NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.2972 7.8827 121.4507 61.2011 38.7944 173.8251 17 V 4.4277 8.4874 125.4581 61.6650 33.1167 174.3592 18 G 3.7460 8.3969 113.3440 46.1940 0.0000 173.3645 19 G 4.1260 7.7302 109.6002 44.2034 0.0000 172.3283 20 Y 4.9591 7.7955 116.6530 55.1957 42.2609 174.6691 21 T 4.3386 8.5709 116.8147 63.7942 68.3806 175.7037 22 C 4.3460 8.6896 125.3393 59.3838 35.7012 175.3456 23 G 4.0566 8.5903 106.0657 44.6095 0.0000 172.7203 24 A 4.1802 8.6009 125.6116 53.9346 18.6411 176.8699 25 N 4.2507 8.8121 119.4759 54.4338 36.3226 175.4890 26 T 4.1910 7.5884 108.3508 62.7784 70.0421 175.1365 27 V 4.0631 7.0783 122.5667 60.0006 31.1623 173.6725 28 P 4.5691 0.0000 0.0000 63.7319 31.9415 178.0288 29 Y 4.9770 6.6987 115.7668 56.1463 38.7999 174.7252 30 Q 4.6439 7.2482 123.1341 56.3676 29.4014 175.3892 31 V 4.8751 8.8764 118.3297 59.6759 36.4809 174.1192 32 S 4.8877 8.7744 116.6913 56.5650 65.1372 172.5704 33 L 4.6148 8.3941 127.1263 53.0499 43.4780 174.8662 34 N 5.8625 9.0034 122.9654 50.1125 41.9698 175.0251 *37 S 4.4198 8.4641 120.3901 58.4505 64.2123 174.5654 38 G 4.0685 9.5452 109.3025 46.4850 0.0000 173.0595 39 Y 4.5742 6.7926 115.5080 56.2585 40.1978 172.5943 40 H 4.6669 8.7261 121.2152 55.7079 30.5002 174.6286 41 F 4.9671 7.7553 120.1371 57.2011 39.9674 173.8809 42 C 4.7049 6.8310 114.8788 56.0547 45.0672 172.9066 43 G 4.3683 8.4550 108.7166 45.3194 0.0000 172.1922 44 G 4.5409 7.5883 102.9856 46.4939 0.0000 172.6691 45 S 5.5543 8.7666 115.6511 56.4221 66.8441 173.6049 46 L 4.6813 9.2734 127.5233 54.7232 42.4180 177.0536 47 I 4.3864 8.5711 119.4868 61.0161 38.7578 174.4667 48 N 4.7761 7.5902 117.4393 51.9728 39.5967 175.0515 49 S 4.3045 8.6340 112.0563 60.3745 63.2797 174.7076 50 Q 4.5631 9.2299 121.4757 55.3157 30.8359 174.2913 51 W 5.6371 8.4295 116.5214 55.4761 33.5514 174.3387 52 V 5.1899 9.1144 122.8418 61.0532 34.8617 174.3928 53 V 4.9416 8.7737 125.0950 60.5002 33.9866 174.8527 54 S 4.7713 8.9601 116.4809 57.8811 65.9924 172.1042 55 A 4.7724 8.7432 119.6388 49.8022 20.7022 178.4308 56 A 3.8427 8.2272 123.9550 55.2296 18.4798 179.1380 57 H 4.5467 8.3664 109.1500 57.0396 28.6300 175.2215 58 C 4.7626 7.7514 117.1191 57.0709 40.6008 173.4117 59 Y 4.1737 7.7885 122.0934 57.4450 38.8379 174.9015 60 K 3.6456 6.2725 123.1823 56.5111 34.3725 173.9833 61 S 4.2858 8.2146 114.3788 57.8312 65.1635 173.2318 62 G 3.5722 8.3486 105.9717 46.5908 0.0000 173.7193 63 I 4.6176 7.2026 118.5767 59.3701 40.4349 176.1633 64 Q 4.8018 8.7608 127.5736 54.2050 31.8464 174.0663 65 V 4.4834 8.9015 126.6442 61.5883 33.7316 174.5403 65A R 5.0444 8.8046 126.8891 54.6506 32.5576 174.9613 66 L 4.7504 9.0359 124.6884 52.7011 44.7962 177.3144 *69 G 4.1644 8.2536 106.5669 46.2492 0.0000 172.8317 70 E 4.6002 8.3949 118.8066 55.6699 30.3627 174.5664 71 D 4.7643 8.1496 118.7407 54.7677 44.6031 174.2650 72 N 5.2770 7.9612 120.8898 52.1808 39.1620 175.9017 73 I 3.9208 8.4325 120.1056 62.3854 37.8811 176.3290 74 N 4.7617 8.5166 117.8710 53.0565 39.2120 174.8424 75 V 4.3972 7.3390 116.7083 60.7334 34.4600 174.6738 76 V 4.2209 8.3780 126.3319 62.1948 31.9418 175.2266 77 E 4.5314 9.5201 125.6191 54.8306 31.4068 176.1461 78 G 4.0135 8.9287 106.4302 45.7380 0.0000 174.2565 79 N 4.5947 9.0181 116.6502 52.7643 36.6570 174.4229 80 E 4.6076 7.6225 117.0208 56.2758 30.8318 176.2817 81 Q 4.4016 9.0672 120.7921 54.3533 32.9684 173.9763 82 F 5.5213 8.8867 123.0039 55.9901 40.9866 175.1492 83 I 4.7154 8.7658 124.6223 59.4936 41.0806 175.5967 84 S 4.7128 8.6229 121.3126 57.9821 64.5877 173.0444 85 A 4.5194 8.1026 123.9524 52.0162 18.7214 177.7310 86 S 4.4059 9.0947 118.1492 60.4936 63.1263 174.3019 87 K 4.7705 7.5984 116.4871 55.7008 36.0036 174.6896 88 S 5.1878 8.7448 116.5932 56.9268 66.2288 173.6880 89 I 4.4790 9.2398 125.7248 59.5644 39.0067 174.9816 90 V 4.2069 8.3181 127.3820 62.0387 32.8473 175.2074 91 H 3.7880 8.5732 126.7221 56.0232 29.9878 174.4459 92 P 4.2966 0.0000 0.0000 65.4009 31.3704 177.1799 