 4.65 0.00 2.76 2.60 0.00 5.65 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 37 P 0.00 4.49 0.00 2.14 2.11 0.00 3.82 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.13 0.00 38 E 8.21 4.17 0.00 2.30 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.62 0.00 39 T 8.16 3.74 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 0.67 0.00 0.00 40 L 7.85 3.44 0.00 1.41 1.69 -0.03 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.82 4.11 0.00 2.27 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 2.37 2.54 0.00 42 K 8.21 4.44 0.00 1.81 1.70 0.00 1.86 0.00 0.00 1.77 0.00 0.00 3.16 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.73 1.93 7.81 43 F 8.03 4.47 0.00 3.23 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 44 D 8.51 4.33 0.00 2.64 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 45 K 7.86 3.85 0.00 1.32 1.07 0.00 1.70 0.00 0.00 1.59 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.39 1.41 7.81 46 F 7.79 5.05 0.00 2.93 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 47 K 7.91 4.26 0.00 1.71 1.85 0.00 1.92 0.00 0.00 1.90 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.75 1.53 7.81 48 H 7.47 4.67 0.00 3.29 3.44 0.00 5.52 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 L 7.28 4.40 0.00 1.48 1.59 0.70 1.29 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 50 K 8.83 4.40 0.00 1.73 1.82 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.50 7.81 51 S 7.27 4.57 0.00 3.98 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 52 E 8.61 3.90 0.00 2.03 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 2.35 2.37 0.00 53 D 8.09 4.39 0.00 2.71 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 54 E 8.07 3.99 0.00 2.20 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 2.33 2.34 0.00 55 M 7.81 3.99 0.00 1.94 2.24 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.77 2.50 0.00 56 K 8.40 4.06 0.00 1.76 1.83 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.64 7.81 57 A 7.77 4.27 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 58 S 7.41 4.15 0.00 3.89 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 E 8.82 4.10 0.00 2.26 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.43 0.00 60 D 8.17 4.49 0.00 3.00 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 61 L 8.08 3.45 0.00 1.13 1.57 0.69 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 62 K 7.70 3.87 0.00 1.78 1.93 0.00 1.67 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 63 K 8.27 3.97 0.00 2.06 1.92 0.00 1.77 0.00 0.00 1.61 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.50 1.80 7.81 64 H 8.56 4.36 0.00 3.59 3.72 0.00 5.79 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 G 8.37 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 66 N 8.36 4.31 0.00 2.78 3.02 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.10 3.87 4.42 0.00 0.00 0.00 0.00 0.00 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 68 N 8.23 4.29 0.00 2.76 3.01 0.00 0.00 7.29 6.39 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 69 L 8.23 4.22 0.00 1.80 1.90 0.88 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.33 3.96 4.47 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 1.26 0.00 0.00 71 A 7.98 3.98 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.07 3.68 0.00 1.61 1.62 0.15 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 73 G 8.27 3.41 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 0.00 74 G 7.81 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 75 I 7.47 3.84 1.86 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 1.51 1.04 0.89 0.00 0.00 76 L 7.79 3.92 0.00 1.10 1.51 -0.21 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 77 K 7.68 3.87 0.00 1.74 1.80 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.46 1.41 7.81 78 K 7.59 4.01 0.00 1.84 1.96 0.00 1.80 0.00 0.00 1.62 0.00 0.00 2.98 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.56 1.92 7.81 79 K 8.91 2.00 0.00 1.21 0.74 0.00 1.40 0.00 0.00 1.47 0.00 0.00 2.64 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.30 0.86 7.81 80 G 8.74 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 81 H 7.06 4.51 0.00 3.00 3.23 0.00 5.80 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 H 7.55 5.08 0.00 3.23 3.40 0.00 5.67 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 E 8.55 3.92 0.00 2.05 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 2.42 2.38 0.00 84 A 7.94 4.04 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 85 E 7.98 4.14 0.00 2.21 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 2.37 2.42 0.00 86 L 8.70 4.14 0.00 1.72 1.68 0.78 0.97 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 87 T 8.05 3.91 4.27 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 1.24 0.00 0.00 88 P 0.00 4.38 0.00 2.30 2.36 0.00 3.80 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.07 0.00 89 L 7.60 4.08 0.00 2.00 1.91 1.03 1.16 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 90 A 8.44 4.24 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 91 Q 8.58 3.95 0.00 2.25 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.42 2.57 0.00 92 S 8.20 4.05 0.00 3.98 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 93 H 8.68 4.16 0.00 3.55 3.59 0.00 5.80 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 A 7.84 3.05 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 T 7.37 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 1.22 0.00 0.00 96 K 7.49 3.94 0.00 