NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 S 4.3991 8.3349 115.4069 58.2543 64.3125 172.4200 4 R 4.3348 8.2124 118.4503 55.3446 31.5355 175.0587 5 I 4.0571 9.2167 125.3282 60.5424 38.8025 173.5952 6 P 4.9631 0.0000 0.0000 62.5781 32.6711 175.5180 7 V 5.0241 9.1689 123.3100 61.1272 35.3393 174.1052 8 V 4.9608 8.8250 126.4815 61.1613 34.4785 173.9251 9 L 5.1389 9.0866 127.7946 53.1113 44.0065 175.0115 10 L 5.1408 9.0579 125.9153 53.2166 44.7482 174.6136 11 A 5.1659 9.3073 128.8275 49.8585 20.9986 175.2894 12 C 5.3265 9.3715 120.0120 57.2995 30.9896 174.1291 13 G 3.6616 8.0726 107.6112 44.8332 0.0000 173.7011 14 S 3.9422 7.8355 115.1783 60.7061 63.1993 175.0242 15 F 3.7500 7.1945 116.8014 58.9677 36.2473 175.2832 16 N 5.3693 7.6847 118.4745 51.4157 39.0957 170.5363 17 P 5.0496 0.0000 0.0000 60.0841 34.0067 175.9178 18 I 4.1781 8.2369 118.8525 61.2702 38.5333 175.1299 19 T 4.7585 8.3915 116.1025 59.4764 72.9335 174.8214 20 N 4.5043 8.9256 120.7793 57.1699 38.3775 178.4500 21 M 4.1482 7.9830 121.6527 59.9669 31.3618 181.9245 22 H 4.6325 7.8565 115.9448 58.8619 29.1509 177.6669 23 L 4.2921 8.0023 120.4415 57.7615 41.4365 179.3208 24 R 4.0119 8.4699 119.0825 59.6077 29.9623 177.9468 25 M 4.0124 8.3160 118.0449 58.8990 32.0387 178.3377 26 F 4.1663 8.3344 117.2410 60.6243 39.1479 177.5248 27 E 4.2989 8.5541 117.7971 59.5493 29.4044 179.4460 28 V 3.6271 8.3074 118.3393 65.9520 31.5892 177.9124 29 A 4.0155 8.1678 120.5279 55.0896 18.1664 179.5786 30 R 3.6534 8.4119 117.4699 59.7067 30.0907 178.4565 31 D 4.2848 8.0860 118.6519 57.4774 40.5400 178.3374 32 H 4.0893 8.0747 117.7267 59.3728 30.1170 176.9792 33 L 4.1692 8.0527 120.7919 58.2442 41.3810 179.3569 34 H 4.3354 8.4438 116.2633 58.9615 28.4223 177.8743 35 Q 4.0729 8.2015 119.1764 58.6067 28.5696 178.3223 36 T 4.0656 7.5393 110.0122 62.5106 69.0182 175.8337 37 G 3.9246 8.1579 109.5465 45.7564 0.0000 173.6093 38 M 4.4461 7.8220 116.0066 54.9937 32.6179 174.9784 39 Y 5.2981 7.7650 116.0318 56.3718 42.2663 174.9074 40 Q 4.4216 9.2051 122.6283 54.2715 32.0668 174.3919 41 V 4.4744 8.8428 127.9777 62.8731 31.5388 175.5040 42 I 4.3898 8.6739 121.9420 61.6298 38.9365 175.3828 43 Q 5.0653 7.8895 121.7252 55.4579 32.3818 172.5519 44 G 4.4079 8.9898 111.2539 44.3958 0.0000 171.6558 45 I 4.9512 9.3347 124.2190 59.3148 40.7200 174.4300 46 I 4.3924 8.4528 128.6837 60.0099 38.9508 174.7952 47 S 4.9539 9.0417 123.1880 55.3230 63.4642 170.7484 48 P 5.1641 0.0000 0.0000 62.1890 31.8535 176.6856 49 V 4.1025 8.5228 123.7457 61.3539 32.2412 175.8038 50 N 4.5216 8.8634 120.4922 53.8042 39.4653 175.7272 51 D 4.5424 8.6112 123.0550 57.1445 41.1331 177.8364 52 T 4.1059 8.4373 108.4886 63.1522 69.2171 174.5538 53 Y 3.8249 7.7949 123.9581 58.4664 39.3582 176.6139 54 G 2.7938 6.5903 112.1986 46.4331 0.0000 172.5025 55 K 3.9793 8.0302 116.2744 58.7826 32.5312 177.9929 56 K 3.6520 7.7574 116.1804 57.0155 32.3095 176.1416 57 D 4.5596 8.5165 122.5055 53.2477 40.7046 175.6222 58 L 4.7532 8.1353 126.3053 52.9124 43.3529 176.8684 59 A 4.0536 8.4862 123.3942 51.8666 19.1513 178.1303 60 A 4.1424 8.5489 121.7082 52.4783 20.2084 179.3983 61 S 4.1518 9.3044 118.2277 61.6731 63.0506 176.5648 62 H 3.9912 8.2366 121.5011 59.6967 29.4597 176.7636 63 H 4.3282 8.0505 117.3024 58.8968 28.6865 177.8883 64 R 3.9782 8.0768 120.0228 59.1351 29.7807 179.3186 65 V 3.4929 8.1401 118.2985 65.7539 31.4328 177.9877 66 A 3.7432 7.5335 120.1270 55.3696 18.0802 179.5395 67 M 3.6965 7.9495 117.3116 58.2533 31.9538 178.9195 68 A 3.8230 7.8503 120.9836 54.9496 18.3106 179.5080 69 R 3.7026 7.7709 116.3116 59.6748 30.3251 178.4290 70 L 4.0664 8.0384 118.6044 57.7296 41.3739 179.3558 71 A 4.0116 8.0644 120.1141 54.7132 18.6285 178.7166 72 L 4.1874 7.7127 115.3296 55.0913 41.6636 178.4858 73 Q 4.0101 7.6816 121.1253 58.8235 28.9422 176.7225 74 T 4.3937 7.5298 107.4311 61.2367 69.1775 173.7010 75 S 4.7335 7.7251 116.7532 57.1156 63.8529 173.4023 