NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 46 T 4.3093 8.0333 115.2430 60.9649 68.6414 174.5231 47 P 4.3941 0.0000 0.0000 65.4190 31.5686 175.3131 48 E 4.2032 9.0109 118.0280 58.0927 30.5384 177.6339 49 K 4.7700 7.7087 116.7083 55.8781 32.7034 176.2140 50 E 4.2095 7.6568 119.5097 55.3856 29.9606 175.3118 51 P 4.7366 0.0000 0.0000 61.2885 32.1709 176.2023 52 L 4.1893 8.7247 122.3385 55.5602 42.6638 176.5882 53 K 4.6901 9.5171 124.6610 53.5322 35.2115 174.2063 54 P 4.3680 0.0000 0.0000 64.0569 31.7186 177.2148 55 G 3.9762 9.2996 110.6780 45.3353 0.0000 173.8821 56 D 4.5822 7.7066 120.5785 54.4849 42.1082 176.0283 57 I 3.9823 8.3811 124.3499 61.2752 38.4631 175.1185 58 L 4.8317 8.7151 127.3578 54.2178 43.1074 176.3447 59 V 4.8324 8.5104 116.0922 59.2899 35.6774 174.9308 60 Y 4.5655 8.6110 121.0942 57.7128 38.5666 176.0760 61 A 4.3995 8.7836 124.7901 53.0144 18.9113 176.9634 62 Q 4.7815 8.8846 122.6848 54.1724 33.2210 173.7853 63 G 4.2640 8.3725 117.4317 45.4120 0.0000 177.5851 64 G 3.7589 8.8292 110.9002 45.1361 0.0000 173.5118 65 G 3.8222 8.4594 106.1292 43.8879 0.0000 172.9183 66 E 4.1509 8.2689 117.8698 55.4572 30.0154 175.3609 67 P 4.5523 0.0000 0.0000 62.2415 32.7402 175.2363 68 K 4.6016 8.3557 119.9321 53.8833 34.2097 173.4365 69 P 4.7129 0.0000 0.0000 63.1339 32.4259 176.0873 70 I 3.8676 8.5067 124.7432 60.4043 38.3620 175.3492 71 R 4.7991 8.6531 126.5983 54.3853 31.8565 177.1023 72 L 3.9376 8.9403 125.6265 58.3191 42.0172 179.2993 73 E 4.1240 8.1131 113.7305 58.5766 29.5951 177.5274 74 E 4.1224 8.0294 118.6099 57.9143 29.9049 176.4901 75 L 4.3749 7.8145 119.4914 53.1822 42.3835 175.7893 76 K 4.3842 8.3042 125.3915 53.8403 33.3854 173.8889 77 P 4.5578 0.0000 0.0000 64.4614 31.6230 176.7864 78 G 3.9534 8.7272 111.3762 45.3705 0.0000 173.6223 79 D 4.3891 7.4287 119.3202 52.5986 41.5405 174.5493 80 P 2.0000 0.0000 0.0000 61.7848 31.4269 176.0708 81 F 4.5247 7.0701 114.8275 57.3781 38.8138 174.4105 82 V 4.6374 8.9220 112.9714 59.6345 34.7185 175.1312 83 L 4.9474 8.5713 123.1187 54.4046 43.2194 175.6800 84 A 5.1317 8.8035 123.6596 50.7373 23.2976 174.3995 85 Y 5.1596 8.7732 116.0037 55.4134 42.8213 173.1702 86 P 5.0023 0.0000 0.0000 62.6610 33.5953 174.3805 87 M 5.1021 8.9607 122.7512 53.3418 35.1377 174.0824 88 D 4.8985 8.9242 126.1372 53.5196 41.6718 175.6335 89 P 4.2230 0.0000 0.0000 65.5883 31.4636 177.5256 90 K 4.0802 8.0943 120.4197 59.2841 32.3830 178.0578 91 T 3.9932 7.9906 108.9937 62.3196 69.2415 174.7769 92 K 3.9130 7.9639 120.2057 57.1790 30.4976 175.0506 93 V 3.8259 7.3481 119.2964 62.0582 31.9843 175.1445 94 V 4.1158 8.2246 127.4754 62.2526 32.0237 176.3642 95 K 4.4825 8.5224 131.1412 56.5082 31.4621 177.8113 96 S 3.7383 7.6645 111.7542 58.5545 63.8401 175.4452 97 G 3.5409 8.0767 110.8187 47.4067 0.0000 173.4708 98 E 4.3566 7.9872 121.2096 54.2770 30.2082 176.3052 99 A 4.2576 8.5891 130.1189 54.7043 18.6570 178.7354 100 K 4.1689 8.3093 114.1193 58.1898 32.5652 177.5272 101 N 4.8823 8.3511 116.0709 53.8163 39.1259 174.8242 102 T 3.5670 7.8793 117.4111 63.5633 69.4096 173.4334 103 L 5.3128 8.6611 126.6110 52.6756 45.5107 175.2206 104 L 5.1147 8.6177 122.1561 53.9897 43.1419 175.3709 105 V 5.0161 8.8480 121.4750 61.1883 34.6430 174.0304 106 A 4.9821 9.3048 128.2049 50.4988 23.3717 174.4857 107 R 4.9551 8.4766 120.6030 54.9307 32.0887 175.3692 108 F 5.0815 9.4187 124.9615 55.1168 42.9975 174.5399 109 D 4.6211 9.0744 120.1685 53.7484 41.6197 175.2397 110 P 4.3141 0.0000 0.0000 65.7678 31.4793 177.5887 111 E 4.3675 8.5113 115.3424 57.0352 29.5936 176.9945 112 E 4.3287 8.2822 117.0410 57.0198 30.4899 176.9498 113 L 4.1761 7.2704 118.8188 53.9161 42.5877 176.7391 114 A 4.1678 8.6447 125.6293 51.5682 19.0754 176.9680 115 P 4.3421 0.0000 0.0000 66.0335 31.0866 178.8128 116 E 3.9703 8.0475 116.6612 58.9753 29.9254 178.5783 117 V 