NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 E 4.2755 8.4449 121.4672 56.5161 30.7006 175.2895 6 N 4.7235 8.5057 115.7158 52.2611 39.2407 173.2024 7 C 4.4324 8.0672 119.8003 58.4556 33.5972 173.2285 8 I 3.7645 8.3722 128.2138 64.3523 37.7205 177.7617 9 F 4.5703 8.1830 118.2765 60.7598 38.7798 177.3318 10 C 4.3892 8.3105 116.0248 62.6203 28.0052 176.0274 11 K 4.0604 8.0001 119.7955 59.1704 31.4309 179.5113 12 I 3.9373 7.4141 121.6970 63.6392 36.7535 178.4294 13 I 3.7288 7.6763 119.5363 64.4177 37.0721 178.2048 14 A 4.1801 8.0271 120.3972 53.4407 18.2580 178.4236 15 G 4.0005 7.4964 104.4693 45.4416 0.0000 174.5073 16 D 4.4174 8.2101 120.0802 56.8191 41.0739 176.8085 17 I 4.3322 7.4037 119.8942 58.6585 38.6393 173.8382 18 P 4.5073 0.0000 0.0000 63.0270 31.9871 175.4053 19 S 4.3926 7.8795 111.2535 57.4082 65.2739 174.9888 20 A 4.4601 8.1988 124.6622 50.4247 17.9975 175.2112 21 K 4.4360 8.3736 119.2677 57.1225 32.2627 176.5683 22 V 4.2699 8.9750 125.2941 64.3715 33.3731 175.2546 23 Y 4.8540 7.7103 119.1408 56.5490 42.3246 173.2568 24 E 5.1690 7.3519 123.9397 55.7332 32.6869 174.0889 25 D 4.4812 8.6326 125.7126 52.4270 42.0182 173.9156 26 E 4.0137 9.1348 117.2767 60.3763 29.5200 177.5728 27 H 5.1072 8.4022 111.4804 55.1980 31.2647 173.1565 28 V 5.1464 9.2908 119.2525 61.0679 35.2632 173.9527 29 L 5.4014 9.3285 128.0277 53.3620 45.5865 174.7756 30 A 5.1548 9.5724 127.8545 50.1809 22.3656 174.7239 31 F 5.2879 8.0052 115.2899 55.1217 41.8855 173.8715 32 L 4.5476 8.4920 120.2436 55.0319 42.5220 176.3686 33 D 4.8151 8.6188 122.9934 52.9698 41.6822 177.3595 34 I 3.9608 8.7881 120.2985 63.5135 37.7105 177.4096 35 S 4.1483 8.9619 117.6251 59.9972 63.3248 174.3444 36 Q 3.3643 8.3305 118.5047 56.4434 26.5000 174.5911 37 V 3.8060 7.6087 112.1792 64.4297 32.6381 176.8966 38 T 4.9017 7.3921 107.4883 59.5014 71.4442 172.7379 39 K 4.1031 8.3328 124.4435 57.9481 32.3516 177.1030 40 G 3.7246 8.9712 115.0569 44.5457 0.0000 172.6285 41 H 4.2311 7.9854 120.1877 57.4900 30.7841 173.9136 42 T 5.0689 8.9930 121.3935 61.7125 72.9576 172.7321 43 L 4.7663 8.6801 125.1762 52.9350 44.0471 175.4476 44 V 4.6123 8.4476 124.4870 60.9994 33.6605 174.4564 45 I 5.4008 8.8630 120.9801 58.5399 41.4890 172.4826 46 P 5.1480 0.0000 0.0000 62.4086 31.7246 176.4352 47 K 4.2785 9.3865 123.0523 59.7221 32.7124 178.0166 48 T 4.1226 7.8978 116.6174 63.0394 69.0873 173.6234 49 H 4.1315 8.7569 126.7645 55.7067 30.6130 174.4238 50 I 4.5852 7.3946 119.1627 58.9244 40.4499 175.6326 51 E 4.1153 9.0851 124.3904 58.6613 29.9990 175.6905 52 N 4.9742 7.6073 113.9800 51.8083 39.8843 174.9751 53 V 3.8828 8.7753 117.1488 64.6849 31.3997 178.0574 54 Y 4.4113 7.6530 118.0655 60.8057 37.8123 176.2372 55 E 4.4355 8.1193 117.1455 56.2772 29.5262 176.5368 56 F 4.0940 7.6460 117.9085 57.4516 39.5875 175.6036 57 T 4.7042 8.2465 114.7985 59.8334 72.3941 175.3360 58 D 4.3444 8.5226 121.5735 57.6361 40.8944 178.7293 59 E 3.9368 8.1722 119.1303 59.3760 29.4975 178.5308 60 L 4.0933 7.6639 118.8689 57.9654 42.3649 178.4491 61 A 4.0497 8.4366 121.3236 54.9232 18.0628 179.5247 62 K 4.0112 8.3118 117.6782 59.5227 32.4173 178.2781 63 Q 4.4029 8.1097 115.2925 56.6731 29.0339 175.7748 64 Y 4.6539 7.7870 119.6859 59.4771 40.3090 176.9672 65 F 4.0380 8.3694 121.1455 61.6216 38.9590 176.4206 66 H 3.8527 8.4239 113.8813 58.7198 27.8190 177.1285 67 A 3.1672 7.0047 122.9558 54.2819 17.9478 179.7319 68 V 3.1902 7.0848 117.0078 65.7371 31.5898 176.6425 69 P 4.0729 0.0000 0.0000 65.1104 31.2429 178.8855 70 K 3.8806 7.2352 117.3026 59.4465 31.9003 179.5233 71 I 3.6279 7.8031 120.2916 63.9914 36.9352 178.2221 72 A 3.9152 8.1255 122.0684 55.4209 18.1399 179.9595 73 R 3.8277 7.9666 116.2091 59.2211 30.0812 179.2305 74 A 3.9578 7.8913 120.3371 55.2975 18.4109 179.8310 75 I 3.9373 8.0619 118.4172 64.1049 37.1259 178.7808 76 R 3.8610 8.0467 119.9142 59.7298 29.8040 178.4335 77 D 4.3809 8.1102 117.4333 56.9644 40.8149 178.2416 78 E 3.8505 8.0410 119.3169 58.6886 29.8248 177.9881 79 F 4.8036 7.8923 113.8397 56.1576 40.9054 175.2713 80 E 3.8709 8.3214 118.3742 56.7113 