NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 22 L 4.3004 8.1801 120.6355 55.0613 41.9561 175.5140 23 A 4.2359 8.1253 124.7833 50.9718 20.3746 175.0611 24 D 5.0917 8.2149 114.3227 50.6760 43.8997 174.3909 25 S 4.1640 9.3711 114.7789 61.9416 62.5795 176.9447 26 K 3.9232 8.1368 120.3679 59.5119 31.7813 178.9983 27 A 4.0094 8.5182 121.2028 55.2267 18.2585 180.1319 28 V 3.6940 7.8538 117.4004 64.7229 31.5245 178.6270 29 L 4.2092 8.3820 120.0810 57.8449 41.5118 178.9927 30 N 4.3073 8.4642 117.1225 56.4768 38.7323 176.6468 31 Q 4.2499 8.4657 121.0537 59.2979 29.1660 178.2706 32 A 4.2244 8.5486 122.1196 55.1668 18.5749 179.6135 33 V 3.5582 8.0984 116.5982 66.1653 31.5938 178.1923 34 A 4.0847 8.4309 120.2656 55.4742 18.3527 179.4171 35 D 4.3707 8.6342 117.8669 57.5441 40.8278 179.0548 36 L 4.2265 8.7183 119.8731 57.8309 41.6801 179.8000 37 S 3.9014 7.8038 114.9583 61.5043 62.6161 176.9291 38 V 3.6398 7.7889 120.7546 65.7228 31.2049 177.8610 39 A 4.0140 8.6216 121.0224 55.4263 18.2296 178.9667 40 H 3.9924 8.5504 116.9873 59.5104 29.9323 177.3854 41 S 4.1248 8.0067 114.3449 61.4641 62.1564 176.2260 42 I 3.7233 7.9463 122.5198 64.3660 36.7802 178.3365 43 L 3.9451 8.0852 119.9566 58.0850 41.3438 179.1321 44 H 3.6841 8.0423 118.1130 58.9301 29.6185 177.0436 45 Q 4.3270 8.0828 121.3870 59.3400 28.7296 178.4429 46 V 3.6455 8.0180 119.3567 66.2556 31.3318 177.2300 47 H 4.1772 8.2772 117.0216 59.3071 29.7284 176.9643 48 W 4.6861 8.3926 119.4396 59.9283 28.8699 177.5100 49 Y 4.3214 8.5797 114.5441 57.2961 37.6497 175.1938 50 M 4.5151 7.5761 121.1963 55.9024 32.9454 175.6270 51 R 4.6679 8.8354 123.4438 55.3958 34.6399 173.6935 52 G 4.2793 8.9972 106.3144 42.9793 0.0000 173.4517 53 R 4.2156 8.3317 119.8410 57.6004 30.4285 177.4517 54 G 4.2622 9.3255 109.9293 45.3416 0.0000 175.0354 55 F 4.1091 8.7230 122.3910 61.8161 39.1348 176.6423 56 M 4.1833 8.3683 115.5903 58.2955 31.6909 177.7028 57 I 3.7907 7.5084 119.3056 63.7226 37.8589 177.9595 58 W 4.1771 8.2402 119.4665 59.0288 28.6691 178.3310 59 H 3.9022 8.0385 118.7094 58.6939 29.6669 175.3677 60 P 4.2306 0.0000 0.0000 65.4036 31.1076 178.1445 61 K 3.5929 7.3677 118.9580 59.4675 31.9182 178.5818 62 M 3.9861 7.8601 119.0023 58.3523 31.8054 178.2271 63 D 4.1203 7.6747 117.8011 57.0891 41.2874 178.1848 64 E 3.8997 7.7124 118.7152 59.5798 29.4643 178.6818 65 Y 4.4682 7.9438 116.8988 61.4829 37.8504 178.6017 66 M 4.0245 8.4984 120.0489 58.3794 32.0400 178.4187 67 E 3.8807 8.2927 119.4562 59.1253 29.7832 178.5083 68 E 3.6900 8.3658 119.4580 59.2409 29.7320 178.8116 69 I 3.7864 8.0318 120.1356 64.5817 37.1007 178.0748 70 D 4.4455 8.5130 120.1464 57.2286 40.6222 179.1027 71 G 3.4373 7.8252 106.1363 48.0965 0.0000 175.4006 72 Y 4.3466 7.3706 119.4225 60.5849 37.7524 178.3009 73 L 3.9882 8.1764 121.3922 58.0829 42.1368 178.7356 74 D 4.3220 8.3108 118.9992 57.4446 40.8228 178.5159 75 E 3.8914 8.1241 118.7777 59.9131 29.5501 179.5729 76 M 3.9454 8.2905 119.1251 58.1038 31.9327 179.0686 77 S 4.1363 8.3462 114.7905 61.5957 63.2235 176.4300 78 E 3.9173 8.1608 122.5004 58.9379 29.1406 179.3754 79 R 3.8251 7.9612 118.8924 59.1204 30.0437 178.3051 80 L 3.9160 7.9693 120.1985 58.1894 42.0290 179.0035 81 I 3.6781 7.9481 119.8701 64.8388 36.8452 178.5651 82 T 3.8755 7.8750 115.3231 66.2900 68.2887 175.6839 83 L 4.4268 7.5878 118.3654 54.5266 41.7354 177.5107 84 G 3.8064 8.1598 107.4682 45.6166 0.0000 174.1880 85 G 3.7910 7.9721 109.3529 43.8976 0.0000 173.4922 86 A 4.4752 7.9962 121.2248 49.2128 20.3900 174.2141 87 P 4.5298 0.0000 0.0000 62.8929 32.2049 176.7283 88 F 4.5557 8.4102 120.4676 58.6983 39.3266 176.3307 89 S 4.7781 8.8594 119.3868 56.2905 63.3171 174.6133 