3.9986 7.9029 119.1487 65.4174 31.9049 177.7195 118 A 4.0540 8.5572 121.1191 55.0292 17.9482 179.2855 119 Q 4.0791 7.7426 114.9660 58.4803 29.0611 176.5080 120 H 4.8791 8.0154 117.0441 55.4832 30.0793 174.0003 121 A 5.0216 7.8129 119.9420 50.4777 21.3786 177.4998 122 A 4.3685 8.6074 121.0284 49.9685 21.2604 176.4806 123 E 3.6884 9.4498 123.2955 58.5450 26.8092 176.5706 124 G 4.2084 8.1803 105.6690 46.2631 0.0000 173.2688 125 V 4.5183 7.7888 121.4033 62.2965 32.6773 175.1378 126 V 4.7971 9.1510 121.3327 59.4683 34.9062 174.6221 127 A 5.2868 8.2320 124.4290 50.5857 22.5826 174.5325 128 Y 5.1731 8.8280 116.6128 55.8934 43.1414 174.7263 129 S 4.4365 9.1333 116.4495 58.7342 63.1198 173.6630 130 A 4.4072 8.8570 127.6259 51.7532 20.2001 176.1480 131 V 4.2476 7.2566 118.4983 62.4009 32.0456 175.6447 132 C 4.2748 9.1236 130.0004 60.3791 32.0879 174.5133 133 T 4.4003 8.7103 114.3368 62.3144 68.4886 175.1160 134 H 4.5034 7.6317 122.6369 57.4761 30.4837 174.7894 135 L 4.6346 7.6159 117.7780 54.3064 43.2059 177.8274 136 G 3.9594 8.1612 106.5439 45.2283 0.0000 173.8749 137 C 4.5264 7.8474 116.9793 56.9547 41.6779 172.9686 138 I 4.3405 8.2068 122.5734 61.4370 37.4202 177.0016 139 V 4.1421 8.9038 129.0256 62.4099 29.7237 175.3628 140 S 5.0602 8.7674 118.2444 57.7373 64.5564 173.9378 141 Q 4.8588 8.5466 120.1847 54.0523 31.8996 174.0287 142 W 5.3060 8.6629 131.4866 55.8884 33.0393 175.3730 143 V 3.9705 8.3384 127.7109 61.2975 31.4705 176.2042 144 A 3.8218 8.6244 131.7973 55.2241 18.4902 178.3198 145 D 4.4358 7.9807 113.4772 56.0449 39.4956 177.0347 146 E 4.1519 7.9361 116.5104 55.6771 30.5640 175.3251 147 E 2.5400 7.2085 118.3804 57.2816 27.8090 173.4476 148 A 5.0951 6.5093 118.0786 49.9512 23.6304 176.1473 149 A 5.3430 8.7165 121.4202 50.8954 20.9772 176.1458 150 L 5.1572 9.6178 125.3282 53.3763 45.1618 174.5658 151 C 4.9738 9.4540 127.5885 57.5872 32.3350 172.7466 152 P 4.4346 0.0000 0.0000 65.5126 31.5907 178.6218 153 C 4.3844 8.3008 116.2511 60.0629 40.1966 174.3562 154 H 4.8018 7.9023 111.4338 55.3842 30.2536 174.1127 155 G 3.8901 8.4470 106.8514 45.1161 0.0000 174.3089 156 G 3.6527 7.9658 107.2417 46.5709 0.0000 172.9727 157 V 4.9565 8.3151 124.1828 61.1268 35.1061 173.6069 158 Y 4.8794 9.0146 125.4812 56.1216 40.8254 174.6661 159 D 4.7901 9.4133 125.5939 53.8432 39.7530 176.4427 160 L 3.8309 8.2420 127.6881 57.3850 42.4234 179.9113 161 R 3.5883 7.8861 114.5542 58.0288 30.1132 176.4051 162 H 4.9912 7.3736 114.1761 55.3134 29.0265 175.2877 163 G 4.0731 8.6540 103.4299 45.3515 0.0000 173.5783 164 A 3.4986 7.9846 119.6256 52.3664 16.5676 178.2821 165 Q 3.9523 7.5839 119.5036 58.3281 30.1935 176.4873 166 V 4.1247 8.3690 126.1070 62.6438 31.7421 175.3354 167 I 4.4916 8.4033 120.6234 60.6919 38.8218 175.1370 168 A 4.3438 7.7980 123.3262 52.2906 22.5762 177.7653 169 G 3.8691 8.5236 109.3917 44.4357 0.0000 171.9986 170 P 4.5854 0.0000 0.0000 61.7545 31.4598 173.9545 171 P 4.3444 0.0000 0.0000 62.7007 31.4488 174.7004 172 P 4.4962 0.0000 0.0000 64.1118 31.9626 176.0295 173 R 4.6060 7.4654 113.2672 54.3285 31.6843 172.7953 174 P 4.7277 0.0000 0.0000 62.8510 31.9217 177.0067 175 V 3.6912 8.0760 115.2312 60.8310 32.2079 174.3483 176 P 4.7551 0.0000 0.0000 62.4392 32.8549 174.9771 177 Q 4.1185 8.6536 122.4163 55.6862 30.5894 173.9119 178 L 4.6374 7.8826 127.8082 52.3281 43.8124 174.2330 179 P 4.4367 0.0000 0.0000 63.3423 32.1330 175.6893 180 V 5.0131 8.3454 117.9624 59.6389 34.5724 175.2241 181 R 4.6948 8.7021 118.2947 54.7880 33.4574 173.7286 182 V 4.5546 8.2552 120.0764 61.6707 32.9541 174.7378 183 E 4.5115 8.9526 128.3543 55.6166 32.1932 175.2315 184 D 4.1285 9.9618 126.8035 55.4867 38.6543 174.7280 185 G 3.9527 8.2204 106.0453 45.2238 0.0000 173.1277 186 V 4.7032 7.2689 119.7962 60.6208 33.6735 174.4413 187 L 4.5960 8.9389 127.3176 54.7667 42.6830 176.2308 188 V 