NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.5003 8.2227 120.1901 54.2153 42.1290 172.6582 2 V 4.4544 7.9507 117.8283 61.0324 33.3911 175.0146 3 Q 4.8662 9.9234 128.0072 54.1165 31.9662 174.0317 4 L 5.2714 8.6306 122.3474 53.1135 45.1774 176.1705 5 Q 4.3586 8.5768 123.6770 54.8349 31.7928 173.7089 6 E 5.0283 8.8867 126.5569 56.5269 30.8861 176.2856 7 S 4.6222 8.6411 115.9101 56.9372 66.8508 174.0124 8 G 4.3225 8.4822 110.2840 43.8901 0.0000 170.4044 9 P 4.2116 0.0000 0.0000 62.9179 31.6595 177.3410 10 G 3.7959 8.6264 109.7729 47.3961 0.0000 172.7136 11 L 5.3436 7.7234 121.7456 53.3588 45.1320 175.9497 12 V 4.5622 8.8054 118.9682 59.1755 35.9491 174.9900 13 K 4.6092 8.5640 125.4001 55.3676 33.4324 174.5482 14 P 4.5645 0.0000 0.0000 64.4997 31.7776 176.8823 15 S 4.2778 9.1763 117.3259 58.8862 62.5575 169.8824 16 Q 4.5541 7.5775 118.7120 55.0137 31.0655 174.5953 17 S 5.0565 8.3740 113.3730 56.9224 65.6623 173.4808 18 L 4.2981 8.9649 125.2078 54.3988 43.6067 175.3351 19 S 4.8471 8.2612 119.1940 56.6353 65.0309 172.7718 20 L 4.9565 8.6485 126.5563 53.1208 45.6154 175.5603 21 T 5.0140 9.1539 118.3364 61.9226 72.0529 172.2674 22 C 5.0447 8.8940 126.3473 55.1199 40.4009 172.4532 23 T 4.6506 8.5708 124.0995 62.2134 69.8089 174.0067 24 V 4.7603 8.1344 126.8411 61.5240 33.4693 175.0617 25 T 4.5938 8.9608 123.3213 63.1440 72.1054 175.1379 26 G 3.9709 10.6779 112.8354 46.4246 0.0000 172.6349 27 Y 4.5049 7.0373 116.5237 56.6566 41.8280 173.5370 28 S 4.3749 7.6499 123.5976 57.9680 63.7844 175.1259 29 I 3.4392 8.7258 118.7562 62.4069 37.2828 177.3383 30 T 4.6693 7.3205 109.6593 61.9614 69.6108 176.1340 31 S 4.0101 7.8571 118.8936 60.9627 62.9055 173.2835 32 D 3.3700 7.8846 115.7298 54.7073 43.3998 175.0829 33 Y 4.1616 8.0496 114.4239 57.9059 36.7281 167.6752 34 A 4.2659 7.9235 122.1285 49.8448 21.6875 176.0252 35 W 4.4988 9.0773 122.4580 55.2249 31.0979 175.3957 35A S 5.5838 9.1653 121.8391 56.8513 65.5451 173.3630 36 W 5.4065 9.1392 121.8051 55.2201 31.8242 175.1321 37 I 5.2957 9.4694 124.6737 59.5511 41.1523 174.4426 38 R 4.9489 9.0061 122.0128 54.2540 32.7920 174.2197 39 Q 4.9700 8.9042 122.5579 54.4034 31.4384 175.0815 40 F 4.8576 9.0300 125.9499 56.1489 40.7525 173.6003 41 P 4.4766 0.0000 0.0000 64.6605 31.4156 177.1558 42 G 3.9523 8.8585 111.2119 44.8600 0.0000 173.8532 43 N 4.6171 8.6018 116.1720 52.6771 37.0867 174.4024 44 K 4.2433 7.9727 120.6051 56.6730 33.5236 175.1611 45 L 5.3010 8.6407 126.4046 53.0344 44.1093 175.3267 46 E 4.8235 9.1878 124.2531 54.0005 32.7243 174.3593 47 W 4.6169 9.2277 135.0000 58.0190 31.1574 175.2160 48 M 4.1048 9.0145 126.6114 55.0322 33.5819 176.4939 49 G 3.6439 5.6707 105.2269 45.9688 0.0000 170.3802 50 Y 5.7852 8.0661 117.5119 55.3511 42.3999 173.8878 51 I 5.2645 8.8528 119.8630 59.3917 41.2631 175.3046 52 N 4.9612 9.5508 127.7370 51.6001 38.7515 175.2320 53 Y 5.0581 8.3335 114.8711 59.2008 38.0181 177.5950 54 S 4.0423 7.5279 114.7734 58.5199 63.4044 174.8624 55 G 3.8457 7.9793 108.8662 44.9845 0.0000 173.0275 56 Y 4.6956 8.1482 118.8670 57.8722 38.9169 174.9521 57 T 5.0122 8.5557 113.3330 60.1084 72.0462 173.4185 58 S 4.2706 7.8292 116.3897 56.9197 65.9618 172.2627 59 Y 5.1337 8.1844 123.4741 55.6213 41.5025 174.9002 60 N 4.5373 8.7644 122.1618 53.5740 