NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1938 8.3144 121.7898 55.9951 33.3549 174.6867 2 E 4.0573 8.5195 125.1774 53.8228 30.2961 175.6962 3 T 4.2609 8.6946 118.7515 61.1820 72.2304 174.9315 4 A 4.0116 8.4924 123.1302 55.2390 18.3040 179.9234 5 A 3.9957 8.0076 118.7706 55.2409 18.4995 179.5950 6 A 4.0101 8.1055 119.4317 55.1008 18.4129 179.7593 7 K 4.0222 8.3564 118.3733 59.5099 32.1717 178.7936 8 F 4.0921 8.3313 121.0236 61.4019 39.4694 176.9998 9 E 3.9374 8.1877 118.0360 59.2998 29.0185 179.3798 10 R 3.8653 7.9076 117.8307 59.6514 30.2951 178.3410 11 Q 3.9395 7.9138 116.4874 58.0538 29.0224 176.3609 12 H 4.6552 7.8836 114.1372 54.0858 31.5656 173.3464 13 M 4.6552 7.6995 118.3637 53.8113 33.2524 176.7132 14 D 4.7468 8.8832 122.9629 53.1106 41.5942 175.6953 15 S 4.2112 8.4799 118.4019 60.7095 63.8094 175.9318 16 S 4.2739 8.3332 114.8401 61.1927 62.3763 174.6602 17 T 4.4973 7.6279 110.2842 59.4057 70.1195 174.6921 18 S 4.3280 8.3919 117.1081 59.3708 63.9436 173.9576 19 A 4.0011 6.9545 119.9192 51.1686 21.2541 175.5064 20 A 3.7639 8.3349 125.4288 51.7871 18.7196 177.3728 21 S 4.4881 8.4873 117.6772 59.4010 65.0436 174.9415 22 S 4.3984 7.8233 116.1035 57.3349 62.7431 174.4961 23 S 4.3489 8.6826 121.4067 60.0062 63.3993 173.9950 24 N 4.6990 7.8428 118.7586 53.8433 39.3123 175.4673 25 Y 3.9686 8.1968 119.1657 62.0139 38.7775 177.5659 26 C 4.2670 8.3517 116.8344 60.0647 39.6613 175.7775 27 N 4.4189 8.2528 117.5194 56.5508 38.0847 177.2769 28 Q 3.8997 7.7973 118.6203 59.2458 28.9905 178.5837 29 M 3.6262 7.7672 119.8717 58.5529 31.8651 178.7375 30 M 4.0299 8.2926 119.0659 58.1652 32.0266 178.8360 31 K 4.0380 7.8755 119.9809 59.0657 32.3312 179.0491 32 S 4.2910 8.0428 112.3902 60.2950 62.9803 175.3204 33 R 4.3960 7.4986 120.2624 55.1709 30.1302 175.6058 34 N 4.2633 7.8871 114.7341 54.6432 36.6044 174.8555 35 L 4.4819 8.0260 116.5442 55.1851 41.9242 177.8783 36 T 5.2356 7.5242 107.2853 60.0527 69.1086 175.4257 37 K 3.9694 7.9909 122.6724 59.4091 32.3456 176.8147 38 D 4.7183 7.4143 116.7671 53.1143 41.9043 176.2691 39 R 3.5374 6.6795 114.5567 55.5740 31.0488 174.0732 40 C 4.8238 8.7662 117.5280 55.9779 40.5732 173.7046 41 K 4.2095 8.4796 127.0519 55.7310 32.3752 174.6468 42 P 4.7234 0.0000 0.0000 65.3407 32.2318 176.4796 43 V 5.0854 7.5069 116.1608 61.5118 34.9764 174.0080 44 N 4.6287 8.8507 122.2178 52.9391 42.7056 172.9900 45 T 4.8380 7.8887 121.3729 61.6514 71.7024 172.8657 46 F 4.8348 8.9127 124.6484 55.6314 42.1082 174.5946 47 V 4.5732 9.0074 123.0173 60.9338 33.5391 175.6058 48 H 5.7013 8.5419 126.6031 54.1223 26.5976 173.0560 49 E 4.8244 7.7069 117.2685 53.3691 34.4643 176.8279 50 S 4.3770 8.3256 115.0044 58.1754 65.0728 174.8954 51 L 3.9954 8.5962 124.5060 58.3951 41.7824 179.2565 52 A 3.9923 7.9834 120.1782 55.3620 18.1783 179.1982 53 D 4.3230 7.6579 116.3489 57.4657 41.1720 178.9352 54 V 3.7884 7.8550 118.7640 66.1112 31.7156 178.2064 55 Q 3.9419 8.5214 117.9139 58.6983 28.4801 178.4986 56 A 4.0039 8.0462 121.8321 54.7737 18.2743 179.6275 57 V 3.4308 7.5795 116.9684 66.1240 31.2641 176.9771 58 C 3.8180 7.7187 114.3320 57.9059 39.8664 174.1063 59 S 4.6326 7.5652 114.3716 57.9266 63.9171 174.3831 60 Q 4.1841 7.1795 121.0952 56.1461 30.1985 178.2510 61 K 4.3094 8.4765 134.0684 56.9099 32.8272 174.8087 62 N 4.5928 8.8409 127.4669 53.5912 39.7629 174.2935 63 V 4.5927 8.3358 117.8938 59.4998 36.8866 174.5705 64 A 4.4131 8.3822 124.3533 52.1133 19.2284 178.1547 65 C 4.6594 8.9184 118.3085 55.4444 41.6648 175.3626 66 K 3.7295 8.5091 121.0475 59.7167 31.5845 178.1304 67 N 4.5463 8.0339 112.9670 52.9201 37.5581 