4.8264 8.7134 122.7703 60.6380 35.5525 174.2744 189 A 4.3581 9.0627 128.9287 52.1180 18.8572 177.7599 190 A 4.3977 9.0933 125.0182 51.8615 20.1486 176.1853 191 G 3.9154 7.1426 100.6615 45.7418 0.0000 173.2106 192 E 4.2819 8.7309 119.5169 55.2272 30.2402 177.0555 193 F 4.2645 8.3527 118.8560 58.4616 39.5860 175.7987 194 L 4.5165 8.7395 124.0712 52.8035 41.5275 176.9202 195 G 4.3799 7.6274 109.8871 44.2377 0.0000 170.6955 196 P 4.2748 0.0000 0.0000 62.3026 31.9249 176.2983 197 V 3.8392 8.1204 122.0536 62.5832 33.1793 176.6438 198 G 3.7456 8.4581 113.0854 44.8403 0.0000 172.4827 199 V 3.8334 8.1816 122.9531 62.4550 31.7094 176.2244 200 Q 4.3887 8.4651 126.9943 53.7956 29.3677 175.6018 201 A 4.1609 8.6765 125.1849 52.6177 18.3062 176.8610 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 46 T 8.03 4.31 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 1.20 0.00 0.00 47 P 0.00 4.39 0.00 2.29 2.10 0.00 3.64 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.16 0.00 48 E 9.01 4.20 0.00 2.05 1.94 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 2.36 2.35 0.00 49 K 7.71 4.77 0.00 1.74 1.80 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.43 1.36 7.81 50 E 7.66 4.21 0.00 2.11 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 2.35 2.29 0.00 51 P 0.00 4.74 0.00 2.08 2.04 0.00 3.76 0.00 0.00 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.05 0.00 52 L 8.72 4.19 0.00 1.83 1.71 0.68 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 53 K 9.52 4.69 0.00 1.76 1.63 0.00 1.73 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.33 1.37 7.81 54 P 0.00 4.37 0.00 2.00 1.93 0.00 3.67 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.13 0.00 55 G 9.30 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 0.00 0.00 0.00 56 D 7.71 4.58 0.00 2.70 2.59 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 57 I 8.38 3.98 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 1.21 0.60 0.89 0.00 0.00 58 L 8.72 4.83 0.00 1.49 1.47 0.83 0.51 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 59 V 8.51 4.83 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 0.79 0.00 0.00 1.07 0.00 0.00 60 Y 8.61 4.57 0.00 2.88 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 61 A 8.78 4.40 1.50 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 0.00 0.00 0.00 62 Q 8.88 4.78 0.00 2.04 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.98 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 63 G 8.37 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 0.00 0.00 0.00 0.00 64 G 8.83 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 65 G 8.46 3.82 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 0.00 0.00 0.00 66 E 8.27 4.15 0.00 1.98 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 2.32 2.25 0.00 67 P 0.00 4.55 0.00 2.23 2.09 0.00 3.73 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 2.01 1.96 0.00 68 K 8.36 4.60 0.00 1.92 1.94 0.00 1.73 0.00 0.00 1.76 0.00 0.00 2.76 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.66 1.53 7.81 69 P 0.00 4.71 0.00 1.99 1.97 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.15 0.00 70 I 8.51 3.87 1.60 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.05 0.69 0.00 0.00 71 R 8.65 4.80 0.00 2.04 1.84 0.00 3.17 0.00 0.00 3.