NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.6158 8.4244 119.1686 52.4075 40.5892 173.8876 4 Q 4.5279 8.1073 117.7895 54.7596 31.4524 173.0998 5 Y 5.0724 9.7722 122.4291 56.4467 42.6779 173.2326 6 Y 5.3375 9.5289 120.9714 56.0682 43.0129 174.2565 7 G 3.8046 8.0894 112.3174 45.8428 0.0000 171.9161 8 T 3.8059 7.9231 116.2130 60.5452 68.0464 172.5858 9 G 4.1537 10.5854 113.1675 44.9787 0.0000 172.9509 10 R 5.2766 8.4795 116.9170 56.7217 31.8144 174.1765 11 R 4.4274 8.3177 114.2371 56.4066 32.2704 174.6671 12 K 4.0417 9.2172 118.6323 58.2655 29.2115 175.1436 13 S 3.6400 7.9970 104.4859 59.3789 62.0784 172.4467 14 S 5.3792 7.9012 115.8116 56.8336 63.7763 172.1521 15 A 4.5542 8.6004 129.7169 51.1976 19.6104 175.9206 16 A 5.0337 8.6321 123.8065 50.1026 22.8733 175.7206 17 R 4.4839 8.4267 117.7417 54.5177 33.9393 174.7482 18 V 4.5055 8.4878 124.2782 61.1762 34.7901 174.5384 19 F 6.2398 8.3248 122.9978 54.2179 40.7155 172.4739 20 I 4.1385 8.3344 122.8899 61.3863 38.3869 174.6439 21 K 5.0189 8.7705 128.4232 53.6643 35.7685 173.5916 22 P 4.4714 0.0000 0.0000 61.9400 32.3942 174.3717 23 G 3.5303 9.2069 114.1181 45.6800 0.0000 175.1393 24 N 3.7536 9.1147 123.1221 52.5575 39.4397 175.7820 25 G 4.9705 8.5191 98.6815 44.7866 0.0000 174.7565 26 K 4.4104 7.8867 118.9747 56.4933 34.4096 178.0108 27 I 4.4129 8.1907 122.8888 60.5015 40.7229 174.0845 28 V 4.5564 8.3269 128.2288 61.1565 33.7207 174.1301 29 I 4.4067 8.4950 129.8322 60.3642 38.9150 176.2221 30 N 3.7908 8.7951 123.9755 54.5906 36.4908 174.2543 31 Q 3.6760 8.0903 111.6019 56.8796 28.1471 172.2168 32 R 4.7112 8.0317 114.0343 53.3894 34.4235 174.6991 33 S 4.4246 8.2688 113.3922 57.8872 63.2608 174.4947 34 L 3.8785 8.3673 127.4665 58.6593 41.6923 179.4098 35 E 4.2664 8.1111 117.4622 58.6264 29.2825 178.1721 36 Q 4.3855 7.6483 115.8709 56.4049 28.6316 175.3677 37 Y 4.4924 7.6550 119.5406 58.7926 41.1568 175.9175 38 F 5.5846 7.9362 114.9129 55.7776 40.2775 175.0662 39 G 3.8396 8.4334 111.0533 47.1984 0.0000 173.5975 40 R 3.8915 8.8107 122.0776 57.0472 28.7580 175.2954 41 E 4.7583 7.8168 112.9321 54.0511 33.1545 176.8456 42 T 4.0661 8.5623 112.6205 63.2982 67.3826 174.6553 43 A 4.0689 8.2399 125.1529 54.4179 19.3306 180.4013 44 R 4.4940 8.0768 106.8800 57.6132 29.6149 176.9105 45 M 4.2961 8.3101 117.9429 57.8030 32.4915 178.8087 46 V 3.8322 7.6768 112.4725 63.3311 31.9889 178.6484 47 V 3.6310 7.9167 111.7236 64.5070 30.8979 177.5509 48 R 4.1648 7.8777 117.1170 57.7862 30.3668 178.4458 49 Q 4.0829 7.9852 118.4966 58.7809 28.4760 177.8255 50 P 4.1281 0.0000 0.0000 65.4046 31.5046 178.2114 51 L 4.1278 7.5653 118.4889 57.7306 41.7447 178.8463 52 E 4.2128 9.3225 116.7628 58.6372 29.5570 178.0119 53 L 4.3981 7.5733 119.0138 56.4735 42.6444 177.0507 54 V 4.4809 7.7206 112.7601 60.5044 32.6971 171.5187 55 D 4.5816 8.8138 125.2103 54.2585 41.0708 173.6133 56 M 4.4203 8.3686 119.8406 56.2087 34.8008 173.8071 57 V 3.7677 8.7654 121.4854 63.7208 31.4941 173.0590 58 E 4.7826 7.8863 114.4478 55.9795 30.0092 175.7327 59 K 4.5377 7.9097 117.6618 57.1710 34.4876 176.2611 60 L 4.9904 7.3058 116.8932 55.9975 43.4561 171.7321 61 D 5.6435 9.0087 118.2820 50.5247 42.0469 174.9803 62 L 5.8147 8.5396 120.4487 52.5908 45.5159 174.7556 63 Y 5.0426 8.6301 121.9817 56.3950 40.4016 174.3144 64 I 4.2673 8.3171 128.5617 61.0426 39.3388 175.9814 65 T 4.8634 8.9914 122.8909 61.8750 70.4549 172.8238 66 V 4.9030 7.5548 124.3318 59.9383 34.5628 175.2292 67 K 4.3566 9.7340 119.8852 57.3222 36.4519 171.3846 68 G 4.3031 8.9389 116.6721 46.2689 0.0000 171.3246 69 G 4.3138 9.0777 107.6422 43.8308 0.0000 174.1252 70 G 4.0272 8.4460 112.8790 43.7514 0.0000 171.2938 71 I 3.7098 7.9139 118.2062 64.8244 36.7852 177.9869 72 S 4.1034 7.9710 115.4131 61.4864 62.9220 177.0691 73 G 3.5286 7.8751 108.8060 