76 D 4.9181 8.8241 125.3098 52.9809 39.7000 176.5159 77 W 5.2695 7.6948 114.4626 55.9882 30.8600 174.1258 78 I 4.3900 7.1561 122.0964 59.2380 38.3590 175.1958 79 R 4.6618 8.5964 122.5925 54.2023 33.2785 174.3497 80 V 4.4027 8.0814 119.3582 60.5832 33.3063 174.8178 81 D 4.9487 8.7599 123.3337 51.6460 43.0670 174.3997 82 P 4.4817 0.0000 0.0000 63.5674 31.4739 177.5467 83 W 4.3767 8.4437 129.1708 61.0211 30.6688 176.7604 84 E 3.7032 8.6072 118.5344 59.2955 28.9480 178.6430 85 S 4.2159 7.9499 111.6703 60.4284 63.4641 175.0580 86 E 4.1753 7.4832 120.5322 56.2694 29.9058 176.6686 87 Q 3.8455 6.6041 118.2583 55.0065 29.4794 175.8789 88 A 4.0802 8.5298 124.3649 55.0647 18.3673 177.5921 89 Q 4.6078 7.4194 109.9245 53.6905 31.8967 173.9454 90 W 4.3473 8.9083 128.6694 58.2066 31.0778 174.8139 91 M 4.1879 6.9417 122.3966 52.9277 34.9144 175.0423 92 E 3.3911 7.5887 123.8494 56.0584 30.7316 177.8946 93 T 3.8818 8.7202 119.4304 67.1384 68.5629 177.0006 94 V 3.5838 7.8957 120.1476 64.9752 31.2009 178.4130 95 K 4.0165 7.9401 118.8162 59.0178 31.8393 179.5648 96 V 3.7755 7.6705 118.3356 65.7935 31.4818 177.9032 97 L 3.7077 7.7686 118.7815 57.6891 41.2195 179.6502 98 R 4.0800 7.8110 117.8893 59.4697 30.0378 178.4983 99 H 3.7431 8.0237 117.8145 59.6939 29.7490 177.1595 100 H 3.9696 8.0038 117.6440 58.6003 28.1900 177.4273 101 H 4.2005 8.3227 120.1404 59.4036 29.9871 177.0795 102 S 4.1788 8.2606 117.2509 61.4685 62.3834 176.5468 103 K 3.7491 7.5375 121.3033 59.4371 32.0045 178.3254 104 L 4.1705 7.4369 116.4163 55.0284 41.8185 176.7419 105 L 4.2755 7.2918 120.0726 53.2585 43.0827 177.0826 *126 A 4.1205 8.2272 127.1128 51.9336 19.7155 176.4215 127 V 4.2662 7.4620 120.5908 60.7939 33.4461 173.5277 128 P 4.6737 0.0000 0.0000 62.8865 32.5169 175.2206 129 E 4.4831 9.1826 121.2617 55.5846 31.0652 175.1362 130 L 5.0100 8.7129 126.7705 53.7929 43.3421 175.5081 131 K 4.9380 9.0291 125.9573 54.3070 35.8620 175.2337 132 L 4.5563 8.9212 126.7661 54.8541 43.5568 175.0390 133 L 5.1658 9.1449 129.2521 53.5556 44.3182 174.8477 134 C 4.6429 8.7373 119.7699 57.3747 33.8327 173.4464 135 G 4.0921 8.4849 107.7257 44.3864 0.0000 174.7955 136 A 4.0784 8.4852 122.0375 54.6995 17.9495 180.0213 137 D 4.0132 7.7810 116.9736 56.4625 39.8030 178.5086 138 V 3.6254 7.6308 119.6168 65.5875 31.3783 177.7835 139 L 3.1538 7.4993 119.6402 57.6372 42.0348 178.7056 140 K 3.1105 7.5681 119.4569 58.9092 32.0333 178.6584 141 T 4.0916 7.5346 109.6028 63.9450 68.4791 176.3402 142 F 4.3308 7.2256 120.6378 60.7432 38.8646 177.0362 143 Q 4.2299 7.8586 116.3832 57.4809 28.7212 177.0257 144 T 3.9465 7.5736 117.8303 62.9031 68.9696 171.8740 145 P 4.3450 0.0000 0.0000 64.0300 31.7119 175.7689 146 N 4.2888 8.8448 119.1267 54.4291 36.1772 174.9589 147 L 4.3529 7.9096 119.9656 56.1886 43.0170 176.5131 148 W 4.9004 8.0202 116.0458 54.4967 31.9875 175.3454 149 K 4.3429 8.5847 121.1804 55.8637 32.6678 177.6629 150 D 4.3531 9.0793 123.4079 57.8546 40.7205 179.2222 151 A 4.0249 7.9826 120.3669 55.3440 18.2991 179.3114 152 H 4.3577 8.4617 115.1504 58.9880 28.8530 177.9497 153 I 3.1864 7.7024 121.1777 64.1981 36.8422 178.0678 154 Q 3.8089 8.1103 120.3344 59.1918 28.8479 177.8984 155 E 3.9163 8.3025 120.3140 59.1798 29.6285 178.8548 156 I 3.9738 8.1114 120.1694 64.7570 37.0618 178.8598 157 V 3.9162 7.6081 111.3393 63.4646 31.4421 177.8992 158 E 4.0939 8.1619 118.8417 58.4428 29.8837 177.4046 159 K 3.9246 7.9387 116.3111 57.2948 32.2651 176.3354 160 F 4.6803 7.7227 113.9215 57.3817 41.8504 174.5554 161 G 4.2953 8.1047 106.3672 43.5519 0.0000 172.1757 162 L 5.1446 9.0110 122.2296 53.0106 45.8866 175.2273 163 V 4.7171 8.9361 126.2156 61.3885 34.0359 173.4274 164 C 5.2538 9.0264 129.4516 57.6473 33.8995 172.4706 165 V 4.6114 8.6577 126.9911 61.2448 32.8206 175.5399 166 G 4.1767 8.6193 115.2023 46.7379 0.0000 173.1036 167 R 4.8999 8.3064 119.5206 53.6359 34.3073 175.1102 168 V 3.7245 8.5026 123.9296 65.3784 31.8475 