90 T 4.4592 6.7177 109.5529 60.0189 72.9455 173.3119 91 L 4.0201 8.2712 122.4569 57.7427 41.6055 179.7074 92 K 3.8422 7.8388 119.0586 59.6392 32.2220 178.5061 93 E 3.7068 7.6995 118.2281 59.2281 29.3309 179.2896 94 F 4.4352 7.7289 117.7288 60.7598 38.8375 177.5088 95 S 4.1286 8.2843 111.6160 61.7122 62.2920 175.8859 96 E 4.0703 8.1325 119.9727 59.3356 29.2772 178.6430 97 N 4.4376 7.8854 115.2581 54.3990 39.1192 176.0073 98 S 4.4308 7.4870 114.5167 58.5140 62.9313 173.7452 99 Q 4.3411 8.8223 124.2695 55.8541 29.0209 176.0746 100 L 4.1164 7.3274 118.7978 53.6360 42.6514 176.1839 101 K 4.5598 8.2464 120.8354 54.6170 34.4602 175.5737 102 E 4.6745 8.5181 122.1494 54.7343 31.6227 175.5463 103 V 4.5295 7.7427 113.7113 58.8926 35.4480 175.6740 104 L 4.0438 8.2566 121.2125 54.4755 42.0345 177.8719 105 G 2.5058 8.0067 110.7710 45.3944 0.0000 172.9327 106 D 4.3885 7.3604 121.0366 52.5875 43.3909 175.7054 107 Y 4.7351 8.6581 124.4457 60.3637 38.1150 176.9959 108 N 4.6210 8.7597 116.2346 54.3592 38.9802 175.7528 109 V 3.8168 7.3039 119.6419 62.7305 32.2456 176.4275 110 T 4.2641 9.0672 118.0085 61.2630 70.8796 175.8357 111 I 3.6868 8.2790 122.6917 64.8930 37.1904 178.6139 112 E 3.8808 8.0689 118.7006 59.2282 29.3226 179.1024 113 E 3.9578 8.2543 118.9006 59.2346 29.4657 179.2627 114 Q 3.9485 8.2185 118.2835 59.0693 28.7621 178.9841 115 L 3.7230 7.8579 119.6605 57.5510 41.5266 179.4594 116 A 3.8697 7.9717 120.8163 54.8982 18.2528 179.7083 117 R 3.7489 7.9101 117.4866 59.4611 30.1530 178.9209 118 V 3.2450 7.4657 118.1295 65.7389 31.3671 178.0689 119 V 3.4443 7.6553 118.0530 66.0221 31.3095 177.8091 120 E 3.9486 8.0590 118.2225 59.3756 29.2925 179.5380 121 V 3.6273 7.7749 118.1269 66.2197 31.5628 178.1648 122 F 4.4434 8.6665 117.8987 60.6321 38.6568 177.9512 123 R 3.9259 8.5588 118.3664 59.1825 29.8005 178.3934 124 Y 3.8743 8.0700 119.3675 60.7075 38.8740 178.1257 125 L 3.4325 8.1101 119.6488 57.4660 41.6377 179.3526 126 A 3.7818 7.9656 120.6641 55.0683 18.3098 179.6100 127 A 3.8040 7.7165 119.2512 54.8795 18.2997 179.5803 128 L 3.6017 7.5062 119.2641 58.3681 42.0648 179.3387 129 F 4.4057 8.1970 117.9515 60.5977 38.6737 177.4960 130 Q 4.0046 8.2541 121.9002 59.5275 28.7244 178.9976 131 K 4.0264 7.9750 125.0422 59.6774 31.7619 181.7046 132 G 2.4545 7.7956 107.4683 46.8474 0.0000 175.6080 133 F 4.0229 8.0216 123.0739 61.2166 39.4953 176.9532 134 D 4.4338 8.4805 118.7489 57.4055 40.7146 179.0355 135 V 3.5675 7.9794 119.1692 66.0746 31.7118 178.2953 136 S 4.4889 8.0644 115.3232 60.8027 62.7935 175.9940 137 D 4.1023 7.8819 121.8068 57.1254 40.7569 177.8416 138 E 3.9670 8.0418 118.6320 58.7603 29.8094 177.6562 139 E 4.3970 8.2088 116.6694 55.5163 29.5935 177.2097 140 G 3.8946 7.6485 107.0894 46.9707 0.0000 175.3102 141 D 4.6130 8.3569 121.7943 52.1261 38.4689 176.1630 142 S 4.0342 7.9610 119.2112 61.0535 63.3559 176.9068 143 V 3.4985 7.6408 121.0501 66.1977 31.5645 177.9460 144 T 3.7502 7.9209 115.0551 66.5284 68.2369 175.9809 145 N 4.6075 8.1799 120.3074 56.2397 38.8527 176.4147 146 D 4.3655 8.1180 119.2994 57.2427 41.3078 178.0873 147 I 3.5327 7.4950 119.9526 64.5132 37.0734 178.4251 148 F 3.9059 7.7698 118.0863 60.3307 38.7339 177.2355 149 N 4.3889 8.3941 116.7959 56.8194 38.9347 177.1338 150 V 3.5838 8.0311 119.5230 65.8880 31.6348 177.9087 151 A 3.3483 7.6306 120.5458 54.5804 17.9021 179.4672 152 K 4.0739 8.3917 118.4222 59.5458 32.4093 178.6585 153 A 4.0023 8.0636 121.2446 55.4025 18.3252 179.8394 154 S 4.1253 7.9728 112.1431 61.5988 63.1375 176.6308 155 I 3.5559 7.8849 123.4424 64.2194 36.8568 178.2826 156 E 4.0717 8.4493 119.4982 59.1962 29.3495 179.3632 157 K 4.2714 8.0802 119.4412 59.9588 32.2215 