27.3282 172.3897 81 P 4.4559 0.0000 0.0000 62.6941 32.6370 176.3822 82 I 4.1668 7.6944 110.4737 59.8465 37.7095 175.1077 83 G 3.9268 7.0526 108.1120 46.8371 0.0000 171.8209 84 L 4.8063 7.9024 117.8749 54.2861 44.7440 173.1602 85 N 5.2865 8.9178 122.7262 51.5214 42.9937 173.2513 86 T 5.0602 8.2650 109.7207 60.0318 71.6785 172.9778 87 L 4.7509 8.9081 127.0512 53.1171 45.6369 174.2667 88 N 5.1280 8.8618 123.9166 51.7314 41.5881 172.9382 89 N 4.9110 8.6181 122.6382 51.3880 41.1139 173.6228 90 N 4.9732 8.9317 120.0233 54.4076 40.8210 174.7000 91 G 4.1968 9.3944 111.7420 45.1441 0.0000 173.3682 92 E 4.2468 9.2233 122.3050 58.4937 29.7326 178.9721 93 K 4.1759 8.1612 115.3352 58.0358 32.2595 177.0978 94 A 4.4567 7.9785 121.1195 51.5528 19.4275 177.5458 95 G 3.9730 7.8486 103.8024 44.9018 0.0000 173.9850 96 Q 3.8923 8.0571 121.9118 55.9915 28.8282 176.0690 97 S 4.3015 8.4382 120.6854 58.7761 64.3159 174.5418 98 V 4.0783 7.1139 119.9514 60.7656 33.3130 176.1895 99 F 4.2961 8.4992 129.3426 55.7545 37.4702 174.5288 100 H 4.8439 7.4370 119.2467 54.6609 32.6706 171.8144 101 Y 4.1879 8.6453 128.6451 58.5954 38.9591 175.3356 102 H 5.0258 7.6241 119.3156 54.6949 31.7671 172.1789 103 M 4.5255 8.9790 120.8084 54.0902 34.7355 174.1597 104 H 4.8143 9.3060 124.4475 55.3575 30.5581 174.3392 105 I 4.5617 9.0699 125.3456 59.8225 39.1356 175.0456 106 I 4.6520 8.5171 130.2141 58.4881 38.9339 173.7729 107 P 4.4990 0.0000 0.0000 62.5964 32.4566 175.8549 108 R 4.6721 8.3061 120.6286 54.8089 32.6083 176.1265 109 Y 4.6804 9.7333 119.1012 57.3444 40.9172 176.0148 110 G 4.0439 8.6855 107.3356 43.3330 0.0000 176.5032 111 K 3.9043 8.6888 125.0950 58.1976 31.8749 176.3661 112 G 4.0576 9.1514 112.1687 45.3323 0.0000 173.4625 113 D 4.4258 8.4293 120.9319 54.9193 41.0260 177.6344 114 G 3.6767 8.8381 112.8380 46.4942 0.0000 173.0240 115 F 4.8938 7.2561 122.1994 56.3472 41.6980 174.5399 116 G 3.5127 6.6621 112.3377 44.3864 0.0000 172.1743 117 A 4.4667 7.9215 124.5611 49.8570 20.7193 176.7388 118 V 3.8883 8.3704 123.4450 61.7529 32.0408 174.9486 119 W 4.5921 8.8392 135.0000 55.4892 32.1793 174.6105 120 K 4.3786 8.0340 125.5443 54.6158 33.1497 176.2682 121 T 4.0744 8.1071 120.8160 63.7863 69.5322 174.6811 122 H 4.9912 8.2527 120.3698 55.1797 30.1528 175.7737 123 A 4.1093 8.2604 124.3669 55.4977 18.6288 179.6398 124 D 4.7064 8.0883 112.4791 55.6835 40.9909 176.5170 125 D 4.6119 7.9477 118.1900 54.6858 41.3319 175.9389 126 Y 4.7543 7.7146 116.6656 56.0340 41.7790 175.0741 127 K 4.6293 8.4680 122.4773 54.1475 33.9908 175.9322 128 P 4.3105 0.0000 0.0000 66.5155 30.7799 178.5238 129 E 4.0405 8.1495 117.6263 59.1240 29.4137 178.7472 130 D 4.4393 8.1593 119.2436 57.3280 40.8040 178.7377 131 L 4.0454 7.9410 119.0873 57.7839 41.5697 179.4387 132 Q 3.9904 7.7664 117.7034 58.9500 28.6134 178.5400 133 N 4.3483 8.2395 117.4852 56.3833 38.4869 177.5919 134 I 3.7413 8.1829 121.8735 64.2305 37.1037 178.7159 135 S 4.0692 8.3217 115.3085 61.5718 63.0440 176.1839 136 S 4.0602 8.3036 117.9396 61.0277 61.8293 176.1419 137 S 4.1378 7.9603 116.3064 61.8831 62.7455 176.6685 138 I 3.8491 7.5872 121.9233 64.3981 36.9858 178.4387 139 A 4.0343 8.3563 121.5967 54.7588 17.8452 179.8344 140 K 4.0503 7.7309 116.6376 59.7732 32.3529 179.3984 141 R 4.1556 7.8154 118.2936 58.6184 29.8117 178.0077 142 L 4.5153 7.3646 116.6948 54.5152 41.5039 176.8421 143 A 4.1067 8.1889 127.8979 53.0900 19.8258 177.0871 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 5 E 8.44 4.28 0.00 1.85 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.34 0.00 6 N 8.51 4.72 0.00 2.79 2.77 0.00 0.00 6.72 6.78 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 7 C 8.07 4.43 0.00 3.04 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 8 I 8.37 3.76 1.90 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 1.79 1.24 0.83 0.00 0.00 9 F 8.18 4.57 0.00 3.01 2.