177.3096 *169 S 4.3953 9.0165 121.9327 58.0535 60.3914 166.4851 170 H 5.2171 7.6963 114.7232 54.2347 31.2003 174.0864 171 D 4.6177 7.4554 121.5865 50.5266 41.1036 173.8584 172 P 4.0689 0.0000 0.0000 65.2917 31.7117 177.6465 173 K 3.9759 7.9559 116.4941 59.5284 31.9804 179.4756 174 G 3.5447 7.7465 105.8055 47.8699 0.0000 175.3452 175 Y 4.4610 7.5644 119.1868 61.0691 37.7481 178.9589 176 I 3.7923 8.1088 120.4951 64.4349 37.0374 178.4527 177 A 4.0653 7.9569 120.3005 54.5878 18.2671 178.5164 178 E 4.5190 8.0672 114.5501 55.4516 30.1797 175.9043 179 S 4.6900 7.4586 115.5780 55.5240 64.1493 172.7578 180 P 4.4372 0.0000 0.0000 65.6996 30.8869 178.7874 181 I 3.7705 7.6214 118.2472 64.3111 36.9575 178.2862 182 L 3.9938 7.3940 118.3222 57.6148 41.6197 179.0961 183 R 4.0200 8.5344 119.0608 59.8022 29.8202 178.2890 184 M 4.0839 7.9389 116.5280 57.8322 32.3105 176.2649 185 H 4.7354 7.6015 116.0175 55.1284 29.7341 176.1635 186 Q 3.9810 7.7798 120.8433 58.9783 28.4359 178.2120 187 H 4.2751 7.7938 113.3833 57.9230 28.8600 175.6022 188 N 4.7558 8.2596 116.9693 52.8521 38.5718 173.6554 189 I 4.7796 7.4426 120.0633 59.8166 39.4967 174.6963 190 H 4.8319 9.4556 125.2802 54.0254 30.8760 173.7108 191 L 4.8277 8.5860 124.1909 53.6496 42.4436 176.0557 192 A 4.7871 8.5619 126.6472 50.1596 22.0674 175.0085 193 K 4.7973 8.0961 116.9382 56.3622 35.0416 174.4088 194 E 4.8069 8.5640 118.1536 53.9487 32.5271 175.2921 195 P 4.5218 0.0000 0.0000 62.4958 30.5614 176.4811 196 V 4.1942 7.6411 117.7235 60.9935 33.4030 174.7575 197 Q 4.2443 8.6238 129.0372 55.3159 28.1675 174.4047 198 N 4.9647 8.2665 124.6396 51.6246 38.6758 174.5705 199 E 4.4116 7.8281 119.4344 54.2675 28.9483 173.8660 200 I 4.4024 7.8466 121.7871 59.1705 39.5645 175.8966 201 S 4.7988 8.3901 120.2903 56.6214 66.1290 175.1269 202 A 4.0104 8.5172 125.8116 55.4317 18.1349 180.2084 203 T 3.7737 7.9042 114.0934 66.9985 68.5025 175.8099 204 Y 4.0273 8.0417 121.2411 60.6746 38.7856 177.8982 205 I 3.4611 7.7543 120.6631 64.6463 37.1828 178.4986 206 R 3.5841 8.0309 118.8492 59.0865 29.9763 179.1389 207 R 3.7649 7.7972 118.1773 59.2691 30.0690 178.3707 208 A 3.9086 7.6749 120.7601 55.1805 18.3446 179.5602 209 L 3.9956 7.9384 117.6524 57.9527 41.4637 180.0965 210 G 3.7048 8.1350 104.7834 47.0992 0.0000 174.7177 211 Q 4.4824 7.6104 117.5524 55.0865 29.0356 176.4420 212 G 3.8730 7.7934 107.9702 45.9673 0.0000 174.1084 213 Q 4.3482 7.7958 118.2729 54.5319 29.8568 175.5784 214 S 4.4175 8.2845 114.1022 58.3702 63.3310 174.0846 215 V 4.4701 8.0319 117.7410 60.6758 32.7117 175.3592 216 K 3.9481 7.7688 121.5344 57.9509 32.2181 176.8455 217 Y 3.9265 8.1638 121.1432 58.4051 35.8342 169.6700 218 L 4.6151 8.0502 120.3997 55.0374 43.4299 176.3592 219 I 5.0641 7.2652 109.0834 57.7611 40.9139 173.1620 220 P 4.3854 0.0000 0.0000 62.7947 32.0327 177.3329 221 D 4.3184 8.8936 121.3077 57.7321 40.5883 179.2594 222 A 4.0739 7.9483 120.5615 54.9393 18.3407 179.7258 223 V 3.6453 7.7478 117.1228 66.0820 31.5854 178.3205 224 I 3.7461 7.7375 119.1648 64.6672 36.9358 178.2990 225 T 3.8701 7.9579 116.5789 66.8107 68.3141 176.0557 226 Y 3.9943 7.9278 121.2300 60.7507 38.8378 178.0342 227 I 3.8232 8.2073 120.9170 64.2022 37.3393 178.4076 228 K 3.9077 8.2631 120.4114 59.7786 31.9272 178.6725 229 D 4.3262 8.2116 118.0104 56.7678 40.6723 177.6134 230 H 4.6243 7.7687 113.8020 53.8774 29.7208 174.5393 231 G 3.9317 7.5684 108.1916 46.4482 0.0000 173.9684 232 L 4.1425 7.7968 117.5586 54.3096 43.0828 176.6704 233 Y 3.6781 7.6490 114.5582 59.5386 35.4275 170.7164 234 T 4.1431 7.2989 118.8831 63.9760 68.5244 174.8229 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 3 S 8.33 4.40 0.00 3.97 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 4 R 8.21 4.33 0.00 1.77 1.76 0.00 3.15 0.00 0.00 3.39 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 5 I 9.22 4.06 1.94 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 1.24 0.65 1.13 0.00 0.00 6 