NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4382 8.3044 120.3270 54.8019 32.8087 174.8870 2 E 3.8850 8.7272 125.5540 55.0755 30.4080 170.4856 3 V 4.4014 8.9897 125.8471 60.8874 34.4624 174.4302 4 K 4.7181 8.4717 125.3606 54.6107 34.9102 175.4196 5 E 4.7547 8.5146 121.0336 54.8014 33.3463 175.1261 6 V 4.8052 8.1293 114.4934 59.8032 36.3270 174.6006 7 E 4.7364 8.7666 121.0682 54.7352 33.3227 174.8038 8 L 5.3592 8.5979 123.2025 53.1535 45.0848 175.4385 9 E 4.8804 9.0295 121.5728 54.2505 33.5644 174.1720 10 L 3.9626 8.8813 128.4709 55.6243 42.0286 176.6099 11 S 4.5571 8.7207 119.9115 59.0013 65.2500 173.4724 12 S 4.3161 7.3502 113.2484 56.7774 65.0783 172.5659 13 E 3.8870 8.8757 120.6144 57.7676 29.2263 176.1967 14 A 3.7762 8.5985 129.6485 53.3511 16.7191 175.6916 15 T 4.9522 7.4838 113.8885 63.1483 73.3386 173.7401 16 F 5.2944 9.2415 123.0436 55.6310 43.2452 174.1391 17 L 4.7546 9.3214 123.6950 54.3742 43.0459 175.8778 18 S 5.0382 9.3497 121.3432 56.6119 65.2013 173.2548 19 K 4.8350 9.2348 128.2974 55.9196 33.1534 175.7372 20 T 5.0271 8.7149 117.7027 59.7217 72.0213 174.9202 21 S 4.2274 8.9111 116.5822 61.0326 62.8367 175.4823 22 I 4.2135 8.1776 110.4792 59.8656 38.6735 176.1975 23 G 3.8692 6.0468 106.4198 45.6259 0.0000 170.2478 24 E 5.9476 8.5245 118.7167 53.6908 32.4120 175.7724 25 I 4.8391 8.2292 115.8397 59.2629 41.9781 173.8227 26 T 5.0576 8.4208 113.2875 60.5091 70.7862 173.1964 27 A 5.0974 10.3059 127.9574 49.4956 22.4643 176.1423 28 G 3.6064 8.6011 109.7055 44.8095 0.0000 173.0424 29 E 3.8981 8.3622 121.6564 59.0619 29.5991 179.2939 30 K 4.5994 8.3239 114.8910 55.9164 33.0601 176.4227 31 G 4.2122 7.4973 107.7194 45.2308 0.0000 172.9478 32 L 4.2851 8.8794 123.3945 54.5436 42.9737 176.5457 33 N 4.6204 8.8554 122.9659 53.2442 39.6676 173.5465 34 P 4.2677 0.0000 0.0000 66.3147 31.3799 178.6644 35 M 4.1940 8.0924 116.6514 58.2047 31.9233 178.5384 36 E 4.1048 8.6394 119.1208 59.2861 29.5492 179.2302 37 L 4.0630 8.2348 119.3781 57.4384 41.5199 179.3124 38 L 3.9877 7.9146 120.5932 58.2062 42.0128 179.0413 39 L 3.9604 7.8090 119.0027 57.7392 41.4313 179.7156 40 V 3.5947 7.9019 118.3333 65.8866 31.4300 178.3227 41 S 4.1211 8.3078 115.2646 61.5772 62.7231 176.6840 42 I 3.8121 8.0380 122.6533 64.3666 36.8613 178.6660 43 G 3.6237 8.3687 107.0876 47.9103 0.0000 175.8424 44 S 4.1454 8.4487 117.4936 61.0494 62.5876 175.9966 45 C 4.0614 8.2129 122.4016 62.3914 31.2569 175.6347 46 S 4.5411 7.7603 116.1585 60.7774 61.9403 176.1523 47 G 3.7260 8.6194 109.0188 47.8505 0.0000 175.7850 48 V 3.5715 8.0364 120.4936 65.7853 31.4544 177.8521 49 D 4.2549 7.7356 117.8417 57.5014 40.6707 178.8230 50 V 3.4802 8.0465 118.9205 66.0939 31.4309 177.3047 51 Y 3.9097 8.2030 119.1941 61.1608 38.6030 177.9124 52 H 4.1987 8.2012 116.9991 58.8518 28.7029 177.9858 53 I 3.6050 8.0080 121.9007 64.3792 36.9224 178.4226 54 L 3.8510 8.0155 120.1200 57.6265 41.3875 179.6234 55 K 3.7290 7.7569 119.5500 59.2901 31.9058 178.8884 56 K 3.9867 7.9785 119.1469 58.9083 32.0530 177.7522 57 K 4.3656 7.8342 117.3148 55.6919 32.2049 176.8279 58 R 3.8567 7.4619 115.9675 57.3164 28.1086 176.3107 59 Q 4.2792 7.9254 116.0473 55.4988 30.2105 176.0787 60 E 4.2747 8.4726 122.2772 55.1671 30.5165 175.1922 61 V 4.1160 8.0283 125.4852 61.6858 31.8112 175.2869 62 K 4.2560 9.0914 130.3990 58.7085 33.1339 175.8252 63 D 4.6373 7.5151 116.1914 53.6045 44.7488 174.5249 64 I 5.0979 8.3136 122.3991 59.6540 40.8284 174.7426 65 K 4.5190 9.3298 126.9493 54.4637 35.0499 175.3238 66 I 4.7676 7.7424 124.0660 59.3798 40.4582 174.5723 67 F 4.7805 9.0777 125.9459 55.5528 41.4493 174.4134 68 L 5.2049 8.5943 123.2617 52.6802 44.5691 175.7856 69 K 4.4820 9.1659 124.6919 54.4644 35.1851 174.8615 70 G 3.8951 8.6501 113.9523 44.0777 0.0000 172.0063 71 K 4.8272 8.9264 123.2925 54.5651 34.5036 175.7278 72 R 5.0081 8.6612 124.1190 54.8513 31.5905 176.5531 73 R 4.0964 8.6038 123.1122 56.6522 30.3285 