93 S 4.6980 7.9104 111.8261 58.1684 63.0012 173.3195 94 Y 4.3383 7.7832 122.2690 57.5826 39.0699 174.8109 95 N 4.5308 8.0580 125.0619 51.3716 40.3239 175.1600 96 S 3.8398 7.9681 120.7114 60.2219 63.5371 175.0045 97 N 4.4204 8.4660 119.1487 54.9172 38.6817 175.9742 98 T 4.0578 7.7215 105.8637 60.6290 70.3143 174.7821 99 L 3.8006 7.7578 120.4694 55.4713 39.6846 173.8690 100 N 4.5091 7.7273 117.1591 54.5483 39.5902 174.4654 101 N 5.0121 8.6698 119.7133 54.4284 36.0691 175.4657 102 D 4.6932 7.7459 118.0110 53.0222 40.1542 174.4655 103 I 4.9380 7.1031 120.8732 59.3120 42.4819 173.1874 104 M 5.4133 9.1862 126.3367 54.1818 36.3361 173.3004 105 L 5.3963 9.1468 124.2707 53.1418 45.0878 175.4196 106 I 5.0139 9.0014 123.2477 59.4297 40.8232 174.2619 107 K 3.8042 8.6462 128.0532 54.4437 33.9146 175.3423 108 L 4.5758 8.0881 127.2564 53.6684 42.4047 176.8833 109 K 4.1459 8.8976 124.5804 59.0988 32.5548 176.9796 110 S 4.6425 7.6896 110.9167 55.9521 66.2361 173.0372 111 A 4.4882 8.3017 122.4432 51.8819 18.8825 177.3401 112 A 4.4074 8.7913 122.9172 51.7189 20.0820 177.3112 113 S 4.6296 9.0210 116.2881 57.1399 63.7578 174.5949 114 L 4.6978 8.5028 125.4501 54.1173 43.3352 176.6365 115 N 4.6128 8.7125 119.9544 52.8944 39.6353 175.0160 116 S 4.4029 8.7510 110.1362 60.0711 63.6297 175.2625 117 R 4.2382 8.8790 120.1584 56.7096 30.7817 175.9846 118 V 4.6999 7.8070 116.8360 60.9721 33.6776 173.5392 119 A 5.1311 8.6612 128.2483 50.4821 23.0356 175.1619 120 S 5.0653 8.6717 114.1714 57.6993 64.9816 173.0039 121 I 4.5048 8.0914 120.3607 59.2349 40.1700 175.2558 122 S 4.5315 8.3122 122.4509 57.6902 63.9774 174.0103 123 L 4.4031 8.0770 122.8871 53.4393 42.4936 175.1203 124 P 4.6314 0.0000 0.0000 62.6231 32.7176 175.9740 125 T 4.2567 8.1605 107.5846 61.9789 70.2778 174.3552 *127 S 4.9303 7.5820 114.8762 58.1913 63.9911 173.9558 128 C 4.4445 8.4208 118.1475 56.6157 40.7857 173.1902 129 A 4.5081 7.9450 124.0541 51.2115 20.3385 176.6654 130 S 4.5082 7.9611 114.4024 56.7033 65.5533 173.6964 *132 A 4.2801 8.1709 123.9814 53.2954 19.2653 176.5870 133 G 4.0871 9.0160 109.1750 45.6301 0.0000 174.8205 134 T 3.9204 7.6928 116.8767 63.8334 69.4873 173.3034 135 Q 4.7267 8.5596 127.2679 55.4928 30.2395 175.2048 136 C 5.2754 9.3881 122.9063 55.1180 46.3795 172.2699 137 L 5.2343 9.0527 122.5229 53.5239 44.0626 175.0490 138 I 5.3554 9.1727 127.1305 58.7680 40.2143 174.7921 139 S 4.9365 8.9263 119.3555 56.2038 66.6294 173.0366 140 G 3.8375 7.2879 108.7282 46.0525 0.0000 172.7376 141 W 4.5761 8.4861 117.2777 56.2409 29.5022 176.9741 142 G 4.1683 8.1905 108.5599 44.0599 0.0000 173.5915 143 N 3.7901 8.6807 118.2584 54.3992 38.9374 174.4667 144 T 5.1202 8.2257 112.4880 60.4764 69.5656 174.1537 145 K 4.6507 7.8565 121.1583 54.8766 34.8089 176.0427 146 S 4.4686 8.5345 115.5440 59.2736 63.9085 174.4186 147 S 4.4111 7.8782 116.2253 56.7101 63.1467 172.1894 148 G 3.9440 8.1796 110.3702 43.6866 0.0000 170.7534 149 T 4.4959 8.2466 109.6546 59.7728 70.5759 174.1300 150 S 4.4249 9.2699 121.8066 57.0262 65.3851 171.8611 151 Y 4.9559 8.7225 125.2398 55.7203 39.7185 174.3307 152 P 4.7638 0.0000 0.0000 62.1444 33.3734 175.3813 153 D 4.6632 8.6804 117.1273 55.8015 41.6666 177.2633 154 V 5.7783 7.3816 109.7297 58.4576 34.5628 175.8079 155 L 3.1668 8.1977 124.7781 55.1531 42.8541 176.0149 156 K 4.9237 8.2369 125.2684 54.8856 35.1710 174.5994 157 C 5.2858 8.4571 119.5869 55.2811 42.2722 172.8858 158 L 4.9485 8.5422 121.7980 53.9612 45.7051 174.1416 159 K 5.1828 8.9325 125.1023 55.0158 33.7733 175.6540 160 A 4.9230 9.3771 126.1106 48.9961 23.1232 173.3223 161 P 5.0752 0.0000 0.0000 61.7496 34.0039 175.1070 162 I 4.3335 8.3280 122.6996 61.4563 38.1739 175.9781 163 L 4.8368 8.7372 127.4967 53.2115 43.6448 176.5923 164 S 4.4543 8.3647 114.3523 57.8812 64.1431 175.0634 165 D 4.4491 8.6893 121.6721 57.5544 40.5109 179.2764 166 S 4.1415 8.0070 114.4213 61.6446 63.1688 176.6625 167 S 4.1507 7.9664 118.6530 61.1113 62.5097 175.8618 168 C 4.2908 8.2426 121.2900 