P 0.00 4.96 0.00 2.12 2.00 0.00 3.59 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.10 0.00 7 V 9.17 5.02 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 8 V 8.82 4.96 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 1.14 0.00 0.00 1.00 0.00 0.00 9 L 9.09 5.14 0.00 1.94 1.60 1.18 0.61 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 10 L 9.06 5.14 0.00 1.70 1.49 0.92 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 11 A 9.31 5.17 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 12 C 9.37 5.33 0.00 2.94 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 13 G 8.07 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 7.84 3.94 0.00 3.78 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 15 F 7.19 3.75 0.00 3.25 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 16 N 7.68 5.37 0.00 2.73 2.75 0.00 0.00 7.26 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 17 P 0.00 5.05 0.00 2.29 2.22 0.00 3.21 0.00 0.00 2.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.71 0.00 18 I 8.24 4.18 1.94 0.00 0.00 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 1.58 1.05 0.92 0.00 0.00 19 T 8.39 4.76 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 1.26 0.00 0.00 20 N 8.93 4.50 0.00 2.92 2.96 0.00 0.00 7.56 7.26 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 21 M 7.98 4.15 0.00 2.02 2.07 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.20 0.00 22 H 7.86 4.63 0.00 3.49 3.75 0.00 5.64 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 L 8.00 4.29 0.00 1.89 1.73 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 24 R 8.47 4.01 0.00 2.07 2.17 0.00 3.25 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.75 0.00 25 M 8.32 4.01 0.00 2.40 2.18 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 26 F 8.33 4.17 0.00 3.34 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 27 E 8.55 4.30 0.00 2.27 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 0.00 2.81 2.48 0.00 28 V 8.31 3.63 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 1.03 0.00 0.00 1.08 0.00 0.00 29 A 8.17 4.02 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 R 8.41 3.65 0.00 1.54 1.85 0.00 2.32 0.00 0.00 2.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 1.06 0.00 31 D 8.09 4.28 0.00 2.76 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 32 H 8.07 4.09 0.00 3.15 3.51 0.00 5.96 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 33 L 8.05 4.17 0.00 1.81 1.72 0.73 0.51 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 34 H 8.44 4.34 0.00 3.27 3.30 0.00 5.64 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 35 Q 8.20 4.07 0.00 2.25 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.98 0.00 0.00 0.00 0.00 0.00 2.40 2.37 0.00 36 T 7.54 4.07 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 1.31 0.00 0.00 37 G 8.16 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 38 M 7.82 4.45 0.00 1.85 1.82 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 2.21 0.00 39 Y 7.77 5.30 0.00 3.01 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 40 Q 9.21 4.42 0.00 2.04 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.01 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 41 V 8.84 4.47 1.81 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 0.93 0.00 0.00 0.85 0.00 0.00 42 I 8.67 4.39 1.93 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.87 0.99 0.00 0.00 43 Q 7.89 5.07 0.00 2.21 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.89 0.00 0.00 0.00 0.00 0.00 2.30 2.50 0.00 44 G 8.99 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 I 9.33 4.95 1.83 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 1.17 0.64 0.80 0.00 0.00 46 I 8.45 4.39 1.49 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.54 -0.11 0.00 0.00 47 S 9.04 4.95 0.00 3.89 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 48 P 0.00 5.16 0.00 2.05 2.14 0.00 3.76 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.04 