176.5551 74 E 4.1466 8.8618 123.1126 57.7327 30.0943 177.1705 75 K 4.4975 7.5632 116.3438 54.9169 34.8518 175.5968 76 H 4.5163 8.3471 117.5464 54.9137 29.3418 173.7304 77 P 4.4901 0.0000 0.0000 62.4541 32.5954 177.4201 78 K 4.3469 8.3105 122.8151 55.8441 30.7364 175.9590 79 I 3.8772 7.0778 114.7445 60.6700 40.0137 176.3616 80 Y 4.8403 8.1375 120.6105 58.0073 37.7750 176.0045 81 E 4.3192 9.6589 125.1953 58.3994 31.0544 176.3259 82 E 5.2581 8.0421 119.4786 54.7657 33.8073 173.9236 83 I 4.8450 8.7088 125.9019 59.7896 41.3217 173.8034 84 E 5.1062 9.4552 127.4578 54.7618 31.9072 175.1766 85 I 4.8409 8.8960 125.0026 59.2811 40.8199 174.2008 86 K 5.1886 9.0872 128.7693 54.8588 34.9441 174.0219 87 Y 5.1760 9.3116 125.4619 56.4001 40.5291 174.8471 88 V 5.0627 9.3777 123.8965 61.2495 34.5027 173.7976 89 A 5.1341 8.8509 130.4287 50.4245 21.3731 175.5018 90 V 4.5216 9.5484 122.3733 60.7797 34.3055 174.0474 91 G 3.5563 7.5950 114.6849 44.7710 0.0000 174.1898 92 K 2.4800 7.6802 115.8972 53.8056 30.5475 174.2953 93 V 4.5469 6.5458 118.6688 60.3212 34.3965 175.3167 94 E 4.5474 8.7222 126.8102 55.7315 31.3479 177.1661 95 E 4.1169 9.1152 123.9171 59.5517 29.6510 179.3974 96 K 3.9959 8.1459 118.1014 59.8116 32.6682 178.9969 97 A 3.9147 7.8241 121.5181 54.7507 18.3535 179.1727 98 L 3.7176 7.8410 118.9238 58.1070 42.0924 178.6508 99 E 2.5400 8.0765 119.4286 59.0005 29.4391 178.8179 100 Q 3.8027 7.8533 117.6348 58.8234 28.7770 178.7737 101 A 3.8378 7.8635 121.7284 55.1122 18.3331 179.8954 102 V 3.0439 7.5142 117.0599 65.7869 31.3838 178.4780 103 K 3.8560 7.8307 118.4178 59.3782 31.9148 179.3793 104 L 3.9638 7.9901 119.4078 57.6862 41.0377 179.5439 105 S 4.2243 8.1577 113.2736 61.8120 62.2605 176.4599 106 T 4.0690 8.0830 111.1845 63.9233 68.6742 175.2563 107 E 4.5200 8.2058 119.1179 56.1281 30.4279 176.0809 108 K 4.2958 7.5856 116.4928 57.8803 35.9468 176.4193 109 Y 4.2901 7.8684 114.6518 60.1342 38.5628 175.0487 110 C 4.3033 8.4998 121.5898 59.5767 31.0654 174.0979 111 S 4.1388 8.7315 124.2864 61.4891 62.7114 176.3716 112 V 3.7460 7.7504 120.4119 66.0336 31.4069 177.6299 113 L 3.9796 7.9866 119.3227 58.1565 41.7613 178.5656 114 A 4.0681 7.8345 119.7083 55.3315 18.3291 179.1422 115 M 4.1985 7.8290 116.1707 57.4409 32.3645 178.1684 116 V 4.2697 7.6389 110.6404 61.2628 33.0598 177.6563 117 K 3.8587 8.0222 119.0377 59.2799 31.9708 176.9022 118 P 4.5402 0.0000 0.0000 64.1673 31.1955 176.8058 119 S 4.7266 8.1380 113.2491 58.0778 63.8454 173.0218 120 T 4.6161 7.6813 113.7598 61.0717 71.0913 172.4060 121 N 4.7379 8.8862 124.2431 52.3469 40.0400 173.2958 122 L 5.0259 8.4996 128.9966 53.7897 43.7368 175.6187 123 K 4.6019 9.0181 125.5434 54.9332 34.7303 174.9638 124 I 5.3050 8.5085 126.0516 59.7323 39.5838 175.3486 125 S 4.6727 9.2630 119.4681 57.1756 66.7661 172.5811 126 W 5.9785 7.6199 116.5822 56.0640 31.0337 173.1889 127 E 4.9415 9.3688 116.7944 55.7221 32.5092 174.4666 128 V 4.9942 8.5845 114.0761 59.6915 35.0998 175.6133 129 K 4.5597 8.8797 122.8803 54.1566 34.7523 175.3520 130 W 4.6337 8.9382 135.0000 57.3676 30.7659 175.0742 131 E 4.8662 8.6092 125.8812 54.7218 34.1124 175.7731 132 E 4.2005 8.6724 120.0245 56.6332 30.1394 176.1608 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 4.44 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.54 0.00 2 E 8.73 3.89 0.00 2.01 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.36 0.00 3 V 8.99 4.40 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 0.89 0.00 0.00 0.98 0.00 0.00 4 K 8.47 4.72 0.00 1.74 1.66 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.16 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.32 1.36 7.81 5 E 8.51 4.75 0.00 1.88 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.30 0.00 6 V 8.13 4.81 2.14 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 0.72 0.00 0.00 0.91 0.00 0.00 7 E 8.77 4.74 0.00 1.83 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 