175.7442 68 G 3.9543 8.2651 108.9195 45.6145 0.0000 174.3705 69 Q 4.1929 8.4501 119.2306 56.2870 29.2319 176.4604 70 T 4.5489 8.2856 108.7292 61.6548 69.1235 173.8310 71 N 4.9050 7.8201 118.6111 53.9909 38.5168 174.9103 72 C 5.2900 7.3887 115.5497 56.7516 43.6539 172.8151 73 Y 5.1537 8.6786 118.1677 56.4170 42.2479 173.8285 74 Q 5.2082 9.1530 124.9308 54.0062 31.4727 174.9283 75 S 4.4186 8.6697 121.7105 58.7609 63.2201 174.2652 76 Y 4.5029 9.0790 121.6387 60.9501 37.8568 176.7697 77 S 4.7511 7.8840 114.0115 57.2198 64.7745 173.3737 78 T 4.3867 7.9888 111.7473 61.6004 70.0634 173.8515 79 M 5.0349 9.0066 121.9820 53.3679 36.9397 174.5996 80 S 4.8193 9.2816 116.8075 58.2490 63.4831 173.1064 81 I 5.1852 9.0023 120.2561 59.5283 41.6937 174.1875 82 T 4.9330 8.9501 119.5840 61.9054 71.9766 172.4374 83 D 4.9479 9.4430 127.1474 53.2607 43.1894 174.1809 84 C 5.6078 9.2639 123.9281 55.2609 40.0798 172.9054 85 R 5.3234 8.8255 123.6065 54.1180 33.0467 174.0189 86 E 4.1167 9.2715 128.3756 56.4839 30.1700 176.8194 87 T 4.2373 8.3935 116.4565 60.8750 69.8098 175.9039 88 G 3.5998 8.4936 110.8611 47.6321 0.0000 174.8112 89 S 4.3618 7.3512 113.9810 59.5230 63.9585 174.8691 90 S 3.8615 7.4906 114.4218 58.4167 62.5020 173.6203 91 K 4.4663 8.5952 127.4298 54.6749 34.7029 174.8263 92 Y 4.4012 8.6527 127.8825 57.2631 39.2456 173.7187 93 P 3.2165 0.0000 0.0000 62.9531 31.7809 176.9037 94 N 4.6798 7.9470 119.6780 52.1401 37.2286 171.8412 95 C 4.5844 8.2075 117.4478 56.2658 40.3753 173.0140 96 A 5.0959 8.7559 126.5245 50.3059 21.5100 174.5239 97 Y 5.1818 9.1086 118.5857 56.0530 42.3254 174.8571 98 K 4.5934 9.3132 123.7328 55.5258 34.3953 175.1103 99 T 5.1313 8.5409 123.2323 62.2812 70.6908 173.9747 100 T 4.5456 8.7445 122.5157 61.8073 71.9585 172.8341 101 Q 4.8041 8.7540 127.9624 55.4595 30.3601 174.3601 102 A 4.6190 8.8859 125.9925 51.2386 23.6580 174.8832 103 N 5.3363 8.7143 116.2485 51.7788 40.6599 174.1548 104 K 4.7548 8.7176 122.4666 54.8249 37.6657 175.4844 105 H 5.0380 9.1494 118.6292 55.7416 30.0753 175.0746 106 I 4.9421 8.6479 114.9153 59.2667 41.0616 174.3586 107 I 4.9604 8.2469 123.7741 59.7330 40.2829 175.1167 108 V 4.8117 8.5744 119.2633 59.3505 36.0989 174.4250 109 A 4.9399 8.7832 124.9081 51.0958 20.6338 175.6928 110 C 5.1592 8.6987 119.1602 55.3210 39.4193 173.0562 111 E 4.6349 8.7269 121.2292 56.5657 33.6335 175.6628 112 G 3.8539 9.2462 111.1735 44.7294 0.0000 171.6128 113 N 4.9622 8.2365 116.2343 50.6190 40.3730 172.3275 114 P 4.3289 0.0000 0.0000 62.7525 31.9438 176.0577 115 Y 4.9115 8.3158 121.5853 57.1957 38.5863 174.4231 116 V 4.4509 7.9802 119.4059 58.2254 36.7834 173.2831 117 P 4.5150 0.0000 0.0000 62.9543 31.1268 177.1400 118 V 4.4801 8.4839 115.2759 61.1050 33.8469 175.1948 119 H 4.9759 7.8114 119.7325 54.9601 33.4344 171.6838 120 F 4.7069 8.7457 128.0621 57.3381 39.5676 174.5904 121 D 4.4908 8.5342 127.0998 55.7658 41.6288 175.8028 122 A 4.5120 6.2517 117.5045 51.6114 22.2808 174.4431 123 S 5.2135 8.8650 113.1330 56.7562 66.2163 174.7539 124 V 4.1525 8.7451 114.2709 61.7403 32.5541 175.4126 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 K 8.31 4.19 0.00 1.74 1.78 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.39 7.81 2 E 8.52 4.06 0.00 2.06 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 2.38 0.00 3 T 8.69 4.26 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 1.23 0.00 0.00 4 A 8.49 4.01 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 5 A 8.01 4.00 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 6 A 8.11 4.01 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 7 K 8.36 4.02 0.00 1.95 