0.00 49 V 8.52 4.10 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 0.70 0.00 0.00 0.91 0.00 0.00 50 N 8.86 4.52 0.00 2.79 2.93 0.00 0.00 7.03 8.49 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 51 D 8.61 4.54 0.00 2.73 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 52 T 8.44 4.11 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 1.30 0.00 0.00 53 Y 7.79 3.82 0.00 2.90 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 54 G 6.59 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 0.00 0.00 0.00 55 K 8.03 3.98 0.00 1.62 1.75 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.25 1.22 7.81 56 K 7.76 3.65 0.00 1.69 1.77 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.43 7.81 57 D 8.52 4.56 0.00 2.60 2.61 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 0.00 0.00 0.00 0.00 58 L 8.14 4.75 0.00 1.74 1.66 1.04 0.98 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 59 A 8.49 4.05 1.14 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 0.00 0.00 60 A 8.55 4.14 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 61 S 9.30 4.15 0.00 4.08 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 0.00 62 H 8.24 3.99 0.00 3.23 3.24 0.00 5.86 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 63 H 8.05 4.33 0.00 3.41 3.42 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 64 R 8.08 3.98 0.00 1.94 2.16 0.00 3.60 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.74 0.00 65 V 8.14 3.49 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 1.02 0.00 0.00 0.95 0.00 0.00 66 A 7.53 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 M 7.95 3.70 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 68 A 7.85 3.82 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 69 R 7.77 3.70 0.00 1.69 2.04 0.00 3.21 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 70 L 8.04 4.07 0.00 1.78 1.68 0.91 1.11 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 71 A 8.06 4.01 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 72 L 7.71 4.19 0.00 1.58 1.62 0.61 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 73 Q 7.68 4.01 0.00 2.09 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 7.25 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 74 T 7.53 4.39 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 1.22 0.00 0.00 75 S 7.73 4.73 0.00 3.66 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 76 D 8.82 4.92 0.00 2.87 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 77 W 7.69 5.27 0.00 3.48 3.27 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 78 I 7.16 4.39 1.07 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 -0.30 -0.36 -0.28 0.00 0.00 79 R 8.60 4.66 0.00 1.70 1.85 0.00 2.71 0.00 0.00 3.17 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.44 0.00 80 V 8.08 4.40 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 0.59 0.00 0.00 0.87 0.00 0.00 81 D 8.76 4.95 0.00 2.65 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 82 P 0.00 4.48 0.00 2.44 2.27 0.00 3.84 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 2.12 2.02 0.00 83 W 8.44 4.38 0.00 3.34 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 E 8.61 3.70 0.00 2.33 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.32 0.00 85 S 7.95 4.22 0.00 4.07 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 86 E 7.48 4.18 0.00 1.91 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 2.27 2.49 0.00 87 Q 6.60 3.85 0.00 1.72 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 1.47 1.28 0.00 88 A 8.53 4.08 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 89 Q 7.42 4.61 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.81 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 90 W 8.91 4.35 0.00 3.31 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 M 6.94 4.19 0.00 1.65 1.57 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 2.27 2.32 0.00 92 E 7.59 3.39 0.00 1.86 1.75 