2.21 2.26 0.00 8 L 8.60 5.36 0.00 1.35 1.55 0.87 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 9 E 9.03 4.88 0.00 2.07 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.30 0.00 10 L 8.88 3.96 0.00 1.59 1.48 0.32 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 11 S 8.72 4.56 0.00 3.89 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 12 S 7.35 4.32 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 13 E 8.88 3.89 0.00 1.90 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 2.27 2.30 0.00 14 A 8.60 3.78 1.34 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 15 T 7.48 4.95 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 1.23 0.00 0.00 16 F 9.24 5.29 0.00 2.99 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 17 L 9.32 4.75 0.00 1.59 1.63 0.93 0.79 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 18 S 9.35 5.04 0.00 3.72 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 19 K 9.23 4.84 0.00 1.80 1.80 0.00 1.58 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.39 7.81 20 T 8.71 5.03 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 21 S 8.91 4.23 0.00 3.88 3.97 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 22 I 8.18 4.21 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.59 0.90 0.00 0.00 23 G 6.05 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 E 8.52 5.95 0.00 1.83 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.11 0.00 25 I 8.23 4.84 1.88 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 1.19 0.92 0.00 0.00 26 T 8.42 5.06 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 27 A 10.31 5.10 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 28 G 8.60 3.61 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 0.00 0.00 0.00 29 E 8.36 3.90 0.00 2.04 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 0.00 2.33 2.31 0.00 30 K 8.32 4.60 0.00 1.73 1.77 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.33 7.81 31 G 7.50 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 0.00 0.00 0.00 0.00 32 L 8.88 4.29 0.00 1.64 1.64 0.94 0.72 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 33 N 8.86 4.62 0.00 2.80 2.73 0.00 0.00 7.21 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 34 P 0.00 4.27 0.00 2.20 2.10 0.00 3.67 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.23 0.00 35 M 8.09 4.19 0.00 1.99 2.21 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.48 0.00 36 E 8.64 4.10 0.00 2.23 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 2.39 2.59 0.00 37 L 8.23 4.06 0.00 1.91 1.74 0.94 0.78 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 38 L 7.91 3.99 0.00 1.85 2.03 0.98 0.80 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 39 L 7.81 3.96 0.00 1.88 1.65 0.79 0.43 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 40 V 7.90 3.59 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 1.09 0.00 0.00 0.98 0.00 0.00 41 S 8.31 4.12 0.00 4.08 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 42 I 8.04 3.81 2.01 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 1.49 1.05 0.93 0.00 0.00 43 G 8.37 3.62 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 0.00 0.00 0.00 44 S 8.45 4.15 0.00 4.01 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 C 8.21 4.06 0.00 3.16 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 46 S 7.76 4.54 0.00 4.08 4.01 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 0.00 0.00 0.00 47 G 8.62 3.73 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 V 8.04 3.57 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 1.08 0.00 0.00 0.98 0.00 0.00 49 D 7.74 4.25 0.00 2.95 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 50 V 8.05 3.48 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 1.01 0.00 0.00 0.74 0.00 0.00 51 Y 8.20 3.91 0.00 3.14 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 52 H 8.20 4.20 0.00 3.32 3.25 0.00 5.67 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 