178.6502 158 H 4.4246 8.2020 116.5740 58.8937 28.5092 177.7388 159 I 3.8297 8.0246 121.7437 64.1296 36.8689 178.1504 160 W 4.3380 8.3642 129.0919 60.9554 30.5148 177.9901 161 M 3.3845 7.6965 118.1258 58.0316 31.3144 178.7912 162 L 3.9983 8.3546 119.5333 57.9552 41.8025 179.6072 163 Q 3.9783 8.4283 117.9903 58.8183 28.5556 178.6275 164 A 4.0624 8.3571 122.1832 55.2955 18.2166 179.2402 165 E 3.9923 8.2030 116.6549 59.2889 29.7562 178.1561 166 L 4.3823 7.6369 116.1624 54.1945 41.6417 177.1471 167 G 3.9347 8.1836 106.8697 46.4442 0.0000 173.5028 168 Q 4.6347 8.3174 117.2267 53.1875 32.2745 175.1073 169 A 4.4717 8.2427 121.9361 51.0107 19.4502 176.1357 170 P 4.4087 0.0000 0.0000 64.3336 31.6549 177.6665 171 K 3.8514 8.1222 114.8113 56.9490 29.5582 175.0954 172 L 4.1713 8.0730 122.1574 55.3146 41.4824 177.6508 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 22 L 8.18 4.30 0.00 1.67 1.73 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.13 4.24 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 24 D 8.21 5.09 0.00 3.06 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 25 S 9.37 4.16 0.00 3.89 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 26 K 8.14 3.92 0.00 1.79 1.85 0.00 1.65 0.00 0.00 1.99 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.52 7.81 27 A 8.52 4.01 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.85 3.69 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 1.07 0.00 0.00 0.77 0.00 0.00 29 L 8.38 4.21 0.00 2.01 1.79 0.93 0.57 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 30 N 8.46 4.31 0.00 2.81 2.59 0.00 0.00 6.87 6.64 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 31 Q 8.47 4.25 0.00 2.45 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.58 0.00 0.00 0.00 0.00 0.00 2.47 2.74 0.00 32 A 8.55 4.22 1.71 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 0.00 0.00 33 V 8.10 3.56 2.46 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 1.24 0.00 0.00 0.99 0.00 0.00 34 A 8.43 4.08 1.59 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 35 D 8.63 4.37 0.00 2.88 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 36 L 8.72 4.23 0.00 1.77 1.79 1.15 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 37 S 7.80 3.90 0.00 3.42 3.23 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 38 V 7.79 3.64 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 0.99 0.00 0.00 0.96 0.00 0.00 39 A 8.62 4.01 1.48 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 0.00 0.00 0.00 40 H 8.55 3.99 0.00 3.38 3.48 0.00 5.79 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 41 S 8.01 4.12 0.00 4.02 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 0.00 42 I 7.95 3.72 2.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.57 0.87 0.00 0.00 43 L 8.09 3.95 0.00 1.80 1.68 1.12 0.96 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 44 H 8.04 3.68 0.00 3.05 2.73 0.00 5.59 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Q 8.08 4.33 0.00 2.27 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.37 2.40 0.00 46 V 8.02 3.65 2.26 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 0.97 0.00 0.00 1.04 0.00 0.00 47 H 8.28 4.18 0.00 3.04 3.34 0.00 6.00 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 W 8.39 4.69 0.00 3.67 2.80 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 49 Y 8.58 4.32 0.00 3.19 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 50 M 7.58 4.52 0.00 2.30 2.39 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.86 0.00 51 R 8.84 4.67 0.00 1.90 1.79 0.00 3.30 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.79 0.00 52 G 9.00 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 0.00 0.00 0.00 