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 2.39 1.72 0.00 93 T 8.72 3.88 4.60 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 1.36 0.00 0.00 94 V 7.90 3.58 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 0.59 0.00 0.00 1.03 0.00 0.00 95 K 7.94 4.02 0.00 1.91 1.92 0.00 1.53 0.00 0.00 1.54 0.00 0.00 3.13 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.43 1.35 7.81 96 V 7.67 3.78 2.23 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 1.26 0.00 0.00 1.16 0.00 0.00 97 L 7.77 3.71 0.00 1.16 0.13 0.64 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.81 4.08 0.00 2.04 2.03 0.00 3.17 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.93 0.00 99 H 8.02 3.74 0.00 2.58 2.82 0.00 5.78 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 0.00 100 H 8.00 3.97 0.00 3.15 3.28 0.00 5.67 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 H 8.32 4.20 0.00 3.51 3.69 0.00 5.96 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 0.00 102 S 8.26 4.18 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 0.00 103 K 7.54 3.75 0.00 1.56 1.89 0.00 1.63 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.38 1.37 7.81 104 L 7.44 4.17 0.00 1.73 1.68 0.96 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 105 L 7.29 4.28 0.00 1.73 1.55 0.89 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 *126 A 8.23 4.12 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 V 7.46 4.27 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 0.87 0.00 0.00 0.92 0.00 0.00 128 P 0.00 4.67 0.00 2.17 2.08 0.00 3.82 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 2.02 2.03 0.00 129 E 9.18 4.48 0.00 2.02 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 0.00 2.35 2.33 0.00 130 L 8.71 5.01 0.00 1.79 1.88 1.02 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 131 K 9.03 4.94 0.00 1.69 1.66 0.00 1.52 0.00 0.00 1.56 0.00 0.00 2.49 0.00 0.00 2.53 0.00 0.00 0.00 0.00 1.59 1.33 7.81 132 L 8.92 4.56 0.00 1.78 1.57 1.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 133 L 9.14 5.17 0.00 1.59 1.39 0.81 -0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 134 C 8.74 4.64 0.00 2.96 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 0.00 135 G 8.48 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 0.00 136 A 8.49 4.08 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 0.00 137 D 7.78 4.01 0.00 2.77 2.61 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 0.00 0.00 0.00 0.00 138 V 7.63 3.63 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 0.88 0.00 0.00 0.90 0.00 0.00 139 L 7.50 3.15 0.00 1.66 1.83 0.92 0.51 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 0.00 140 K 7.57 3.11 0.00 1.33 1.70 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.12 0.54 7.81 141 T 7.53 4.09 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 142 F 7.23 4.33 0.00 2.90 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 Q 7.86 4.23 0.00 2.14 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.79 0.00 0.00 0.00 0.00 0.00 2.40 2.35 0.00 144 T 7.57 3.95 4.46 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 1.25 0.00 0.00 145 P 0.00 4.34 0.00 2.06 2.03 0.00 3.85 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.14 0.00 146 N 8.84 4.29 0.00 2.89 2.92 0.00 0.00 6.95 7.85 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 0.00 147 L 7.91 4.35 0.00 1.65 1.98 0.84 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 148 W 8.02 4.90 0.00 3.32 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 0.00 149 K 8.58 4.34 0.00 1.63 1.67 0.00 1.37 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.51 1.41 7.81 150 D 9.08 4.35 0.00 2.69 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 0.00 151 A 7.98 4.02 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 0.00 152 H 8.46 4.36 0.00 3.56 3.57 0.00 5.65 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 0.00 153 I 7.70 3.19 1.77 0.00 0.00 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 