48.0433 0.0000 175.0395 74 Q 4.1196 9.5382 123.2550 57.8442 28.8322 178.8007 75 A 4.2501 8.3066 121.1759 55.7505 18.1598 179.7668 76 G 3.5885 8.0248 102.2730 47.8514 0.0000 175.1288 77 A 4.1431 8.4255 123.5691 55.0367 18.3672 179.4385 78 I 3.5730 8.1247 118.3745 64.8652 37.3784 178.3640 79 R 3.7678 7.9529 119.1024 59.7734 29.5830 178.0042 80 H 4.2113 8.3649 117.9884 59.1700 30.0054 177.2133 81 G 3.7579 7.9489 108.3384 47.7859 0.0000 174.5562 82 I 3.5586 8.0089 122.4474 64.3373 36.8020 177.9317 83 T 3.7575 7.8737 115.7298 65.7091 67.4870 176.3783 84 R 3.9320 8.1428 120.0202 59.1470 30.0720 178.6746 85 A 4.2089 8.4725 120.7406 55.2636 18.3302 179.3450 86 L 3.8358 8.1155 117.7781 58.4996 41.3785 179.3229 87 M 4.2604 7.9647 119.0983 57.9736 31.7923 178.2553 88 E 4.1014 8.1461 118.2638 59.7360 29.8631 178.5099 89 Y 4.1242 7.4617 117.3554 59.3844 38.8372 175.0204 90 D 4.0349 7.7404 117.4847 53.4816 42.6394 174.9812 91 E 4.3511 8.5946 126.1099 56.7968 29.9614 177.5345 92 S 4.4116 8.4324 115.2540 61.6715 63.6282 176.2938 93 L 4.1014 7.8061 119.9231 57.7737 39.8697 179.0479 94 R 3.8798 7.7108 119.9165 59.8021 30.1210 178.4347 95 S 4.0469 8.0885 112.1288 61.7492 62.0992 176.2408 96 E 3.9375 7.9882 119.3023 59.2354 29.8459 178.4858 97 L 4.3412 7.8625 119.0428 58.0621 41.7745 179.6970 98 R 3.8654 8.5756 118.7203 59.2847 29.8391 178.3078 99 K 4.0608 7.7113 117.9682 58.6418 31.9904 177.4070 100 A 4.3014 6.9700 118.6863 50.3575 20.5999 176.9334 101 G 3.7720 7.9355 107.3629 48.1871 0.0000 172.8213 102 F 5.1303 7.5227 118.1714 59.5627 41.9556 178.5592 103 V 3.4966 8.2381 112.2297 64.6158 31.4855 177.2038 104 T 4.0808 7.2583 108.0739 61.4900 69.1049 173.3626 105 R 4.3046 8.1053 121.7830 54.2013 32.0595 175.1592 106 D 4.4536 8.5505 125.2121 54.6284 39.1130 176.7416 107 A 4.2130 8.2610 125.3297 53.0941 18.7056 178.1674 108 R 4.0384 7.4032 116.6588 56.2038 30.5118 176.0973 109 Q 4.5206 8.3132 122.3095 54.0199 32.1988 174.0038 110 V 3.5612 8.3975 123.0802 63.6928 31.8897 175.1533 111 E 4.4396 8.5155 125.9959 54.8050 30.5666 176.5484 112 R 3.8931 8.3856 119.9857 55.7434 30.0004 176.2579 113 K 4.0703 8.4936 122.1668 56.2762 30.7893 176.7059 114 K 4.2304 8.4010 126.5060 55.9823 32.7837 177.2611 115 V 3.9056 7.9896 120.7891 62.7288 32.4396 174.8653 116 G 4.3135 8.9847 112.8822 46.0469 0.0000 174.2910 117 L 4.3476 6.6589 115.7803 53.8401 42.9893 175.9519 118 R 4.4970 8.1210 117.2200 56.9362 32.4104 176.6326 119 K 4.3214 7.9969 114.6367 56.1768 33.2087 176.3297 120 A 4.0789 8.3762 121.0676 53.6099 18.5234 178.3405 121 R 4.5607 8.3890 110.9475 57.4907 37.2541 174.7093 122 R 3.7689 8.1125 119.5607 56.8006 29.7019 175.1200 123 R 4.6089 8.3554 125.5078 53.7734 30.7612 175.0771 124 P 4.3304 0.0000 0.0000 62.4292 31.6904 176.2399 125 Q 4.2049 8.7256 120.5026 56.7074 28.7963 176.3156 126 F 4.5861 9.1073 114.6211 55.8870 39.0579 176.5365 127 S 2.9826 7.1320 113.3070 58.5319 63.5567 171.6357 128 K 3.6143 7.7952 125.4702 56.1500 32.6196 176.8059 129 R 4.6003 8.3883 125.5590 56.5263 30.1610 175.3871 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 3 N 8.42 4.62 0.00 2.62 2.56 0.00 0.00 6.89 6.19 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 4 Q 8.11 4.53 0.00 2.10 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.66 0.00 0.00 0.00 0.00 0.00 2.36 2.48 0.00 5 Y 9.77 5.07 0.00 3.07 3.21 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 6 Y 9.53 5.34 0.00 3.33 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 7 G 8.09 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 0.00 0.00 0.00 8 T 7.92 3.81 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 1.36 0.00 0.00 9 G 10.59 4.15 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 0.00 0.00 0.00 10 R 8.48 5.28 0.00 1.97 1.84 0.00 2.70 0.00 0.00 3.95 