NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 11 K 4.1793 8.3144 120.1093 55.8561 33.2444 177.0362 12 R 3.8319 8.9706 120.9647 57.0282 31.3016 173.4787 13 Q 4.4804 9.1436 122.0621 54.5865 32.9547 174.3155 14 V 4.3885 8.4183 116.2120 59.5812 33.9094 175.9195 15 A 5.2407 8.4510 124.5403 52.8126 19.7119 176.6831 16 S 5.0924 7.5914 109.2338 56.7155 65.3092 174.4082 17 G 4.1626 7.8187 110.0062 46.7913 0.0000 172.0804 18 R 5.2663 7.9625 119.0320 54.5196 35.5239 174.4651 19 A 4.9602 8.6312 121.3106 50.7991 22.4177 174.6199 20 Y 4.9654 9.2836 121.2263 56.5358 40.6553 174.8873 21 I 4.6920 8.8011 124.9773 59.8834 39.4949 174.0929 22 H 5.2367 9.6389 127.9757 54.5572 31.8097 172.5850 23 A 4.9024 8.8688 129.7254 50.3019 20.3962 174.8788 24 S 4.9578 8.9419 117.3407 59.0679 64.8443 176.7326 25 Y 3.8593 8.2760 122.4838 60.3937 38.3033 176.4553 26 N 4.6222 8.1254 115.7424 54.8616 39.8792 173.4254 27 N 5.1087 9.1339 116.1159 52.8066 42.7321 172.4594 28 T 5.2098 8.2670 116.0866 61.8910 72.9927 173.1255 29 I 5.0818 9.9874 126.0212 59.5198 41.7296 173.9192 30 V 5.0648 8.9663 122.6569 59.9766 34.6639 174.6094 31 T 4.9672 9.1725 119.4957 60.4273 70.5352 172.4576 32 I 4.7074 8.9008 130.9112 61.0247 38.7406 175.2072 33 T 4.8749 8.6821 121.3056 60.7089 72.2067 171.9140 34 D 5.2805 7.5584 120.1278 51.5711 41.9148 173.8137 35 P 4.4729 0.0000 0.0000 65.0157 31.4893 176.1976 36 D 4.9235 8.7996 119.8891 53.8861 41.7038 178.9273 37 G 4.0794 8.7125 108.3316 46.6664 0.0000 173.9507 38 N 4.2910 8.3826 117.4941 52.8000 38.2592 172.5447 39 P 4.2650 0.0000 0.0000 63.5727 32.0073 175.8994 40 I 4.2831 8.3268 123.2798 62.9113 38.7821 175.8356 41 T 4.3943 7.3537 113.0505 61.2925 70.4550 171.5838 42 W 5.7596 7.9009 121.9145 55.5960 31.8807 173.2292 43 S 4.4839 9.2947 112.6400 58.3766 66.2544 174.3280 44 S 5.1494 8.2317 117.2391 56.0894 65.3641 174.9379 45 G 3.8764 8.8522 106.5681 48.2239 0.0000 176.0657 46 G 4.1013 7.8542 107.5971 46.5285 0.0000 176.0331 47 V 3.5980 7.7804 119.2480 65.9978 31.7328 177.4076 48 I 3.7200 7.3612 118.1954 64.4983 37.0303 175.7345 49 G 3.3569 7.0537 107.6679 45.3281 0.0000 173.2952 50 Y 4.7539 7.6987 119.8439 57.2755 38.4189 174.3691 51 K 4.8950 8.9632 125.6694 54.7681 35.7767 173.3976 52 G 4.1577 8.5072 111.8397 44.8404 0.0000 176.1965 53 S 4.4210 8.8762 117.6270 60.0888 63.8210 175.9326 54 R 4.5388 7.6864 121.0692 56.3846 28.9060 177.2483 55 K 4.4956 7.9748 117.6682 57.3203 34.9278 178.5835 56 G 3.6452 7.8555 104.9133 46.4395 0.0000 174.4454 57 T 4.0169 7.3006 115.0683 61.1087 69.3179 172.8995 58 P 4.5004 0.0000 0.0000 65.8343 31.3907 178.1027 59 Y 4.3473 8.1473 118.9326 60.1475 38.6163 177.7563 60 A 3.9759 8.1005 121.0119 55.2620 18.5576 179.3397 61 A 3.9707 7.8675 117.5430 55.3858 18.6810 178.7379 62 Q 4.0581 8.1769 119.2571 58.1062 29.1307 177.4867 63 L 3.7979 8.2653 119.5350 58.0505 41.9152 179.8633 64 A 3.9077 8.2918 120.3608 55.1973 18.3189 179.6002 65 A 4.0291 7.9429 118.9219 55.1452 18.0634 179.4921 66 L 3.9769 7.6970 117.6114 57.4956 41.9585 178.2871 67 D 4.3213 8.3249 117.5378 57.7425 41.1552 179.0069 68 A 3.8676 8.0112 120.6351 54.9108 18.2774 179.4027 69 A 3.9168 7.4479 117.9644 55.3789 18.3478 179.3457 70 K 3.9268 9.6476 118.1982 59.3466 32.3476 178.9128 71 K 4.0076 8.4259 118.4415 59.7122 32.2228 178.4857 72 A 4.1334 7.8937 119.1234 53.9396 18.0850 179.4197 73 M 3.9885 9.2385 118.7985 58.0504 31.9420 178.1442 74 A 4.0832 7.4034 119.4164 55.7582 18.4744 178.4815 75 Y 4.1136 