2.04 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.45 7.81 8 F 8.33 4.09 0.00 3.26 3.28 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 9 E 8.19 3.94 0.00 2.22 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 2.50 2.69 0.00 10 R 7.91 3.87 0.00 1.79 2.07 0.00 3.36 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 11 Q 7.91 3.94 0.00 1.48 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.48 0.00 0.00 0.00 0.00 0.00 2.23 2.46 0.00 12 H 7.88 4.66 0.00 1.99 2.67 0.00 5.61 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 13 M 7.70 4.66 0.00 1.97 2.14 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.56 0.00 14 D 8.88 4.75 0.00 2.74 2.55 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 15 S 8.48 4.21 0.00 3.93 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 16 S 8.33 4.27 0.00 3.97 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 17 T 7.63 4.50 4.29 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 1.24 0.00 0.00 18 S 8.39 4.33 0.00 3.98 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 19 A 6.95 4.00 1.12 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 0.00 0.00 0.00 20 A 8.33 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 S 8.49 4.49 0.00 3.95 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 22 S 7.82 4.40 0.00 3.92 3.85 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 0.00 0.00 0.00 23 S 8.68 4.35 0.00 4.05 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 24 N 7.84 4.70 0.00 2.88 2.84 0.00 0.00 6.69 7.44 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 25 Y 8.20 3.97 0.00 3.17 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 26 C 8.35 4.27 0.00 3.20 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 27 N 8.25 4.42 0.00 2.94 2.93 0.00 0.00 7.13 7.66 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 28 Q 7.80 3.90 0.00 2.02 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.80 0.00 0.00 0.00 0.00 0.00 2.31 2.53 0.00 29 M 7.77 3.63 0.00 0.76 1.31 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.45 0.00 30 M 8.29 4.03 0.00 1.68 1.86 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 2.38 0.00 31 K 7.88 4.04 0.00 1.92 2.07 0.00 1.56 0.00 0.00 1.81 0.00 0.00 3.09 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.41 1.32 7.81 32 S 8.04 4.29 0.00 3.99 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 33 R 7.50 4.40 0.00 1.88 2.08 0.00 3.58 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 2.05 0.00 34 N 7.89 4.26 0.00 2.90 2.93 0.00 0.00 6.86 7.97 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 35 L 8.03 4.48 0.00 1.82 1.64 0.80 0.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.52 5.24 4.44 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 1.40 0.00 0.00 37 K 7.99 3.97 0.00 1.94 1.85 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.91 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.47 1.51 7.81 38 D 7.41 4.72 0.00 2.59 2.53 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 39 R 6.68 3.54 0.00 1.73 1.69 0.00 2.89 0.00 0.00 3.27 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.41 0.00 40 C 8.77 4.82 0.00 3.10 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 41 K 8.48 4.21 0.00 1.85 1.77 0.00 1.76 0.00 0.00 1.61 0.00 0.00 3.15 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.59 1.42 7.81 42 P 0.00 4.72 0.00 2.15 2.11 0.00 3.63 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.12 0.00 43 V 7.51 5.09 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 0.80 0.00 0.00 0.98 0.00 0.00 44 N 8.85 4.63 0.00 2.66 2.27 0.00 0.00 7.05 6.76 