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 C 8.31 4.39 0.00 3.22 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 11 K 8.00 4.06 0.00 2.05 1.86 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.73 7.81 12 I 7.41 3.94 1.80 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.23 0.15 0.00 0.00 13 I 7.68 3.73 2.12 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.72 0.98 0.00 0.00 14 A 8.03 4.18 1.37 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 0.00 0.00 15 G 7.50 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 16 D 8.21 4.42 0.00 2.77 2.73 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 17 I 7.40 4.33 1.81 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 1.46 1.21 0.87 0.00 0.00 18 P 0.00 4.51 0.00 2.14 2.03 0.00 3.77 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 1.95 1.93 0.00 19 S 7.88 4.39 0.00 3.57 3.40 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 20 A 8.20 4.46 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 21 K 8.37 4.44 0.00 1.68 1.82 0.00 1.72 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.45 7.81 22 V 8.98 4.27 2.24 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 0.79 0.00 0.00 1.00 0.00 0.00 23 Y 7.71 4.85 0.00 3.08 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 24 E 7.35 5.17 0.00 1.94 1.63 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 2.13 2.29 0.00 25 D 8.63 4.48 0.00 2.74 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 26 E 9.13 4.01 0.00 1.88 1.54 0.00 0.00 0.00 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 27 H 8.40 5.11 0.00 3.20 3.38 0.00 5.56 0.00 0.00 0.00 0.00 6.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 V 9.29 5.15 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 1.17 0.00 0.00 1.18 0.00 0.00 29 L 9.33 5.40 0.00 1.87 1.61 1.08 1.20 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 30 A 9.57 5.15 1.18 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 0.00 0.00 31 F 8.01 5.29 0.00 3.15 3.08 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 32 L 8.49 4.55 0.00 1.65 1.69 0.99 1.12 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 33 D 8.62 4.82 0.00 2.42 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 0.00 0.00 0.00 0.00 34 I 8.79 3.96 1.91 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 1.49 0.76 0.96 0.00 0.00 35 S 8.96 4.15 0.00 4.07 4.04 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 36 Q 8.33 3.36 0.00 2.10 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.93 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 37 V 7.61 3.81 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 0.84 0.00 0.00 0.77 0.00 0.00 38 T 7.39 4.90 4.50 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 1.38 0.00 0.00 39 K 8.33 4.10 0.00 1.44 1.24 0.00 1.57 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 3.13 0.00 0.00 0.00 0.00 0.99 1.30 7.81 40 G 8.97 3.72 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 0.00 0.00 0.00 0.00 0.00 0.00 41 H 7.99 4.23 0.00 3.45 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 T 8.99 5.07 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 1.11 0.00 0.00 43 L 8.68 4.77 0.00 0.57 0.91 0.93 0.56 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 44 V 8.45 4.61 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 0.92 0.00 0.00 0.78 0.00 0.00 45 I 8.86 5.40 2.12 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 1.49 0.71 0.75 0.00 0.00 46 P 0.00 5.15 0.00 2.11 2.06 0.00 4.15 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 1.73 0.00 47 K 9.39 4.28 0.00 1.73 2.01 0.00 1.98 0.00 0.00 1.76 0.00 0.00 2.98 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.58 1.66 7.81 48 T 7.90 4.12 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 49 H 8.76 4.13 0.00 3.10 3.21 0.00 5.89 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 I 7.39 4.59 1.60 0.00 0.00 -0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.42 0.68 0.00 0.00 51 E 9.09 4.12 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.43 0.00 52 N 7.61 4.97 0.00 3.18 3.01 0.00 0.00 6.01 7.68 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 53 V 8.78 3.88 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 0.38 0.00 0.00 0.95 0.00 0.00 54 Y 7.65 4.41 0.00 3.24 3.03 