59.8454 39.6645 175.9487 169 K 3.9571 8.4557 120.0505 59.1979 31.3499 179.3591 170 S 4.2274 7.9387 114.5031 60.7417 62.9067 175.9578 171 A 4.0296 7.6436 123.0019 53.6247 19.7835 177.3130 172 Y 4.9249 7.8238 113.6443 55.6324 38.3231 173.7381 173 P 4.7065 0.0000 0.0000 63.6440 32.1514 177.9308 174 G 3.9888 9.0123 109.4251 45.9735 0.0000 173.6321 175 Q 4.5481 8.2667 116.8783 55.5168 29.7749 175.2368 176 I 4.5037 7.8038 119.7930 59.8137 38.7453 175.2107 177 T 4.6107 8.1963 115.0605 59.6652 71.1116 174.8017 178 S 4.5083 8.5622 113.7139 59.7138 63.1498 173.9678 179 N 5.0978 8.1479 118.3575 53.5022 39.5660 173.9334 180 M 6.0182 8.2725 117.6757 52.8410 36.3047 174.5563 181 F 5.0742 8.1735 113.7548 56.0992 41.6884 173.6229 182 C 5.5301 9.0653 116.9116 55.8097 40.1791 172.5727 183 A 5.0337 9.2106 122.1370 51.1533 22.5831 176.4550 184 G 3.7562 7.0028 106.6569 44.5643 0.0000 172.3043 184A Y 4.6241 8.3439 119.3757 55.9839 40.3750 176.5101 185 L 4.1745 8.6073 125.7899 57.0844 41.9802 178.7839 186 E 4.1167 8.2273 115.1732 56.8539 30.1247 177.1966 187 G 3.7954 7.7785 107.3095 45.0058 0.0000 171.5745 188 G 4.1931 9.3662 105.4875 44.6767 0.0000 173.7742 188A K 4.8837 7.2035 116.9928 54.6665 35.5581 175.4027 189 D 4.6088 8.6737 123.1091 54.1381 45.7548 174.7808 190 S 5.0213 8.7843 116.2482 57.7852 65.4161 173.0623 191 C 4.7555 9.3337 119.0837 55.2017 45.6812 172.1950 192 Q 4.3122 8.6611 121.1452 57.9715 28.7505 176.8414 193 G 4.2653 9.2796 112.7507 45.8762 0.0000 174.0801 194 D 4.6852 8.4560 118.5640 55.3177 41.7675 176.7377 195 S 4.4252 8.0721 115.1955 60.4163 63.5930 175.2605 196 G 4.1143 8.9354 112.3783 46.5254 0.0000 173.8802 197 G 4.5133 7.9757 107.3901 44.8906 0.0000 171.0811 198 P 5.1621 0.0000 0.0000 62.2310 33.6433 175.7770 199 V 4.5258 8.4309 121.0670 61.4319 34.2421 173.9041 200 V 4.8987 8.7638 128.7319 61.1889 34.0928 173.6512 201 C 5.1242 8.6757 124.5401 55.7303 43.8762 174.5489 202 S 3.7223 9.8210 119.5793 59.6865 60.1692 173.1114 203 G 3.9134 8.4705 103.9799 45.8992 0.0000 174.0821 204 K 4.6861 7.6190 117.5196 52.9013 35.3188 175.5600 *209 L 4.2948 8.2624 122.3471 55.4546 42.1570 175.9050 210 Q 4.5137 8.8129 125.9440 56.7533 30.8681 175.7744 211 G 5.3216 7.9970 104.4505 45.7870 0.0000 171.3788 212 I 5.1057 8.1586 119.2075 58.9295 41.2060 175.4334 213 V 3.5977 8.9178 127.4888 63.8554 31.7529 174.0189 214 S 4.9238 8.5663 121.5541 58.5271 64.5879 175.7141 215 W 5.0798 7.8679 115.8812 57.0094 31.9531 173.2872 216 G 3.9490 8.4759 106.8449 47.1591 0.0000 172.8212 217 S 4.7090 8.2171 116.4259 56.8761 63.2388 173.8636 *219 G 4.1596 8.0098 115.5217 45.5679 0.0000 171.0686 220 C 5.0207 8.1725 114.7997 56.4879 44.7691 173.7240 221 A 4.1174 9.0280 124.8830 53.1370 16.8705 176.9635 221A Q 4.5898 7.3154 116.9500 55.9489 30.0746 175.9894 222 K 4.2495 8.4193 121.8416 57.8954 32.7179 176.3418 223 N 4.2347 9.2846 121.3765 53.9400 36.9740 175.2428 224 K 4.2479 7.5423 117.7325 53.3164 32.1647 173.7260 225 P 4.5976 0.0000 0.0000 62.2296 33.0646 176.6782 226 G 3.7678 8.5134 106.9985 45.7512 0.0000 172.8634 227 V 4.4491 7.7095 121.7060 60.7192 34.0693 174.1457 228 Y 4.8633 8.1184 124.0910 56.0631 42.2124 174.8280 229 T 4.4884 8.4937 119.1245 63.4245 70.1669 174.6592 230 K 5.1303 9.2707 128.2861 55.2580 31.0634 177.1058 231 V 3.9297 8.6901 125.4729 65.9387 31.4050 174.7809 232 C 4.3368 8.3878 112.5950 58.6189 41.3699 175.0991 233 N 4.1971 8.0889 117.0505 54.7075 38.4964 175.6712 234 Y 4.7704 8.0165 117.5424 57.4913 38.7476 177.3392 235 V 3.6885 7.8744 121.2507 66.3917 31.6140 178.0144 236 S 4.1580 8.1117 114.3137 61.1100 62.7209 176.2441 237 W 4.1423 8.2601 130.5985 60.5448 30.4900 177.7152 238 I 3.1241 8.2100 119.8249 64.2900 36.5969 178.4468 239 K 3.7361 7.9642 118.9622 59.5401 31.9101 179.4684 240 Q 3.8495 8.2879 118.4146 59.2253 28.4502 178.7989 241 T 3.5495 7.4118 115.5390 66.7117 68.5447 176.4079 242 I 2.7978 7.3892 121.6018 63.8830 36.7211 178.3940 243 A 4.0011 7.7200 120.9964 54.3175 18.2100 178.7670 