1.60 1.64 0.00 1.62 0.00 0.00 1.57 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.35 1.36 7.81 97 H 7.76 4.44 0.00 3.00 3.12 0.00 5.81 0.00 0.00 0.00 0.00 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 K 7.58 3.50 0.00 1.81 1.75 0.00 1.66 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.33 1.33 7.81 99 I 7.59 4.32 2.05 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 1.40 0.97 1.14 0.00 0.00 100 P 0.00 4.55 0.00 1.96 1.93 0.00 3.39 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.94 0.00 101 V 8.40 3.40 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 0.89 0.00 0.00 0.62 0.00 0.00 102 K 7.94 3.61 0.00 1.70 1.58 0.00 1.96 0.00 0.00 1.97 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 0.67 1.30 7.81 103 Y 8.01 4.29 0.00 3.26 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 0.00 104 L 7.88 4.13 0.00 1.87 1.76 0.62 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 105 E 7.90 4.04 0.00 1.96 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 2.37 2.47 0.00 106 F 7.73 4.49 0.00 3.16 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 0.00 107 I 8.37 3.85 2.01 0.00 0.00 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 1.58 1.60 1.09 0.00 0.00 108 S 8.39 4.22 0.00 4.16 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 0.00 109 E 8.37 4.01 0.00 2.18 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 0.00 2.38 2.41 0.00 110 A 8.05 4.34 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 0.00 111 I 8.20 3.65 2.08 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 1.59 0.88 1.05 0.00 0.00 112 I 7.87 3.83 2.12 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.82 1.18 0.00 0.00 113 Q 8.61 4.03 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.60 0.00 114 V 8.04 3.67 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 1.27 0.00 0.00 0.92 0.00 0.00 115 L 7.78 3.75 0.00 1.02 0.39 0.72 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 8.00 4.26 0.00 2.40 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.98 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 117 S 8.33 4.25 0.00 4.03 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 0.00 118 K 8.17 4.00 0.00 1.20 1.50 0.00 1.60 0.00 0.00 1.33 0.00 0.00 2.57 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.26 1.45 7.81 119 H 8.37 5.03 0.00 3.14 3.19 0.00 5.65 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 P 0.00 4.38 0.00 2.24 2.38 0.00 3.81 0.00 0.00 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.01 0.00 121 G 8.33 3.81 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 0.00 0.00 0.00 122 D 7.97 4.67 0.00 2.78 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 0.00 123 F 8.09 5.07 0.00 2.93 3.04 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 0.00 0.00 0.00 124 G 7.53 3.86 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 0.00 0.00 0.00 125 A 8.34 3.88 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 D 7.98 4.24 0.00 2.67 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 0.00 127 A 7.84 4.03 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 0.00 128 Q 7.74 3.27 0.00 2.05 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 1.50 1.36 0.00 129 G 7.88 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 0.00 130 A 7.97 3.87 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 0.00 131 M 8.60 4.02 0.00 2.40 2.39 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.88 0.00 132 S 8.40 4.16 0.00 4.11 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 0.00 133 K 8.04 3.86 0.00 1.79 1.68 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.38 1.56 7.81 134 A 7.95 3.91 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 0.00 135 L 8.21 4.06 0.00 1.77 1.82 1.01 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 136 E 8.57 3.93 0.00 2.09 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 2.43 2.32 0.00 137 L 8.40 3.96 0.00 1.81 1.95 1.03 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 138 F 8.53 4.16 0.00 3.15 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 0.00 139 R 8.26 3.48 0.00 1.97 1.84 0.00 3.17 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 2.01 0.00 140 N 8.30 4.23 0.00 2.92 2.84 0.00 0.00 7.11 8.13 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 0.00 141 D 8.27 4.33 0.00 2.65 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 0.00 142 M 7.62 3.79 0.00 1.43 1.60 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.89 0.00 143 A 8.10 3.60 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 0.00 144 A 8.07 3.95 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 0.00 145 K 8.06 3.95 0.00 2.06 1.90 0.00 1.58 0.00 0.00 1.69 0.00 0.00 3.07 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.62 7.81 146 Y 8.51 4.38 0.00 3.19 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 0.00 147 K 8.20 4.64 0.00 1.98 1.88 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.61 7.81 148 E 7.95 3.98 0.00 2.19 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 2.57 0.00 149 L 7.85 4.27 0.00 2.07 1.91 1.04 1.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 150 G 7.98 3.66 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 0.00 0.00 0.00 151 F 8.40 4.86 0.00 3.04 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 0.00 152 Q 8.74 4.48 0.00 2.12 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.07 0.00 0.00 0.00 0.00 0.00 2.40 2.32 0.00 153 G 8.74 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