8.2920 110.0998 59.3908 38.2579 176.5838 76 G 3.8934 9.1018 109.7752 45.9680 0.0000 172.9601 77 M 4.5466 8.3133 119.3952 55.3630 33.1370 175.0601 78 Q 4.5700 9.1801 122.7309 56.9653 33.0691 175.0309 79 S 4.9989 8.0604 112.7602 56.7338 65.7844 173.4829 80 V 5.3177 8.2901 114.8026 59.0812 36.5924 173.3875 81 D 5.0119 8.2791 119.2893 53.2090 44.8948 175.0225 82 V 4.3478 8.6450 124.3598 62.0581 33.3260 174.7594 83 I 4.9033 8.5032 128.4904 59.6789 39.8282 174.5872 84 V 4.5809 8.6126 121.6650 60.2711 33.5232 175.8304 85 R 4.6354 9.8275 124.1904 55.1168 33.6048 174.1650 86 G 4.0445 8.2516 111.9927 45.8189 0.0000 172.4243 87 T 4.3478 7.6342 114.4785 61.7225 73.2355 173.4067 88 G 3.9881 8.2909 117.9637 44.9632 0.0000 173.1234 89 A 3.9755 7.8870 123.3479 53.9094 18.7129 178.9781 90 G 4.1942 7.6825 102.5524 44.3488 0.0000 174.8888 91 R 3.8859 8.6886 121.4951 59.6470 29.9882 177.6180 92 E 4.0131 8.2049 118.8616 58.7288 29.3839 178.2147 93 Q 3.9384 8.0772 117.0416 59.4136 28.9697 179.0916 94 A 3.9870 8.0569 121.1229 55.6729 18.4428 179.2872 95 I 3.6112 7.5129 115.5336 65.1044 37.3759 178.3280 96 R 4.2809 8.4340 119.1616 58.7289 29.7575 178.7637 97 A 3.9869 9.0727 121.0001 55.4333 18.5602 179.4143 98 L 4.0644 7.7290 115.7384 58.5359 42.0248 179.0988 99 Q 3.9769 7.9971 116.8343 59.2079 29.7393 177.9874 100 A 4.6255 8.1917 123.5243 50.2890 16.4238 179.1801 101 S 4.8140 8.0139 112.3447 58.7915 64.0220 178.7026 102 G 3.8727 8.4793 123.3246 46.2406 0.0000 172.0350 103 L 4.6449 7.3856 122.2554 53.2298 45.5703 174.2305 104 Q 4.0957 9.0682 128.3175 55.7036 30.0639 176.2690 105 V 4.3606 7.8346 121.0559 60.4231 29.1879 175.5240 106 K 4.3041 8.0102 123.0226 58.2518 32.4267 177.9822 107 S 4.6521 7.8464 112.9858 57.0511 66.6318 172.4447 108 I 4.7974 8.3872 122.8755 59.9020 38.9724 174.7943 109 V 4.3313 8.8523 128.1821 61.0076 34.0966 174.0625 110 D 5.0138 8.6667 127.1192 52.6423 41.7399 175.7802 111 D 5.0253 8.5766 127.6699 52.9398 40.0276 174.8456 112 T 4.5847 7.7176 116.4398 61.2229 70.4728 174.2640 113 P 4.1526 0.0000 0.0000 63.0107 31.4149 176.1006 114 V 4.2747 8.1584 123.5699 58.6042 32.0673 173.5358 115 P 4.4002 0.0000 0.0000 63.0921 31.8469 175.6798 116 H 4.7242 8.4571 116.8441 56.6573 29.1067 173.5912 117 N 4.1867 8.3682 119.6983 53.3650 34.4028 172.9302 118 G 3.9496 8.1262 106.2476 46.3534 0.0000 170.0776 119 C 4.5929 7.6806 117.6085 56.8979 29.8278 173.9984 120 R 3.9600 8.3652 124.5100 55.9035 30.2639 174.4976 121 P 4.5365 0.0000 0.0000 60.9484 33.1716 175.1997 122 K 4.1897 7.7917 118.8363 56.0587 32.8652 178.1782 123 K 4.0917 8.4308 119.8173 59.2000 32.3536 178.6572 124 K 4.0066 8.2428 119.1460 58.9916 32.1608 176.9362 125 F 4.7015 8.0120 113.9678 57.4606 38.9997 176.2924 126 R 4.5316 7.8331 119.0627 55.8736 30.8523 177.5233 127 K 4.0340 8.1156 117.5110 59.5150 32.1694 176.7601 128 A 4.2701 7.6378 121.9946 50.3499 16.9401 177.0060 129 S 4.2722 8.3780 114.7294 58.8188 62.2995 174.2762 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 11 K 8.31 4.18 0.00 1.74 1.64 0.00 1.73 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.41 7.81 12 R 8.97 3.83 0.00 1.86 1.87 0.00 3.21 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 13 Q 9.14 4.48 0.00 2.02 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.49 0.00 0.00 0.00 0.00 0.00 2.16 2.49 0.00 14 V 8.42 4.39 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 0.75 0.00 0.00 1.04 0.00 0.00 15 A 8.45 5.24 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 