244 S 4.6122 7.5534 110.0867 58.3523 63.5405 174.1362 245 N 4.6818 7.9033 125.4431 53.8677 39.2810 174.0224 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 16 I 7.88 4.30 1.80 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 1.38 0.88 0.93 0.00 0.00 17 V 8.49 4.43 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 1.03 0.00 0.00 0.95 0.00 0.00 18 G 8.40 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 19 G 7.73 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 0.00 0.00 0.00 20 Y 7.80 4.96 0.00 2.91 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 21 T 8.57 4.34 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 1.23 0.00 0.00 22 C 8.69 4.35 0.00 2.76 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 23 G 8.59 4.06 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 0.00 0.00 0.00 24 A 8.60 4.18 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 25 N 8.81 4.25 0.00 2.84 2.90 0.00 0.00 7.30 7.57 0.00 0.00 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 T 7.59 4.19 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 1.34 0.00 0.00 27 V 7.08 4.06 1.76 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 0.33 0.00 0.00 0.77 0.00 0.00 28 P 0.00 4.57 0.00 2.39 2.46 0.00 3.83 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.96 0.00 29 Y 6.70 4.98 0.00 3.17 3.37 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 30 Q 7.25 4.64 0.00 1.80 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.53 0.00 0.00 0.00 0.00 0.00 1.91 2.48 0.00 31 V 8.88 4.88 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 0.81 0.00 0.00 0.99 0.00 0.00 32 S 8.77 4.89 0.00 3.01 3.29 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 33 L 8.39 4.61 0.00 0.46 0.98 0.77 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 34 N 9.00 5.86 0.00 2.42 2.45 0.00 0.00 6.53 7.94 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 *37 S 8.46 4.42 0.00 3.78 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 38 G 9.55 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 39 Y 6.79 4.57 0.00 3.06 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 40 H 8.73 4.67 0.00 2.85 3.16 0.00 5.86 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 F 7.76 4.97 0.00 3.03 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 42 C 6.83 4.70 0.00 2.21 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 43 G 8.46 4.37 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 0.00 44 G 7.59 4.54 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 45 S 8.77 5.55 0.00 3.81 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 L 9.27 4.68 0.00 1.85 1.68 1.08 0.81 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 47 I 8.57 4.39 1.90 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 1.56 0.91 0.95 0.00 0.00 48 N 7.59 4.78 0.00 3.00 3.00 0.00 0.00 6.16 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 49 S 8.63 4.30 0.00 4.05 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Q 9.23 4.56 0.00 2.07 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.89 0.00 0.00 0.00 0.00 0.00 2.18 2.22 0.00 51 W 8.43 5.64 0.00 3.32 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 52 V 9.11 5.19 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 1.17 0.00 0.00 0.98 0.00 0.00 53 V 8.77 4.94 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 0.84 0.00 0.00 1.02 0.00 0.00 54 S 8.96 4.77 0.00 3.88 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 55 A 8.74 4.77 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 56 A 8.23 3.84 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 H 8.37 4.55 0.00 3.36 3.54 0.00 5.55 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 58 C 7.75 4.76 0.00 3.22 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 59 Y 7.79 4.17 0.00 2.99 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 60 K 6.27 3.65 0.00 1.52 1.39 0.00 0.66 0.00 0.00 1.28 0.00 0.00 2.49 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.73 0.91 7.81 61 S 8.21 4.29 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 62 G 8.35 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.20 4.62 1.84 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 1.40 1.18 0.91 0.00 0.00 64 Q 8.76 4.80 0.00 2.