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 45 T 7.89 4.84 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 0.88 0.00 0.00 46 F 8.91 4.83 0.00 2.95 2.85 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 0.00 0.00 0.00 47 V 9.01 4.57 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 1.09 0.00 0.00 1.00 0.00 0.00 48 H 8.54 5.70 0.00 3.04 3.43 0.00 5.61 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.71 4.82 0.00 1.94 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 2.25 2.26 0.00 50 S 8.33 4.38 0.00 4.07 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 51 L 8.60 4.00 0.00 1.82 1.75 1.02 1.20 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 A 7.98 3.99 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 53 D 7.66 4.32 0.00 2.80 2.77 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 54 V 7.86 3.79 2.19 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 1.23 0.00 0.00 1.09 0.00 0.00 55 Q 8.52 3.94 0.00 2.23 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.58 0.00 56 A 8.05 4.00 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 57 V 7.58 3.43 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 1.01 0.00 0.00 0.99 0.00 0.00 58 C 7.72 3.82 0.00 2.89 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 59 S 7.57 4.63 0.00 3.87 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 60 Q 7.18 4.18 0.00 1.69 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.66 6.98 0.00 0.00 0.00 0.00 0.00 1.65 2.12 0.00 61 K 8.48 4.31 0.00 2.04 1.88 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.50 1.53 7.81 62 N 8.84 4.59 0.00 2.86 2.71 0.00 0.00 7.00 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 63 V 8.34 4.59 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 0.68 0.00 0.00 0.83 0.00 0.00 64 A 8.38 4.41 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 65 C 8.92 4.66 0.00 3.07 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 66 K 8.51 3.73 0.00 1.71 1.89 0.00 1.70 0.00 0.00 1.75 0.00 0.00 3.07 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.80 1.55 7.81 67 N 8.03 4.55 0.00 2.80 2.88 0.00 0.00 6.23 7.00 0.00 0.00 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 G 8.27 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 69 Q 8.45 4.19 0.00 2.24 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.27 0.00 70 T 8.29 4.55 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 1.17 0.00 0.00 71 N 7.82 4.90 0.00 3.03 3.13 0.00 0.00 6.05 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 72 C 7.39 5.29 0.00 3.02 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 73 Y 8.68 5.15 0.00 2.85 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 74 Q 9.15 5.21 0.00 2.03 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 75 S 8.67 4.42 0.00 3.94 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 76 Y 9.08 4.50 0.00 3.00 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 77 S 7.88 4.75 0.00 3.90 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 78 T 7.99 4.39 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 1.04 0.00 0.00 79 M 9.01 5.03 0.00 1.93 2.00 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 2.53 2.48 0.00 80 S 9.28 4.82 0.00 3.92 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 81 I 9.00 5.19 1.91 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.56 0.97 0.00 0.00 82 T 8.95 4.93 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 1.17 0.00 0.00 83 D 9.44 4.95 0.00 2.77 2.56 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 84 C 9.26 5.61 0.00 2.97 2.89 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 85 R 8.83 5.32 0.00 