S 7.59 5.09 0.00 3.86 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 17 G 7.82 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 0.00 0.00 0.00 18 R 7.96 5.27 0.00 1.82 1.54 0.00 2.92 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.53 0.00 19 A 8.63 4.96 1.16 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 0.00 0.00 20 Y 9.28 4.97 0.00 3.11 2.90 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 21 I 8.80 4.69 1.92 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 1.13 0.57 0.95 0.00 0.00 22 H 9.64 5.24 0.00 3.21 3.36 0.00 5.74 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 23 A 8.87 4.90 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 24 S 8.94 4.96 0.00 3.93 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 25 Y 8.28 3.86 0.00 2.95 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 N 8.13 4.62 0.00 2.75 2.90 0.00 0.00 6.67 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 27 N 9.13 5.11 0.00 2.69 2.66 0.00 0.00 6.78 7.10 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 28 T 8.27 5.21 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 1.29 0.00 0.00 29 I 9.99 5.08 1.97 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.32 0.97 0.00 0.00 30 V 8.97 5.06 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 0.69 0.00 0.00 1.02 0.00 0.00 31 T 9.17 4.97 4.35 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 1.29 0.00 0.00 32 I 8.90 4.71 1.85 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 1.30 0.60 0.94 0.00 0.00 33 T 8.68 4.87 4.33 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 1.48 0.00 0.00 34 D 7.56 5.28 0.00 2.86 2.76 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 35 P 0.00 4.47 0.00 2.08 2.17 0.00 3.65 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.23 0.00 36 D 8.80 4.92 0.00 2.66 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 G 8.71 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 0.00 0.00 0.00 38 N 8.38 4.29 0.00 3.18 2.84 0.00 0.00 6.79 7.58 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 39 P 0.00 4.26 0.00 2.07 2.09 0.00 3.66 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 2.02 2.14 0.00 40 I 8.33 4.28 1.92 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 1.16 0.89 0.49 0.00 0.00 41 T 7.35 4.39 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 0.99 0.00 0.00 42 W 7.90 5.76 0.00 3.53 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 S 9.29 4.48 0.00 3.68 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 8.23 5.15 0.00 4.27 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 45 G 8.85 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 0.00 0.00 0.00 46 G 7.85 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 47 V 7.78 3.60 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 0.65 0.00 0.00 0.98 0.00 0.00 48 I 7.36 3.72 2.04 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.84 0.62 0.00 0.00 49 G 7.05 3.36 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 0.00 50 Y 7.70 4.75 0.00 3.25 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 K 8.96 4.89 0.00 1.73 1.71 0.00 1.79 0.00 0.00 1.75 0.00 0.00 3.04 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.34 1.44 7.81 52 G 8.51 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 0.00 0.00 0.00 53 S 8.88 4.42 0.00 4.01 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 R 7.69 4.54 0.00 1.57 1.40 0.00 2.88 0.00 0.00 3.13 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 