0.00 53 R 8.33 4.22 0.00 1.87 1.96 0.00 3.38 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.61 0.00 54 G 9.33 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 55 F 8.72 4.11 0.00 3.38 3.12 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 56 M 8.37 4.18 0.00 2.08 2.23 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.74 0.00 57 I 7.51 3.79 1.73 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.05 0.12 0.00 0.00 58 W 8.24 4.18 0.00 3.44 3.19 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 59 H 8.04 3.90 0.00 1.60 2.60 0.00 5.95 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 P 0.00 4.23 0.00 2.16 2.20 0.00 3.64 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.00 0.00 61 K 7.37 3.59 0.00 1.50 1.74 0.00 1.01 0.00 0.00 1.22 0.00 0.00 2.54 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.84 0.43 7.81 62 M 7.86 3.99 0.00 2.06 2.26 0.00 0.00 0.00 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.98 0.00 63 D 7.67 4.12 0.00 2.59 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 64 E 7.71 3.90 0.00 1.96 1.90 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 2.30 2.24 0.00 65 Y 7.94 4.47 0.00 3.23 3.15 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 66 M 8.50 4.02 0.00 1.84 2.08 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.18 0.00 67 E 8.29 3.88 0.00 2.10 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 2.25 2.27 0.00 68 E 8.37 3.69 0.00 2.07 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 2.04 1.90 0.00 69 I 8.03 3.79 2.11 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.04 1.05 0.00 0.00 70 D 8.51 4.45 0.00 2.84 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 71 G 7.83 3.44 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 0.00 72 Y 7.37 4.35 0.00 3.20 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 L 8.18 3.99 0.00 1.78 1.85 0.90 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 74 D 8.31 4.32 0.00 2.91 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 75 E 8.12 3.89 0.00 2.09 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 2.53 2.51 0.00 76 M 8.29 3.95 0.00 1.97 2.16 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 1.95 0.00 77 S 8.35 4.14 0.00 4.06 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 78 E 8.16 3.92 0.00 2.12 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 0.00 2.32 2.37 0.00 79 R 7.96 3.83 0.00 1.96 1.96 0.00 3.10 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 80 L 7.97 3.92 0.00 1.85 1.81 0.95 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 81 I 7.95 3.68 2.00 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 1.52 0.57 0.90 0.00 0.00 82 T 7.87 3.88 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 1.19 0.00 0.00 83 L 7.59 4.43 0.00 1.76 1.68 0.96 1.00 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 84 G 8.16 3.81 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 0.00 0.00 0.00 85 G 7.97 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 0.00 0.00 0.00 86 A 8.00 4.48 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 87 P 0.00 4.53 0.00 2.27 2.07 0.00 3.78 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 88 F 8.41 4.56 0.00 3.44 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 89 S 8.86 4.78 0.00 3.99 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 90 T 6.72 4.46 4.09 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 1.13 0.00 0.00 91 L 8.27 4.02 0.00 1.70 1.82 1.00 1.00 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 92 K 7.84 3.84 0.00 1.76 1.72 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.44 1.49 7.81 93 E 7.70 3.71 0.00 1.92 1.64 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 