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 55 E 8.12 4.44 0.00 2.06 1.89 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 2.34 2.34 0.00 56 F 7.65 4.09 0.00 3.17 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 57 T 8.25 4.70 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 58 D 8.52 4.34 0.00 2.72 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 59 E 8.17 3.94 0.00 2.09 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 2.39 2.44 0.00 60 L 7.66 4.09 0.00 1.65 1.82 0.97 0.78 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 61 A 8.44 4.05 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 62 K 8.31 4.01 0.00 1.77 2.07 0.00 1.82 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.51 7.81 63 Q 8.11 4.40 0.00 2.18 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.52 0.00 0.00 0.00 0.00 0.00 2.64 2.37 0.00 64 Y 7.79 4.65 0.00 3.36 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 65 F 8.37 4.04 0.00 3.07 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 66 H 8.42 3.85 0.00 3.31 3.53 0.00 5.51 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 67 A 7.00 3.17 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 0.00 0.00 0.00 0.00 0.00 0.00 68 V 7.08 3.19 1.56 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 0.97 0.00 0.00 0.70 0.00 0.00 69 P 0.00 4.07 0.00 1.95 1.87 0.00 3.26 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 70 K 7.24 3.88 0.00 1.58 1.72 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.39 1.43 7.81 71 I 7.80 3.63 1.64 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 1.19 0.21 0.83 0.00 0.00 72 A 8.13 3.92 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 73 R 7.97 3.83 0.00 1.97 1.95 0.00 3.09 0.00 0.00 3.12 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.73 0.00 74 A 7.89 3.96 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 75 I 8.06 3.94 2.04 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 1.59 0.83 1.06 0.00 0.00 76 R 8.05 3.86 0.00 1.98 2.04 0.00 3.07 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 77 D 8.11 4.38 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 78 E 8.04 3.85 0.00 1.78 1.66 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 1.67 1.47 0.00 79 F 7.89 4.80 0.00 3.35 3.34 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 80 E 8.32 3.87 0.00 2.14 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 2.29 2.25 0.00 81 P 0.00 4.46 0.00 2.07 1.48 0.00 3.92 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.86 0.00 82 I 7.69 4.17 1.85 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 1.34 0.60 0.93 0.00 0.00 83 G 7.05 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 84 L 7.90 4.81 0.00 1.51 1.41 0.86 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 85 N 8.92 5.29 0.00 2.47 2.55 0.00 0.00 6.32 7.29 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 86 T 8.27 5.06 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 1.18 0.00 0.00 87 L 8.91 4.75 0.00 1.49 1.24 0.96 0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 88 N 8.86 5.13 0.00 2.67 2.64 0.00 0.00 6.95 7.79 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 89 N 8.62 4.91 0.00 2.64 2.80 0.00 0.00 6.84 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 N 8.93 4.97 0.00 2.66 2.75 0.00 0.00 7.36 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 91 G 9.39 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 0.00 0.00 0.00 0.00 92 E 9.22 4.25 0.00 2.29 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 2.46 2.44 0.00 93 K 8.16 4.18 0.00 1.84 1.89 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.42 7.81 94 A 7.98 4.46 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 95 G 7.85 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 0.00 0.00 0.00 96 Q 8.06 3.89 0.00 1.97 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.69 0.00 0.00 0.00 0.00 0.00 1.16 1.86 0.00 97 S 8.44 4.30 0.00 3.99 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 98 V 7.11 4.08 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.27 0.00 0.00 0.63 0.00 0.00 99 F 8.50 4.30 0.00 3.12 