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 72 L 8.94 3.94 0.00 1.68 1.69 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 73 E 8.11 4.12 0.00 2.12 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 2.29 2.35 0.00 74 E 8.03 4.12 0.00 2.26 2.16 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 2.39 2.33 0.00 75 L 7.81 4.37 0.00 1.75 1.61 0.91 0.70 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 76 K 8.30 4.38 0.00 1.75 1.81 0.00 1.71 0.00 0.00 1.78 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.41 1.42 7.81 77 P 0.00 4.56 0.00 2.08 2.01 0.00 3.73 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 78 G 8.73 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 79 D 7.43 4.39 0.00 2.68 2.36 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 80 P 0.00 2.00 0.00 1.37 0.70 0.00 3.44 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 81 F 7.07 4.52 0.00 3.05 3.14 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 0.00 0.00 0.00 0.00 82 V 8.92 4.64 2.32 0.00 0.00 0.00 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 1.02 0.00 0.00 83 L 8.57 4.95 0.00 1.67 1.54 1.04 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 84 A 8.80 5.13 1.09 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 0.00 0.00 85 Y 8.77 5.16 0.00 2.91 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 86 P 0.00 5.00 0.00 2.32 2.16 0.00 3.88 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 87 M 8.96 5.10 0.00 2.14 1.94 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.44 0.00 88 D 8.92 4.90 0.00 2.80 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 89 P 0.00 4.22 0.00 2.21 2.16 0.00 3.81 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.10 0.00 90 K 8.09 4.08 0.00 1.72 1.92 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.42 7.81 91 T 7.99 3.99 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 92 K 7.96 3.91 0.00 1.93 1.93 0.00 1.71 0.00 0.00 1.90 0.00 0.00 2.93 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.50 7.81 93 V 7.35 3.83 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 0.93 0.00 0.00 94 V 8.22 4.12 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 0.86 0.00 0.00 0.95 0.00 0.00 95 K 8.52 4.48 0.00 1.94 1.97 0.00 1.78 0.00 0.00 2.01 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.39 7.81 96 S 7.66 3.74 0.00 3.08 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 97 G 8.08 3.54 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 0.00 0.00 0.00 0.00 0.00 0.00 98 E 7.99 4.36 0.00 2.14 1.88 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 2.35 2.41 0.00 99 A 8.59 4.26 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 0.00 100 K 8.31 4.17 0.00 2.07 1.82 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.38 7.81 101 N 8.35 4.88 0.00 3.21 3.04 0.00 0.00 6.87 6.40 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 0.00 102 T 7.88 3.57 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 0.99 0.00 0.00 103 L 8.66 5.31 0.00 1.54 1.48 0.87 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 104 L 8.62 5.11 0.00 1.01 1.21 0.77 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 105 V 8.85 5.02 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 1.01 0.00 0.00 0.88 0.00 0.00 106 A 9.30 4.98 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 0.00 107 R 8.48 4.96 0.00 1.88 1.76 0.00 3.20 0.00 0.00 3.41 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 108 F 9.42 5.08 0.00 3.01 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 0.00 109 D 9.07 4.62 0.00 2.78 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 0.00 110 P 0.00 4.31 0.00 2.25 2.13 0.00 3.69 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.17 0.00 111 E 8.51 4.37 0.00 2.07 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 2.31 0.00 112 E 8.28 4.33 0.00 2.10 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 0.00 2.78 2.42 0.00 113 L 7.27 4.18 0.00 1.75 1.59 0.96 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 114 A 8.64 4.17 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 0.00 115 P 0.00 4.34 0.00 2.09 2.14 0.00 3.88 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.06 0.00 116 E 8.05 3.97 0.00 1.96 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 2.32 2.47 0.00 117 V 7.90 4.00 2.20 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 1.11 0.00 0.00 1.01 0.00 0.00 118 A 8.56 4.05 