0.62 0.89 0.11 0.00 0.00 154 Q 8.11 3.81 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.25 2.32 0.00 155 E 8.30 3.92 0.00 2.23 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 2.46 2.36 0.00 156 I 8.11 3.97 2.01 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 1.60 0.57 0.97 0.00 0.00 157 V 7.61 3.92 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 0.63 0.00 0.00 0.85 0.00 0.00 158 E 8.16 4.09 0.00 1.53 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 2.20 2.31 0.00 159 K 7.94 3.92 0.00 1.29 1.07 0.00 1.51 0.00 0.00 1.52 0.00 0.00 2.92 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.27 1.34 7.81 160 F 7.72 4.68 0.00 3.24 3.16 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 0.00 161 G 8.10 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 0.00 0.00 0.00 0.00 162 L 9.01 5.14 0.00 1.76 1.48 0.99 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 163 V 8.94 4.72 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 0.91 0.00 0.00 0.89 0.00 0.00 164 C 9.03 5.25 0.00 2.98 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 0.00 165 V 8.66 4.61 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.91 0.00 0.00 166 G 8.62 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 0.00 0.00 0.00 167 R 8.31 4.90 0.00 1.86 1.81 0.00 3.12 0.00 0.00 3.36 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 168 V 8.50 3.72 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 0.70 0.00 0.00 1.02 0.00 0.00 *169 S 9.02 4.40 0.00 3.82 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 0.00 170 H 7.70 5.22 0.00 3.32 3.37 0.00 5.72 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 D 7.46 4.62 0.00 2.52 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 0.00 0.00 0.00 0.00 172 P 0.00 4.07 0.00 2.11 2.09 0.00 3.50 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.18 0.00 173 K 7.96 3.98 0.00 1.71 1.82 0.00 1.62 0.00 0.00 1.79 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.50 1.46 7.81 174 G 7.75 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 0.00 175 Y 7.56 4.46 0.00 3.15 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 0.00 176 I 8.11 3.79 2.04 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 1.51 1.29 0.92 0.00 0.00 177 A 7.96 4.07 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 0.00 178 E 8.07 4.52 0.00 2.12 2.05 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 2.34 2.46 0.00 179 S 7.46 4.69 0.00 3.81 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 0.00 180 P 0.00 4.44 0.00 2.20 2.09 0.00 3.65 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 181 I 7.62 3.77 1.81 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 1.63 0.70 0.86 0.00 0.00 182 L 7.39 3.99 0.00 1.79 1.76 1.09 0.76 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 0.00 183 R 8.53 4.02 0.00 2.09 1.92 0.00 3.27 0.00 0.00 3.10 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.65 0.00 184 M 7.94 4.08 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.31 0.00 185 H 7.60 4.74 0.00 3.09 3.14 0.00 5.68 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 186 Q 7.78 3.98 0.00 2.17 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.80 0.00 0.00 0.00 0.00 0.00 2.42 2.31 0.00 187 H 7.79 4.28 0.00 3.34 3.52 0.00 5.51 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 N 8.26 4.76 0.00 2.94 2.90 0.00 0.00 6.62 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 0.00 189 I 7.44 4.78 1.94 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 1.23 0.57 0.91 0.00 0.00 190 H 9.46 4.83 0.00 3.00 3.28 0.00 5.60 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 191 L 8.59 4.83 0.00 1.49 1.57 0.89 0.79 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 0.00 192 A 8.56 4.79 1.13 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 0.00 193 K 8.10 4.80 0.00 1.69 1.72 0.00 1.41 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.24 1.43 7.81 194 E 8.56 