1.95 1.79 0.00 3.14 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.27 4.12 0.00 2.08 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 2.07 1.57 0.00 87 T 8.39 4.24 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 1.18 0.00 0.00 88 G 8.49 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 89 S 7.35 4.36 0.00 3.96 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 90 S 7.49 3.86 0.00 3.81 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 91 K 8.60 4.47 0.00 1.89 1.57 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.34 1.38 7.81 92 Y 8.65 4.40 0.00 2.95 2.87 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 93 P 0.00 3.22 0.00 1.77 1.13 0.00 3.61 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 1.73 1.71 0.00 94 N 7.95 4.68 0.00 2.87 2.75 0.00 0.00 7.01 8.41 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 95 C 8.21 4.58 0.00 3.16 3.10 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 96 A 8.76 5.10 1.12 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 0.00 0.00 0.00 97 Y 9.11 5.18 0.00 2.87 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 98 K 9.31 4.59 0.00 1.87 1.85 0.00 1.53 0.00 0.00 1.68 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.50 7.81 99 T 8.54 5.13 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 1.26 0.00 0.00 100 T 8.74 4.55 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 1.23 0.00 0.00 101 Q 8.75 4.80 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 102 A 8.89 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 103 N 8.71 5.34 0.00 2.58 2.76 0.00 0.00 6.68 7.61 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 0.00 104 K 8.72 4.75 0.00 1.73 1.83 0.00 1.72 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.39 1.44 7.81 105 H 9.15 5.04 0.00 3.19 3.24 0.00 5.57 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.65 4.94 1.97 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.88 1.15 0.00 0.00 107 I 8.25 4.96 1.75 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 1.15 0.73 0.79 0.00 0.00 108 V 8.57 4.81 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 0.72 0.00 0.00 0.83 0.00 0.00 109 A 8.78 4.94 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 0.00 110 C 8.70 5.16 0.00 2.23 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 0.00 0.00 0.00 111 E 8.73 4.63 0.00 1.98 1.69 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 2.25 2.32 0.00 112 G 9.25 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 113 N 8.24 4.96 0.00 2.66 2.72 0.00 0.00 6.90 7.69 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 0.00 114 P 0.00 4.33 0.00 2.23 2.06 0.00 3.83 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 115 Y 8.32 4.91 0.00 2.85 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 0.00 116 V 7.98 4.45 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 0.74 0.00 0.00 0.90 0.00 0.00 117 P 0.00 4.51 0.00 0.49 1.11 0.00 3.36 0.00 0.00 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.81 0.00 118 V 8.48 4.48 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 0.59 0.00 0.00 0.93 0.00 0.00 119 H 7.81 4.98 0.00 3.27 3.09 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.75 4.71 0.00 2.80 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 0.00 121 D 8.53 4.49 0.00 2.60 2.55 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 0.00 122 A 6.25 4.51 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 0.00 123 S 8.86 5.21 0.00 3.97 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 0.00 124 V 8.75 4.15 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 0.66 0.00 0.00 0.95 0.00 0.00