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 0.00 119 Q 7.74 4.08 0.00 2.06 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.99 0.00 0.00 0.00 0.00 0.00 2.34 1.87 0.00 120 H 8.02 4.88 0.00 3.02 3.22 0.00 5.60 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 0.00 121 A 7.81 5.02 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 0.00 122 A 8.61 4.37 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 0.00 123 E 9.45 3.69 0.00 2.15 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 0.00 2.21 2.29 0.00 124 G 8.18 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 0.00 125 V 7.79 4.52 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 1.04 0.00 0.00 0.96 0.00 0.00 126 V 9.15 4.80 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 0.70 0.00 0.00 1.37 0.00 0.00 127 A 8.23 5.29 1.11 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 0.00 0.00 128 Y 8.83 5.17 0.00 2.80 2.70 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 0.00 129 S 9.13 4.44 0.00 3.51 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 A 8.86 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 0.00 131 V 7.26 4.25 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 0.76 0.00 0.00 0.89 0.00 0.00 132 C 9.12 4.27 0.00 3.20 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 0.00 133 T 8.71 4.40 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 1.35 0.00 0.00 134 H 7.63 4.50 0.00 3.15 3.31 0.00 5.69 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 L 7.62 4.63 0.00 1.59 1.56 0.82 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 136 G 8.16 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 0.00 0.00 0.00 137 C 7.85 4.53 0.00 2.95 3.07 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 0.00 0.00 0.00 0.00 138 I 8.21 4.34 1.92 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 1.28 0.80 0.95 0.00 0.00 139 V 8.90 4.14 1.94 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 0.87 0.00 0.00 0.94 0.00 0.00 140 S 8.77 5.06 0.00 4.01 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 0.00 141 Q 8.55 4.86 0.00 2.29 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.36 0.00 142 W 8.66 5.31 0.00 2.86 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 0.00 143 V 8.34 3.97 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 0.80 0.00 0.00 0.89 0.00 0.00 144 A 8.62 3.82 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 0.00 145 D 7.98 4.44 0.00 2.76 2.79 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 0.00 146 E 7.94 4.15 0.00 1.82 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 2.17 2.18 0.00 147 E 7.21 2.54 0.00 2.38 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 0.00 2.34 2.21 0.00 148 A 6.51 5.10 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 0.00 149 A 8.72 5.34 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 0.00 150 L 9.62 5.16 0.00 1.78 1.79 1.01 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 151 C 9.45 4.97 0.00 3.19 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 0.00 152 P 0.00 4.43 0.00 2.24 2.31 0.00 3.99 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.04 0.00 153 C 8.30 4.38 0.00 2.99 3.02 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 0.00 0.00 0.00 154 H 7.90 4.80 0.00 3.03 3.23 0.00 5.91 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 G 8.45 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 0.00 156 G 7.97 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 0.00 157 V 8.32 4.96 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 1.00 0.00 0.00 0.95 0.00 0.00 158 Y 9.01 4.88 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 0.00 159 D 9.41 4.79 0.00 2.67 2.59 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 0.00 160 L 8.24 3.83 0.00 1.82 1.80 1.34 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 161 R 7.89 3.59 0.00 1.57 1.49 0.00 2.75 