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.09 2.21 0.00 65 V 8.90 4.48 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 0.93 0.00 0.00 0.89 0.00 0.00 65A R 8.80 5.04 0.00 1.63 1.69 0.00 2.66 0.00 0.00 2.34 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.16 0.00 66 L 9.04 4.75 0.00 1.62 1.61 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 *69 G 8.25 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 70 E 8.39 4.60 0.00 2.05 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 2.36 2.07 0.00 71 D 8.15 4.76 0.00 2.71 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 72 N 7.96 5.28 0.00 2.82 2.73 0.00 0.00 6.77 7.86 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 73 I 8.43 3.92 1.47 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.58 -0.47 0.00 0.00 74 N 8.52 4.76 0.00 2.83 2.88 0.00 0.00 6.65 8.79 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 75 V 7.34 4.40 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 0.73 0.00 0.00 0.99 0.00 0.00 76 V 8.38 4.22 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 0.97 0.00 0.00 77 E 9.52 4.53 0.00 1.95 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.40 0.00 78 G 8.93 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 0.00 0.00 0.00 79 N 9.02 4.59 0.00 2.94 3.12 0.00 0.00 6.95 7.67 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 80 E 7.62 4.61 0.00 1.57 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 0.00 2.61 2.45 0.00 81 Q 9.07 4.40 0.00 1.99 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.89 5.52 0.00 2.77 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 83 I 8.77 4.72 1.87 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 1.25 0.75 0.95 0.00 0.00 84 S 8.62 4.71 0.00 3.75 3.74 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 85 A 8.10 4.52 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 S 9.09 4.41 0.00 3.73 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 87 K 7.60 4.77 0.00 1.86 1.84 0.00 1.61 0.00 0.00 1.93 0.00 0.00 2.85 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.31 1.39 7.81 88 S 8.74 5.19 0.00 4.11 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 89 I 9.24 4.48 2.06 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.93 1.10 0.00 0.00 90 V 8.32 4.21 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 0.61 0.00 0.00 0.76 0.00 0.00 91 H 8.57 3.79 0.00 2.89 3.08 0.00 5.65 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 P 0.00 4.30 0.00 2.05 2.13 0.00 3.12 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.21 0.00 93 S 7.91 4.70 0.00 3.91 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 94 Y 7.78 4.34 0.00 2.98 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 95 N 8.06 4.53 0.00 2.60 2.44 0.00 0.00 6.58 6.88 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 96 S 7.97 3.84 0.00 3.93 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 97 N 8.47 4.42 0.00 2.71 2.79 0.00 0.00 6.76 7.27 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 98 T 7.72 4.06 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 1.15 0.00 0.00 99 L 7.76 3.80 0.00 1.54 1.92 0.69 0.98 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 0.00 100 N 7.73 4.51 0.00 2.77 2.65 0.00 0.00 7.29 8.01 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 0.00 101 N 8.67 5.01 0.00 3.05 2.65 0.00 0.00 7.22 8.27 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 0.00 102 D 7.75 4.69 0.00 3.21 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 0.00 103 I 7.10 4.94 1.46 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.24 0.17 0.00 0.00 104 M 9.19 5.41 0.00 2.22 1.82 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.64 0.00 105 L 9.15 5.40 0.00 1.80 1.85 0.23 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 