I 8.01 3.61 1.77 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.71 0.83 0.00 0.00 54 L 8.02 3.85 0.00 1.67 1.56 0.85 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 55 K 7.76 3.73 0.00 1.46 1.78 0.00 1.44 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.34 1.29 7.81 56 K 7.98 3.99 0.00 1.84 1.91 0.00 1.78 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.44 7.81 57 K 7.83 4.37 0.00 1.77 1.76 0.00 1.86 0.00 0.00 1.78 0.00 0.00 3.03 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.41 1.52 7.81 58 R 7.46 3.86 0.00 1.97 2.00 0.00 3.28 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.71 0.00 59 Q 7.93 4.28 0.00 1.90 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.23 6.88 0.00 0.00 0.00 0.00 0.00 2.43 2.42 0.00 60 E 8.47 4.27 0.00 1.76 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.17 0.00 61 V 8.03 4.12 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 0.81 0.00 0.00 0.77 0.00 0.00 62 K 9.09 4.26 0.00 1.68 1.82 0.00 1.86 0.00 0.00 1.62 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.35 7.81 63 D 7.52 4.64 0.00 2.79 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 64 I 8.31 5.10 1.93 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.85 1.00 0.00 0.00 65 K 9.33 4.52 0.00 1.69 1.26 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.90 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.30 1.40 7.81 66 I 7.74 4.77 1.65 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 1.34 0.53 0.51 0.00 0.00 67 F 9.08 4.78 0.00 2.89 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 68 L 8.59 5.20 0.00 1.38 1.43 0.80 0.84 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 69 K 9.17 4.48 0.00 1.75 1.57 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.28 1.34 7.81 70 G 8.65 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 71 K 8.93 4.83 0.00 1.75 1.76 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.39 7.81 72 R 8.66 5.01 0.00 1.69 1.91 0.00 3.15 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.75 0.00 73 R 8.60 4.10 0.00 1.80 1.80 0.00 3.51 0.00 0.00 3.22 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.87 0.00 74 E 8.86 4.15 0.00 1.98 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 2.29 2.28 0.00 75 K 7.56 4.50 0.00 1.83 1.77 0.00 1.57 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.31 1.42 7.81 76 H 8.35 4.52 0.00 3.14 3.27 0.00 5.89 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 P 0.00 4.49 0.00 2.16 2.05 0.00 3.77 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 1.98 1.98 0.00 78 K 8.31 4.35 0.00 1.70 1.74 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.49 1.26 7.81 79 I 7.08 3.88 1.86 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 1.47 0.96 0.88 0.00 0.00 80 Y 8.14 4.84 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 81 E 9.66 4.32 0.00 1.94 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 82 E 8.04 5.26 0.00 2.02 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 83 I 8.71 4.84 1.83 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 0.88 0.63 0.76 0.00 0.00 84 E 9.46 5.11 0.00 1.83 1.84 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 2.24 2.35 0.00 85 I 8.90 4.84 1.88 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 1.02 1.00 0.35 0.00 0.00 86 K 9.09 5.19 0.00 1.84 1.79 0.00 1.58 0.00 0.00 1.59 0.00 0.00 2.79 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.47 7.81 87 Y 9.31 5.18 0.00 3.16 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 88 V 9.38 5.06 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 1.13 0.00 0.00 1.18 0.00 0.00 89 A 8.85 5.13 1.28 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 0.00 0.00 0.00 90 V 9.55 4.52 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 0.00 0.00 0.97 0.00 0.00 91 G 7.59 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 7.68 2.48 0.00 1.48 1.25 0.00 2.05 0.00 0.00 1.72 