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.51 0.00 11 R 8.32 4.43 0.00 1.94 1.97 0.00 3.09 0.00 0.00 3.32 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.62 0.00 12 K 9.22 4.04 0.00 1.91 1.90 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.34 1.39 7.81 13 S 8.00 3.64 0.00 4.12 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 14 S 7.90 5.38 0.00 3.93 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 15 A 8.60 4.55 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 16 A 8.63 5.03 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 17 R 8.43 4.48 0.00 1.66 1.84 0.00 3.14 0.00 0.00 3.11 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.74 0.00 18 V 8.49 4.51 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 0.91 0.00 0.00 0.75 0.00 0.00 19 F 8.32 6.24 0.00 3.45 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 20 I 8.33 4.14 2.01 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 1.17 0.72 0.77 0.00 0.00 21 K 8.77 5.02 0.00 1.80 1.90 0.00 1.60 0.00 0.00 1.67 0.00 0.00 2.84 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.32 1.37 7.81 22 P 0.00 4.47 0.00 2.10 1.97 0.00 3.89 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.00 0.00 23 G 9.21 3.53 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 0.00 0.00 0.00 24 N 9.11 3.75 0.00 2.96 2.81 0.00 0.00 5.94 6.92 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 25 G 8.52 4.97 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 26 K 7.89 4.41 0.00 1.74 1.76 0.00 1.65 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.53 1.48 7.81 27 I 8.19 4.41 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 1.24 1.04 0.91 0.00 0.00 28 V 8.33 4.56 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 0.97 0.00 0.00 29 I 8.49 4.41 1.37 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.39 0.38 0.00 0.00 30 N 8.80 3.79 0.00 2.14 2.57 0.00 0.00 6.95 7.25 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 31 Q 8.09 3.68 0.00 2.21 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.81 0.00 0.00 0.00 0.00 0.00 2.27 2.45 0.00 32 R 8.03 4.71 0.00 1.77 1.70 0.00 3.22 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 33 S 8.27 4.42 0.00 3.85 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 34 L 8.37 3.88 0.00 1.90 1.68 1.03 1.06 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 35 E 8.11 4.27 0.00 2.09 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 36 Q 7.65 4.39 0.00 2.23 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.73 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 37 Y 7.66 4.49 0.00 2.63 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 0.00 0.00 0.00 0.00 38 F 7.94 5.58 0.00 3.24 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 39 G 8.43 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 40 R 8.81 3.89 0.00 1.95 2.00 0.00 3.20 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.64 0.00 41 E 7.82 4.76 0.00 2.20 1.75 0.00 0.00 0.00 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 2.44 0.00 42 T 8.56 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 1.15 0.00 0.00 43 A 8.24 4.07 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 R 8.08 4.49 0.00 2.06 2.38 0.00 3.10 0.00 0.00 3.62 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.68 0.00 45 M 8.31 4.30 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.71 0.00 46 V 7.68 3.83 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 0.97 0.00 0.00 0.99 0.00 0.00 47 V 7.92 3.63 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 0.88 0.00 0.00 1.02 0.00 0.00 48 R 7.88 4.16 0.00 2.02 2.11 0.00 3.23 0.00 0.00 3.32 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.69 0.00 49 Q 7.99 4.08 0.00 2.14 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.79 0.00 0.00 0.00 0.00 0.00 2.41 2.54 0.00 50 