2.28 2.26 0.00 94 F 7.73 4.44 0.00 3.27 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 95 S 8.28 4.13 0.00 3.94 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 96 E 8.13 4.07 0.00 1.95 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 2.31 2.41 0.00 97 N 7.89 4.44 0.00 2.35 2.72 0.00 0.00 7.00 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 98 S 7.49 4.43 0.00 4.08 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 99 Q 8.82 4.34 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.59 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 100 L 7.33 4.12 0.00 1.50 1.43 0.92 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.25 4.56 0.00 1.65 1.65 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.28 1.33 7.81 102 E 8.52 4.67 0.00 1.93 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 2.21 2.29 0.00 103 V 7.74 4.53 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 0.70 0.00 0.00 0.86 0.00 0.00 104 L 8.26 4.04 0.00 1.54 1.51 0.89 0.86 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 0.00 105 G 8.01 2.51 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 0.00 106 D 7.36 4.39 0.00 2.48 2.37 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 0.00 107 Y 8.66 4.74 0.00 3.13 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 0.00 108 N 8.76 4.62 0.00 2.88 2.91 0.00 0.00 6.92 7.83 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 0.00 109 V 7.30 3.82 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 0.82 0.00 0.00 0.96 0.00 0.00 110 T 9.07 4.26 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 1.28 0.00 0.00 111 I 8.28 3.69 1.90 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.12 0.85 0.00 0.00 112 E 8.07 3.88 0.00 1.96 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 2.31 2.34 0.00 113 E 8.25 3.96 0.00 2.15 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 0.00 2.30 2.32 0.00 114 Q 8.22 3.95 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.63 2.60 0.00 115 L 7.86 3.72 0.00 1.54 1.34 0.40 -0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.97 3.87 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 117 R 7.91 3.75 0.00 1.87 2.06 0.00 3.08 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 1.56 1.60 0.00 118 V 7.47 3.25 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 -0.17 0.00 0.00 0.86 0.00 0.00 119 V 7.66 3.44 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 1.04 0.00 0.00 0.86 0.00 0.00 120 E 8.06 3.95 0.00 2.18 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 2.30 2.54 0.00 121 V 7.77 3.63 2.17 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 1.19 0.00 0.00 0.95 0.00 0.00 122 F 8.67 4.44 0.00 3.11 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 0.00 123 R 8.56 3.93 0.00 2.01 1.99 0.00 3.14 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 1.68 1.89 0.00 124 Y 8.07 3.87 0.00 3.13 3.17 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 0.00 125 L 8.11 3.43 0.00 1.57 0.79 0.98 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 126 A 7.97 3.78 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 0.00 127 A 7.72 3.80 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 0.00 128 L 7.51 3.60 0.00 1.11 1.34 0.89 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 129 F 8.20 4.41 0.00 3.12 3.19 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 0.00 130 Q 8.25 4.00 0.00 2.10 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.37 0.00 131 K 7.98 4.03 0.00 1.82 1.80 0.00 1.87 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.37 1.33 7.81 132 G 7.80 2.45 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 0.00 133 F 8.02 4.02 0.00 3.30 3.23 