106 I 9.00 5.01 1.91 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.81 0.88 0.00 0.00 107 K 8.65 3.80 0.00 0.79 1.10 0.00 1.22 0.00 0.00 1.34 0.00 0.00 2.60 0.00 0.00 2.79 0.00 0.00 0.00 0.00 0.63 0.21 7.81 108 L 8.09 4.58 0.00 1.50 1.54 0.97 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.90 4.15 0.00 1.74 1.80 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.35 7.81 110 S 7.69 4.64 0.00 3.93 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.30 4.49 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 A 8.79 4.41 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 0.00 113 S 9.02 4.63 0.00 3.74 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 0.00 114 L 8.50 4.70 0.00 1.66 1.70 0.96 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 115 N 8.71 4.61 0.00 2.73 2.69 0.00 0.00 6.96 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 0.00 116 S 8.75 4.40 0.00 4.01 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 0.00 117 R 8.88 4.24 0.00 2.06 2.02 0.00 3.12 0.00 0.00 3.10 7.39 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.58 4.93 0.00 4.00 3.97 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 0.00 128 C 8.42 4.44 0.00 2.94 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 0.00 129 A 7.95 4.51 1.04 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 0.00 130 S 7.96 4.51 0.00 3.81 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *132 A 8.17 4.28 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 0.00 133 G 9.02 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 0.00 0.00 0.00 0.00 134 T 7.69 3.92 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 1.14 0.00 0.00 135 Q 8.56 4.73 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.91 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 136 C 9.39 5.28 0.00 2.76 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 0.00 137 L 9.05 5.23 0.00 1.75 1.56 1.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.17 5.36 1.88 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.78 1.61 1.00 0.00 0.00 139 S 8.93 4.94 0.00 3.49 3.58 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 0.00 140 G 7.29 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.49 4.58 0.00 3.12 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 0.00 142 G 8.19 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 0.00 0.00 0.00 0.00 143 N 8.68 3.79 0.00 2.24 2.65 0.00 0.00 6.99 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 T 8.23 5.12 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 1.27 0.00 0.00 145 K 7.86 4.65 0.00 1.87 1.69 0.00 1.71 0.00 0.00 1.71 0.00 0.00 3.05 0.00 0.00 3.31 0.00 0.00 0.00 0.00 1.30 1.32 7.81 146 S 8.53 4.47 0.00 3.98 4.06 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 0.00 147 S 7.88 4.41 0.00 3.83 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 0.00 148 G 8.18 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 0.00 0.00 0.00 149 T 8.25 4.50 4.45 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 1.31 0.00 0.00 150 S 9.27 4.42 0.00 3.76 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 0.00 151 Y 8.72 4.96 0.00 2.95 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 0.00 152 P 0.00 4.76 0.00 2.43 2.11 0.00 4.18 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.04 0.00 153 D 8.68 4.66 0.00 2.80 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 0.00 154 V 7.38 5.78 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 0.84 0.00 0.00 0.97 0.00 0.00 155 L 8.20 3.17 0.00 1.13 1.27 -0.73 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.24 4.92 0.00 1.67 1.50 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.43 1.47 7.81 157 C 8.46 5.29 0.00 1.64 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 0.00 0.00 0.00 0.00 158 L 8.54 4.95 0.00 1.71 1.45 1.