0.00 0.00 3.45 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 162 H 7.37 4.99 0.00 3.17 3.25 0.00 5.72 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 0.00 163 G 8.65 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 A 7.98 3.50 0.92 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 0.00 0.00 165 Q 7.58 3.95 0.00 2.29 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 166 V 8.37 4.12 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 0.69 0.00 0.00 0.86 0.00 0.00 167 I 8.40 4.49 1.82 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 1.09 0.76 0.87 0.00 0.00 168 A 7.80 4.34 1.15 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 0.00 169 G 8.52 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 0.00 170 P 0.00 4.59 0.00 1.87 1.98 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.72 0.00 171 P 0.00 4.34 0.00 1.84 2.14 0.00 3.53 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 2.02 0.00 172 P 0.00 4.50 0.00 2.19 2.18 0.00 3.86 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 2.02 1.98 0.00 173 R 7.47 4.61 0.00 1.93 1.92 0.00 3.07 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.68 0.00 174 P 0.00 4.73 0.00 2.15 2.31 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.18 0.00 175 V 8.08 3.69 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 0.18 0.00 0.00 0.35 0.00 0.00 176 P 0.00 4.76 0.00 2.23 2.20 0.00 3.58 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.12 0.00 177 Q 8.65 4.12 0.00 1.83 1.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.91 0.00 0.00 0.00 0.00 0.00 2.06 1.66 0.00 178 L 7.88 4.64 0.00 1.24 1.31 0.15 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 179 P 0.00 4.44 0.00 2.12 1.96 0.00 3.44 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.98 0.00 180 V 8.35 5.01 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 0.61 0.00 0.00 0.96 0.00 0.00 181 R 8.70 4.69 0.00 1.80 1.93 0.00 2.73 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.54 0.00 182 V 8.26 4.55 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 0.00 183 E 8.95 4.51 0.00 1.92 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 2.17 2.37 0.00 184 D 9.96 4.13 0.00 2.78 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 0.00 185 G 8.22 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 0.00 186 V 7.27 4.70 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 1.05 0.00 0.00 0.93 0.00 0.00 187 L 8.94 4.60 0.00 1.59 1.50 0.89 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 188 V 8.71 4.83 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 0.92 0.00 0.00 0.90 0.00 0.00 189 A 9.06 4.36 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 0.00 190 A 9.09 4.40 1.19 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 0.00 191 G 7.14 3.92 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 0.00 0.00 0.00 192 E 8.73 4.28 0.00 1.97 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 2.29 2.27 0.00 193 F 8.35 4.26 0.00 3.08 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 0.00 194 L 8.74 4.52 0.00 1.62 1.63 0.53 0.61 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 0.00 195 G 7.63 4.38 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 0.00 196 P 0.00 4.27 0.00 2.03 1.98 0.00 3.67 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 2.02 2.07 0.00 197 V 8.12 3.84 1.80 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 0.57 0.00 0.00 -0.14 0.00 0.00 198 G 8.46 3.75 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 0.00 0.00 0.00 0.00 0.00 0.00 199 V 8.18 3.83 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 0.82 0.00 0.00 0.96 0.00 0.00 200 Q 8.47 4.39 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.79 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 201 A 8.68 4.16 1.23 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 0.00 0.00 0.00