4.81 0.00 2.05 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 2.18 2.39 0.00 195 P 0.00 4.52 0.00 2.07 2.12 0.00 3.62 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 2.03 2.07 0.00 196 V 7.64 4.19 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 0.82 0.00 0.00 0.94 0.00 0.00 197 Q 8.62 4.24 0.00 2.05 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.08 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 198 N 8.27 4.96 0.00 2.67 2.69 0.00 0.00 7.17 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 E 7.83 4.41 0.00 1.97 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 2.24 2.25 0.00 200 I 7.85 4.40 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.66 0.97 0.00 0.00 201 S 8.39 4.80 0.00 4.06 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 0.00 202 A 8.52 4.01 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 0.00 203 T 7.90 3.77 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 1.23 0.00 0.00 204 Y 8.04 4.03 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 0.00 205 I 7.75 3.46 1.92 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 1.79 0.68 0.76 0.00 0.00 206 R 8.03 3.58 0.00 1.84 1.91 0.00 3.25 0.00 0.00 3.41 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 1.57 0.00 207 R 7.80 3.76 0.00 1.83 1.89 0.00 3.11 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.60 0.00 208 A 7.67 3.91 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 209 L 7.94 4.00 0.00 1.82 1.77 0.82 0.72 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 0.00 210 G 8.14 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 0.00 0.00 0.00 211 Q 7.61 4.48 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.05 0.00 0.00 0.00 0.00 0.00 2.32 2.44 0.00 212 G 7.79 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 0.00 213 Q 7.80 4.35 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.82 0.00 0.00 0.00 0.00 0.00 2.37 2.27 0.00 214 S 8.28 4.42 0.00 3.83 3.78 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 0.00 215 V 8.03 4.47 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 0.72 0.00 0.00 0.89 0.00 0.00 216 K 7.77 3.95 0.00 1.49 1.36 0.00 1.64 0.00 0.00 1.35 0.00 0.00 2.85 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.30 1.00 7.81 217 Y 8.16 3.93 0.00 3.27 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 0.00 218 L 8.05 4.62 0.00 1.90 1.75 1.10 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 219 I 7.27 5.06 2.03 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 1.40 0.66 0.92 0.00 0.00 220 P 0.00 4.39 0.00 2.20 2.02 0.00 3.63 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.27 0.00 221 D 8.89 4.32 0.00 2.68 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 0.00 222 A 7.95 4.07 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 0.00 223 V 7.75 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 1.17 0.00 0.00 0.97 0.00 0.00 224 I 7.74 3.75 2.01 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.57 0.89 0.00 0.00 225 T 7.96 3.87 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 1.28 0.00 0.00 226 Y 7.93 3.99 0.00 3.01 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 0.00 227 I 8.21 3.82 2.14 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.93 1.10 0.00 0.00 228 K 8.26 3.91 0.00 1.82 1.93 0.00 1.63 0.00 0.00 1.63 0.00 0.00 2.92 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.45 7.81 229 D 8.21 4.33 0.00 2.47 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 230 H 7.77 4.62 0.00 2.76 3.01 0.00 5.81 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 231 G 7.57 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 0.00 232 L 7.80 4.14 0.00 1.59 0.83 0.92 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 233 Y 7.65 3.68 0.00 3.17 3.01 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 0.00 234 T 7.30 4.14 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 1.21 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.