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 0.00 134 D 8.48 4.43 0.00 2.87 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 0.00 135 V 7.98 3.57 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 1.07 0.00 0.00 0.91 0.00 0.00 136 S 8.06 4.49 0.00 4.28 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 0.00 137 D 7.88 4.10 0.00 2.58 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 0.00 138 E 8.04 3.97 0.00 2.00 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 0.00 2.31 2.34 0.00 139 E 8.21 4.40 0.00 2.06 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 2.27 2.60 0.00 140 G 7.65 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 0.00 141 D 8.36 4.61 0.00 2.66 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 0.00 142 S 7.96 4.03 0.00 4.04 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 0.00 143 V 7.64 3.50 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 1.01 0.00 0.00 0.90 0.00 0.00 144 T 7.92 3.75 4.49 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 145 N 8.18 4.61 0.00 2.63 2.87 0.00 0.00 6.45 8.07 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 0.00 146 D 8.12 4.37 0.00 2.76 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 0.00 147 I 7.49 3.53 1.64 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.69 0.50 0.00 0.00 148 F 7.77 3.91 0.00 3.40 3.25 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 0.00 149 N 8.39 4.39 0.00 3.31 3.04 0.00 0.00 6.86 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 0.00 150 V 8.03 3.58 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 0.99 0.00 0.00 1.01 0.00 0.00 151 A 7.63 3.35 -0.02 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 0.00 0.00 152 K 8.39 4.07 0.00 2.05 1.98 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.74 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.60 1.52 7.81 153 A 8.06 4.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.97 4.13 0.00 4.35 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 0.00 155 I 7.88 3.56 2.07 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.13 0.81 0.00 0.00 156 E 8.45 4.07 0.00 2.22 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 2.34 2.47 0.00 157 K 8.08 4.27 0.00 2.08 2.02 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.72 1.94 7.81 158 H 8.20 4.42 0.00 3.45 3.41 0.00 5.68 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 I 8.02 3.83 2.19 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.08 1.00 0.00 0.00 160 W 8.36 4.34 0.00 3.44 3.48 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 0.00 161 M 7.70 3.38 0.00 1.94 2.05 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 1.00 0.00 162 L 8.35 4.00 0.00 1.67 1.60 0.80 0.65 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 0.00 163 Q 8.43 3.98 0.00 2.35 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.50 2.73 0.00 164 A 8.36 4.06 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 0.00 165 E 8.20 3.99 0.00 2.24 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 0.00 2.27 2.41 0.00 166 L 7.64 4.38 0.00 1.79 1.63 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 167 G 8.18 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 0.00 168 Q 8.32 4.63 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.91 0.00 0.00 0.00 0.00 0.00 2.28 2.47 0.00 169 A 8.24 4.47 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 0.00 170 P 0.00 4.41 0.00 2.12 2.27 0.00 3.89 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 2.09 2.39 0.00 171 K 8.12 3.85 0.00 1.90 1.88 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.67 7.81 172 L 8.07 4.17 0.00 1.63 1.59 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00