P 0.00 4.13 0.00 2.09 1.86 0.00 3.58 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.89 0.00 51 L 7.57 4.13 0.00 1.86 1.73 0.95 0.95 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 52 E 9.32 4.21 0.00 1.98 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 2.55 2.41 0.00 53 L 7.57 4.40 0.00 1.91 1.96 1.02 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 54 V 7.72 4.48 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 0.78 0.00 0.00 1.03 0.00 0.00 55 D 8.81 4.58 0.00 2.86 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 56 M 8.37 4.42 0.00 1.91 1.93 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.56 0.00 57 V 8.77 3.77 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 0.84 0.00 0.00 0.94 0.00 0.00 58 E 7.89 4.78 0.00 2.06 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 2.27 2.24 0.00 59 K 7.91 4.54 0.00 1.80 1.82 0.00 2.00 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.46 0.00 0.00 0.00 0.00 1.37 1.33 7.81 60 L 7.31 4.99 0.00 1.85 1.63 0.76 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 61 D 9.01 5.64 0.00 2.69 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 L 8.54 5.81 0.00 1.61 1.70 0.94 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 63 Y 8.63 5.04 0.00 3.11 3.33 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 64 I 8.32 4.27 1.75 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.29 0.77 0.00 0.00 65 T 8.99 4.86 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 1.13 0.00 0.00 66 V 7.55 4.90 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 0.74 0.00 0.00 1.02 0.00 0.00 67 K 9.73 4.36 0.00 1.82 1.90 0.00 1.29 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.39 7.81 68 G 8.94 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 0.00 0.00 0.00 0.00 69 G 9.08 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 G 8.45 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 71 I 7.91 3.71 1.80 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.73 0.74 0.00 0.00 72 S 7.97 4.10 0.00 3.97 4.05 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 73 G 7.88 3.53 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 0.00 0.00 0.00 74 Q 9.54 4.12 0.00 2.60 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.63 0.00 0.00 0.00 0.00 0.00 2.84 2.51 0.00 75 A 8.31 4.25 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.02 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 A 8.43 4.14 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 78 I 8.12 3.57 2.07 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 1.40 0.98 0.89 0.00 0.00 79 R 7.95 3.77 0.00 1.95 2.00 0.00 2.79 0.00 0.00 2.96 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.72 0.00 80 H 8.36 4.21 0.00 3.22 3.41 0.00 5.86 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 81 G 7.95 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 82 I 8.01 3.56 1.92 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 1.34 0.77 0.84 0.00 0.00 83 T 7.87 3.76 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 1.28 0.00 0.00 84 R 8.14 3.93 0.00 1.86 1.82 0.00 3.26 0.00 0.00 3.01 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.44 0.00 85 A 8.47 4.21 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 86 L 8.12 3.84 0.00 1.90 1.76 0.93 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 87 M 7.96 4.26 0.00 2.21 2.07 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 88 E 8.15 4.10 0.00 2.32 2.40 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 2.48 2.49 0.00 89 Y 7.46 4.12 0.00 1.43 2.72 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 90 D 7.74 4.03 0.00 2.15 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 0.00 0.00 0.00 91 E 8.59 4.35 0.00 1.95 1.93 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 2.43 2.24 0.00 92 S 