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 0.89 1.01 7.81 93 V 6.55 4.55 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 0.83 0.00 0.00 0.78 0.00 0.00 94 E 8.72 4.55 0.00 2.14 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 0.00 2.63 2.59 0.00 95 E 9.12 4.12 0.00 2.14 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 2.68 2.49 0.00 96 K 8.15 4.00 0.00 2.04 2.10 0.00 1.57 0.00 0.00 1.85 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.54 1.53 7.81 97 A 7.82 3.91 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 98 L 7.84 3.72 0.00 1.79 1.82 0.85 1.13 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 99 E 8.08 2.54 0.00 1.93 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 0.00 2.08 1.78 0.00 100 Q 7.85 3.80 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.32 2.52 0.00 101 A 7.86 3.84 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 0.00 102 V 7.51 3.04 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 0.72 0.00 0.00 0.15 0.00 0.00 103 K 7.83 3.86 0.00 1.73 1.75 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.34 1.26 7.81 104 L 7.99 3.96 0.00 1.79 1.97 0.97 0.70 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 0.00 105 S 8.16 4.22 0.00 3.94 3.97 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 0.00 106 T 8.08 4.07 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 1.34 0.00 0.00 107 E 8.21 4.52 0.00 2.04 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 2.28 0.00 108 K 7.59 4.30 0.00 1.41 1.52 0.00 1.47 0.00 0.00 1.04 0.00 0.00 2.84 0.00 0.00 2.53 0.00 0.00 0.00 0.00 0.30 1.05 7.81 109 Y 7.87 4.29 0.00 3.06 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 0.00 110 C 8.50 4.30 0.00 3.14 2.95 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 0.00 111 S 8.73 4.14 0.00 3.91 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 0.00 112 V 7.75 3.75 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 1.06 0.00 0.00 1.00 0.00 0.00 113 L 7.99 3.98 0.00 1.85 1.69 0.96 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 114 A 7.83 4.07 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 0.00 115 M 7.83 4.20 0.00 1.97 2.30 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 2.83 2.58 0.00 116 V 7.64 4.27 2.14 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 0.89 0.00 0.00 1.05 0.00 0.00 117 K 8.02 3.86 0.00 1.85 1.91 0.00 1.70 0.00 0.00 1.73 0.00 0.00 2.92 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.50 1.65 7.81 118 P 0.00 4.54 0.00 2.05 2.11 0.00 3.59 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 2.04 2.12 0.00 119 S 8.14 4.73 0.00 3.84 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 0.00 120 T 7.68 4.62 4.37 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 121 N 8.89 4.74 0.00 2.93 2.85 0.00 0.00 7.16 6.46 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 0.00 122 L 8.50 5.03 0.00 1.71 1.59 1.02 0.67 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 0.00 123 K 9.02 4.60 0.00 1.73 1.70 0.00 1.68 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.35 1.38 7.81 124 I 8.51 5.31 2.14 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.71 1.41 0.00 0.00 125 S 9.26 4.67 0.00 3.70 3.83 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 0.00 126 W 7.62 5.98 0.00 3.38 3.37 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.37 4.94 0.00 2.09 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.37 0.00 128 V 8.58 4.99 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 0.92 0.00 0.00 1.11 0.00 0.00 129 K 8.88 4.56 0.00 1.68 1.76 0.00 1.73 0.00 0.00 1.64 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.54 7.81 130 W 8.94 4.63 0.00 3.55 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 0.00 131 E 8.61 4.87 0.00 1.81 1.72 0.00 0.00 0.00 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 2.29 0.00 132 E 8.67 4.20 0.00 1.96 1.84 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 2.30 2.42 0.00