55 K 7.97 4.50 0.00 2.00 2.19 0.00 1.89 0.00 0.00 1.97 0.00 0.00 3.11 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.64 1.63 7.81 56 G 7.86 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 57 T 7.30 4.02 4.17 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 1.13 0.00 0.00 58 P 0.00 4.50 0.00 2.35 2.48 0.00 3.92 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 2.12 1.89 0.00 59 Y 8.15 4.35 0.00 3.06 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 A 8.10 3.98 1.53 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 61 A 7.87 3.97 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 62 Q 8.18 4.06 0.00 2.34 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.62 0.00 0.00 0.00 0.00 0.00 2.37 2.43 0.00 63 L 8.27 3.80 0.00 1.47 1.52 0.28 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.29 3.91 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 65 A 7.94 4.03 1.43 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 0.00 0.00 66 L 7.70 3.98 0.00 1.83 1.65 nan 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.32 4.32 0.00 2.63 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 68 A 8.01 3.87 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 69 A 7.45 3.92 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 70 K 9.65 3.93 0.00 1.81 1.91 0.00 1.66 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.47 7.81 71 K 8.43 4.01 0.00 1.86 1.75 0.00 1.59 0.00 0.00 1.43 0.00 0.00 2.76 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.38 1.67 7.81 72 A 7.89 4.13 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 73 M 9.24 3.99 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.94 0.00 74 A 7.40 4.08 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 Y 8.29 4.11 0.00 2.84 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 76 G 9.10 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 0.00 0.00 0.00 77 M 8.31 4.55 0.00 1.89 2.05 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.54 0.00 78 Q 9.18 4.57 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.52 0.00 0.00 0.00 0.00 0.00 2.27 2.49 0.00 79 S 8.06 5.00 0.00 3.93 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 8.29 5.32 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 1.21 0.00 0.00 0.96 0.00 0.00 81 D 8.28 5.01 0.00 2.52 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 82 V 8.65 4.35 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 0.90 0.00 0.00 0.90 0.00 0.00 83 I 8.50 4.90 1.23 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.21 1.01 0.00 0.00 84 V 8.61 4.58 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 0.71 0.00 0.00 1.10 0.00 0.00 85 R 9.83 4.64 0.00 1.87 1.85 0.00 3.25 0.00 0.00 3.25 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.68 0.00 86 G 8.25 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 87 T 7.63 4.35 4.48 0.00 0.00 0.00 0.00 0.00 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 G 8.29 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 0.00 0.00 0.00 89 A 7.89 3.98 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 90 G 7.68 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 R 8.69 3.89 0.00 1.80 1.93 0.00 3.27 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.79 0.00 92 E 8.20 4.01 0.00 2.11 1.87 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 2.37 2.46 0.00 93 Q 8.08 3.94 0.00 2.12 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.60 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 94 A 8.06 3.99 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 I 7.51 3.61 1.96 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 1.52 1.34 0.91 0.00 0.00 96 R 8.43 4.28 0.00 2.02 1.97 0.00 3.36 0.00 0.00 3.28 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.76 0.00 97 A 9.07 3.99 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 98 L 7.73 4.06 0.00 1.82 1.74 0.