8.43 4.41 0.00 4.12 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 93 L 7.81 4.10 0.00 1.93 1.93 0.97 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 94 R 7.71 3.88 0.00 1.83 2.04 0.00 3.35 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 95 S 8.09 4.05 0.00 3.87 3.88 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 96 E 7.99 3.94 0.00 2.12 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.34 0.00 97 L 7.86 4.34 0.00 1.90 2.01 0.99 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 98 R 8.58 3.87 0.00 1.83 2.00 0.00 3.11 0.00 0.00 3.08 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 99 K 7.71 4.06 0.00 1.84 1.92 0.00 1.79 0.00 0.00 1.75 0.00 0.00 2.98 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.41 7.81 100 A 6.97 4.30 0.46 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 0.00 0.00 0.00 0.00 0.00 0.00 101 G 7.94 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 0.00 102 F 7.52 5.13 0.00 3.10 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 0.00 103 V 8.24 3.50 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 0.79 0.00 0.00 0.96 0.00 0.00 104 T 7.26 4.08 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 1.22 0.00 0.00 105 R 8.11 4.30 0.00 1.73 1.80 0.00 3.38 0.00 0.00 3.18 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.52 0.00 106 D 8.55 4.45 0.00 2.75 2.61 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 0.00 107 A 8.26 4.21 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 0.00 108 R 7.40 4.04 0.00 1.75 1.89 0.00 3.16 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.56 0.00 109 Q 8.31 4.52 0.00 1.95 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.81 0.00 0.00 0.00 0.00 0.00 2.24 2.29 0.00 110 V 8.40 3.56 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 0.85 0.00 0.00 0.93 0.00 0.00 111 E 8.52 4.44 0.00 1.99 1.86 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 2.27 2.28 0.00 112 R 8.39 3.89 0.00 1.91 1.94 0.00 3.04 0.00 0.00 3.15 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 113 K 8.49 4.07 0.00 1.74 1.80 0.00 1.78 0.00 0.00 1.71 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.46 7.81 114 K 8.40 4.23 0.00 1.86 1.71 0.00 1.87 0.00 0.00 1.87 0.00 0.00 2.94 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.53 1.57 7.81 115 V 7.99 3.91 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 0.70 0.00 0.00 0.93 0.00 0.00 116 G 8.98 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 6.66 4.35 0.00 1.62 1.84 0.93 0.82 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 0.00 118 R 8.12 4.50 0.00 1.71 1.98 0.00 3.30 0.00 0.00 3.15 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 119 K 8.00 4.32 0.00 1.77 1.62 0.00 1.90 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.37 7.81 120 A 8.38 4.08 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 0.00 121 R 8.39 4.56 0.00 1.73 1.91 0.00 3.35 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.71 0.00 122 R 8.11 3.77 0.00 1.88 1.87 0.00 3.22 0.00 0.00 3.34 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.75 0.00 123 R 8.36 4.61 0.00 1.85 1.88 0.00 3.43 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 124 P 0.00 4.33 0.00 2.20 2.09 0.00 3.80 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.98 0.00 125 Q 8.73 4.20 0.00 2.19 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.94 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 126 F 9.11 4.59 0.00 3.19 3.16 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 0.00 127 S 7.13 2.98 0.00 3.91 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 0.00 128 K 7.80 3.61 0.00 1.63 1.77 0.00 1.61 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.51 7.81 129 R 8.39 4.60 0.00 2.14 1.84 0.00 3.41 0.00 0.00 3.42 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00