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 159 K 8.93 5.18 0.00 1.82 1.82 0.00 1.87 0.00 0.00 1.77 0.00 0.00 2.78 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.64 7.81 160 A 9.38 4.92 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 0.00 161 P 0.00 5.08 0.00 2.02 2.28 0.00 3.17 0.00 0.00 3.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.79 0.00 162 I 8.33 4.33 1.85 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.50 0.70 0.00 0.00 163 L 8.74 4.84 0.00 1.53 1.61 0.92 0.75 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 0.00 164 S 8.36 4.45 0.00 4.00 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 0.00 165 D 8.69 4.45 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 0.00 166 S 8.01 4.14 0.00 4.05 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 0.00 167 S 7.97 4.15 0.00 3.86 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 0.00 168 C 8.24 4.29 0.00 3.20 3.32 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 0.00 169 K 8.46 3.96 0.00 1.96 1.89 0.00 1.75 0.00 0.00 1.69 0.00 0.00 2.99 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.66 7.81 170 S 7.94 4.23 0.00 3.89 3.91 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 0.00 171 A 7.64 4.03 1.10 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 0.00 172 Y 7.82 4.92 0.00 3.10 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 0.00 173 P 0.00 4.71 0.00 2.21 2.11 0.00 3.58 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.96 0.00 174 G 9.01 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 0.00 175 Q 8.27 4.55 0.00 2.44 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.95 0.00 0.00 0.00 0.00 0.00 2.31 2.56 0.00 176 I 7.80 4.50 1.98 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 1.87 0.98 1.00 0.00 0.00 177 T 8.20 4.61 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 1.25 0.00 0.00 178 S 8.56 4.51 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 0.00 179 N 8.15 5.10 0.00 2.89 3.09 0.00 0.00 6.70 9.17 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 0.00 180 M 8.27 6.02 0.00 1.77 1.98 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.64 2.43 0.00 181 F 8.17 5.07 0.00 2.96 3.08 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 0.00 182 C 9.07 5.53 0.00 2.99 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 0.00 183 A 9.21 5.03 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 0.00 184 G 7.00 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 184A Y 8.34 4.62 0.00 3.00 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 0.00 185 L 8.61 4.17 0.00 1.73 1.73 0.91 0.86 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 0.00 186 E 8.23 4.12 0.00 2.10 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 0.00 2.32 2.26 0.00 187 G 7.78 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 G 9.37 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 188A K 7.20 4.88 0.00 1.43 1.65 0.00 0.91 0.00 0.00 1.40 0.00 0.00 2.44 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.20 1.16 7.81 189 D 8.67 4.61 0.00 2.81 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 0.00 190 S 8.78 5.02 0.00 4.00 4.02 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 0.00 191 C 9.33 4.76 0.00 2.93 3.08 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 0.00 192 Q 8.66 4.31 0.00 2.23 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.16 5.44 0.00 0.00 0.00 0.00 0.00 2.62 2.51 0.00 193 G 9.28 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 0.00 0.00 0.00 0.00 194 D 8.46 4.69 0.00 2.99 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 0.00 195 S 8.07 4.43 0.00 3.99 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 0.00 196 G 8.94 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 0.00 0.00 0.00 197 G 7.98 4.51 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 0.00 198 P 0.00 5.16 0.00 2.33 2.35 0.00 3.70 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 2.24 2.24 0.00 199 V 8.43 4.53 2.28 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 0.81 0.00 0.00 0.71 0.00 0.00 200 V 8.76 4.90 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 0.69 0.00 0.00 0.62 0.00 0.00 201 C 8.68 5.12 0.00 2.81 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 0.00 202 S 9.82 3.72 0.00 3.94 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 0.00 203 G 8.47 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 204 K 7.62 4.69 0.00 1.71 1.64 0.00 1.89 0.00 0.00 1.63 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.40 7.81 *209 L 8.26 4.29 0.00 1.51 1.64 1.00 0.75 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 0.00 210 Q 8.81 4.51 0.00 2.