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 99 Q 8.00 3.98 0.00 2.25 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.18 0.00 0.00 0.00 0.00 0.00 2.38 2.69 0.00 100 A 8.19 4.63 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 0.00 101 S 8.01 4.81 0.00 3.95 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 0.00 102 G 8.48 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 0.00 103 L 7.39 4.64 0.00 1.82 1.49 0.92 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 9.07 4.10 0.00 2.17 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 105 V 7.83 4.36 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 0.76 0.00 0.00 0.92 0.00 0.00 106 K 8.01 4.30 0.00 1.77 1.86 0.00 2.04 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.51 7.81 107 S 7.85 4.65 0.00 3.83 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 0.00 108 I 8.39 4.80 1.86 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.53 0.90 0.00 0.00 109 V 8.85 4.33 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 0.93 0.00 0.00 0.91 0.00 0.00 110 D 8.67 5.01 0.00 2.71 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 D 8.58 5.03 0.00 2.72 2.60 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 0.00 112 T 7.72 4.58 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 0.00 113 P 0.00 4.15 0.00 2.18 2.10 0.00 3.74 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 2.02 1.99 0.00 114 V 8.16 4.27 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.97 0.00 0.00 115 P 0.00 4.40 0.00 2.20 2.08 0.00 3.78 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 2.01 2.00 0.00 116 H 8.46 4.72 0.00 3.16 3.33 0.00 5.79 0.00 0.00 0.00 0.00 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 8.37 4.19 0.00 2.91 2.94 0.00 0.00 6.87 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 8.13 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 0.00 0.00 0.00 119 C 7.68 4.59 0.00 2.95 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 0.00 120 R 8.37 3.96 0.00 1.76 1.81 0.00 3.21 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 121 P 0.00 4.54 0.00 2.13 2.00 0.00 3.74 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.12 0.00 122 K 7.79 4.19 0.00 1.47 1.63 0.00 1.44 0.00 0.00 1.41 0.00 0.00 2.72 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.10 7.81 123 K 8.43 4.09 0.00 1.79 1.81 0.00 1.73 0.00 0.00 1.75 0.00 0.00 2.85 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.43 7.81 124 K 8.24 4.01 0.00 1.88 2.30 0.00 2.02 0.00 0.00 1.78 0.00 0.00 3.11 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.51 1.56 7.81 125 F 8.01 4.70 0.00 2.97 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 0.00 126 R 7.83 4.53 0.00 1.95 1.97 0.00 3.21 0.00 0.00 3.23 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 2.00 0.00 127 K 8.12 4.03 0.00 1.73 1.90 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.69 1.43 7.81 128 A 7.64 4.27 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 0.00 129 S 8.38 4.27 0.00 3.84 3.79 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