3.03 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 0.00 100 H 7.44 4.84 0.00 3.08 3.02 0.00 5.79 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Y 8.65 4.19 0.00 2.83 2.73 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 0.00 102 H 7.62 5.03 0.00 3.10 3.34 0.00 5.53 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 M 8.98 4.53 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.62 0.00 104 H 9.31 4.81 0.00 3.11 3.08 0.00 5.83 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 105 I 9.07 4.56 1.80 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.93 0.84 0.00 0.00 106 I 8.52 4.65 1.55 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.49 0.80 0.00 0.00 107 P 0.00 4.50 0.00 1.62 1.93 0.00 3.65 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.95 0.00 108 R 8.31 4.67 0.00 1.59 1.89 0.00 3.27 0.00 0.00 3.48 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.73 0.00 109 Y 9.73 4.68 0.00 2.90 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 0.00 110 G 8.69 4.04 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 0.00 0.00 0.00 111 K 8.69 3.90 0.00 1.77 1.81 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.47 7.81 112 G 9.15 4.06 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 0.00 0.00 0.00 113 D 8.43 4.43 0.00 2.77 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 G 8.84 3.68 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 0.00 0.00 0.00 115 F 7.26 4.89 0.00 2.86 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 0.00 116 G 6.66 3.51 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 0.00 0.00 0.00 117 A 7.92 4.47 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 0.00 118 V 8.37 3.89 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.93 0.00 0.00 119 W 8.84 4.59 0.00 3.27 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 0.00 120 K 8.03 4.38 0.00 1.64 1.58 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.39 7.81 121 T 8.11 4.07 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 122 H 8.25 4.99 0.00 3.25 3.31 0.00 5.62 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.26 4.11 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 0.00 124 D 8.09 4.71 0.00 2.71 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 D 7.95 4.61 0.00 2.84 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 0.00 0.00 0.00 0.00 126 Y 7.71 4.75 0.00 2.79 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 0.00 127 K 8.47 4.63 0.00 1.80 1.73 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.40 1.50 7.81 128 P 0.00 4.31 0.00 2.27 2.34 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.09 0.00 129 E 8.15 4.04 0.00 2.05 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 2.41 2.41 0.00 130 D 8.16 4.44 0.00 3.06 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 0.00 131 L 7.94 4.05 0.00 1.82 1.69 0.90 1.01 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 0.00 132 Q 7.77 3.99 0.00 2.39 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.82 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 133 N 8.24 4.35 0.00 2.91 2.88 0.00 0.00 7.06 7.09 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 0.00 134 I 8.18 3.74 1.87 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 1.64 1.46 0.91 0.00 0.00 135 S 8.32 4.07 0.00 4.03 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 S 8.30 4.06 0.00 3.92 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 0.00 137 S 7.96 4.14 0.00 4.05 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 0.00 138 I 7.59 3.85 2.02 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 0.87 0.92 0.00 0.00 139 A 8.36 4.03 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 0.00 140 K 7.73 4.05 0.00 1.98 1.89 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.71 7.81 141 R 7.82 4.16 0.00 1.83 1.98 0.00 3.12 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 142 L 7.36 4.52 0.00 1.83 1.69 0.93 0.73 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 0.00 143 A 8.19 4.11 1.17 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 0.00 0.00 0.00 0.00 0.00 0.00