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.70 6.33 0.00 0.00 0.00 0.00 0.00 2.41 2.34 0.00 211 G 8.00 5.32 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 0.00 212 I 8.16 5.11 1.91 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 1.29 0.97 1.00 0.00 0.00 213 V 8.92 3.60 2.29 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 0.91 0.00 0.00 1.20 0.00 0.00 214 S 8.57 4.92 0.00 3.88 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 0.00 215 W 7.87 5.08 0.00 3.36 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.48 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 0.00 217 S 8.22 4.71 0.00 4.07 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 *219 G 8.01 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 0.00 220 C 8.17 5.02 0.00 2.95 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 0.00 221 A 9.03 4.12 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 221A Q 7.32 4.59 0.00 2.07 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 6.95 0.00 0.00 0.00 0.00 0.00 2.50 2.47 0.00 222 K 8.42 4.25 0.00 1.72 1.72 0.00 1.94 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.54 7.81 223 N 9.28 4.23 0.00 2.82 2.82 0.00 0.00 6.77 7.64 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 0.00 224 K 7.54 4.25 0.00 1.76 1.83 0.00 1.72 0.00 0.00 1.40 0.00 0.00 2.98 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.50 7.81 225 P 0.00 4.60 0.00 2.13 2.11 0.00 3.59 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 1.98 0.00 226 G 8.51 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 V 7.71 4.45 0.67 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 0.34 0.00 0.00 -0.76 0.00 0.00 228 Y 8.12 4.86 0.00 1.43 2.34 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 0.00 229 T 8.49 4.49 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 1.21 0.00 0.00 230 K 9.27 5.13 0.00 2.09 1.91 0.00 1.82 0.00 0.00 1.79 0.00 0.00 2.90 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.55 1.68 7.81 231 V 8.69 3.93 2.25 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 1.16 0.00 0.00 1.12 0.00 0.00 232 C 8.39 4.34 0.00 3.17 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 233 N 8.09 4.20 0.00 2.38 2.40 0.00 0.00 7.00 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 0.00 234 Y 8.02 4.77 0.00 3.09 3.22 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 0.00 235 V 7.87 3.69 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 1.04 0.00 0.00 1.15 0.00 0.00 236 S 8.11 4.16 0.00 3.97 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 0.00 237 W 8.26 4.14 0.00 3.49 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 0.00 238 I 8.21 3.12 2.03 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.08 0.77 0.00 0.00 239 K 7.96 3.74 0.00 1.89 1.78 0.00 1.73 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 1.39 1.57 7.81 240 Q 8.29 3.85 0.00 1.94 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.78 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 241 T 7.41 3.55 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 242 I 7.39 2.80 1.41 0.00 0.00 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.60 0.37 0.00 0.00 243 A 7.72 4.00 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 0.00 244 S 7.55 4.61 0.00 4.03 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 0.00 245 N 7.90 4.68 0.00 3.00 3.03 0.00 0.00 6.75 9.04 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 * Residues marked with a * may have inaccurate shift predictions.