39.2533 173.9348 61 P 4.5408 0.0000 0.0000 65.9753 31.6611 178.5192 62 S 4.3905 8.4844 112.9241 60.4132 62.9964 174.6914 63 L 4.7284 8.3275 118.5287 53.8438 43.5342 178.3232 64 K 3.8008 7.9430 118.4803 59.6925 31.9882 178.8864 65 S 4.3279 8.0456 109.4754 59.7427 63.1539 174.0240 66 R 4.5451 8.5061 120.8222 55.7800 32.0838 174.4661 67 I 4.9061 7.2730 117.7437 59.7159 41.0767 174.4488 68 S 4.3423 8.6678 120.3620 56.7846 66.2746 172.5643 69 I 5.3303 9.2436 127.2910 59.9950 39.9025 174.8213 70 T 5.1231 8.9584 116.2719 60.4170 72.7300 172.2745 71 R 5.2353 8.5419 116.2638 55.4819 33.1569 174.4000 72 D 4.8321 9.4284 119.1986 52.6664 43.1910 176.0786 73 T 3.9783 8.6579 117.7882 64.0761 69.2962 177.0716 74 S 4.2227 8.0275 116.3204 60.5007 63.1748 174.7452 75 E 4.3031 8.2980 117.5353 55.1936 30.5660 174.7188 76 N 4.0373 7.4749 116.2615 54.9873 38.0323 172.8952 77 Q 5.0188 7.8687 114.9908 53.9235 33.4426 176.0087 78 F 5.2646 8.2001 115.9114 55.0745 41.9727 173.7517 79 F 5.5108 9.7468 117.7603 55.7927 43.2502 173.5465 80 L 4.6621 8.3208 124.1414 53.3527 44.2260 175.0876 81 Q 4.7875 8.8134 124.2742 53.9747 32.4104 173.9324 82 L 4.9445 8.6504 126.3259 53.6272 44.7893 175.4869 82A H 4.8327 9.0830 123.6294 53.6805 31.0956 174.7598 82B S 3.6817 8.3643 113.0706 59.8000 60.4818 173.6286 82C V 4.0843 7.6546 113.1785 61.5049 32.5905 176.2498 83 T 4.9803 8.8794 112.4363 58.7779 71.9630 173.0868 84 P 5.0792 0.0000 0.0000 65.0508 31.3410 178.6712 85 E 4.1445 7.8244 116.5004 58.7008 29.3541 177.2941 86 D 4.9156 8.4366 117.7053 54.8107 41.1822 176.5715 87 T 4.4098 8.0537 117.6949 64.0371 68.9017 173.5651 88 A 4.3416 8.7564 126.5896 51.9198 23.9283 174.7513 89 T 4.6366 8.2712 116.5979 63.0136 70.0211 174.0193 90 Y 4.8675 9.1529 125.3526 56.5793 39.9833 174.7096 91 F 5.5654 10.0294 124.1371 55.9218 42.0865 172.5919 92 C 4.8420 9.4235 117.4708 54.3844 41.7990 172.2010 93 A 5.0952 8.5259 120.9025 51.4046 22.9097 174.4933 94 Y 4.7549 8.2602 116.2227 56.0286 41.9568 174.9514 95 G 3.9537 7.5003 105.3327 46.3609 0.0000 171.8758 96 N 5.4476 8.0438 113.5115 52.5099 38.6397 173.9998 97 Y 4.6246 7.5384 115.3276 58.4965 39.9187 176.9816 98 L 3.8714 7.7356 121.0702 53.8245 42.0705 174.5614 99 P 4.0643 0.0000 0.0000 63.2784 31.6309 175.5738 100 A 4.4235 8.5707 123.3573 52.0600 21.6007 175.9814 101 Y 4.8156 7.0569 111.4427 56.1450 42.3679 174.6282 102 W 5.1830 9.1549 122.0358 54.9343 32.7467 176.1123 103 G 4.1627 9.1190 112.5271 44.7255 0.0000 173.5715 104 Q 4.2043 8.8009 116.2529 57.0263 29.1062 177.3537 105 G 3.5330 9.2996 103.4052 45.7317 0.0000 172.4982 106 T 4.5999 8.3180 114.1659 59.8480 70.7259 172.6085 107 L 4.6841 8.5066 130.5688 54.8493 43.8828 175.3064 108 V 4.8108 8.9969 125.7239 61.4739 34.5742 173.9456 109 T 4.9613 9.1426 124.9866 61.8024 71.3206 173.5242 110 V 5.0438 8.3246 126.2830 61.1172 33.1774 174.2932 111 S 4.9296 8.4773 120.1309 57.9021 64.7828 174.8164 112 A 4.2945 8.8127 125.7579 52.7603 19.2114 178.0507 113 A 3.9575 7.6231 118.9271 51.9782 18.8658 177.4256 114 K 4.5091 8.0145 119.4842 55.3384 33.6124 177.0459 115 T 4.5657 8.4487 118.4659 64.3585 69.2379 174.0473 116 T 4.7869 9.3741 122.7162 61.4210 72.2012 173.6643 117 A 4.6355 8.7589 127.9344 51.0837 19.2730 175.1278 118 P 4.8232 0.0000 0.0000 62.2357 32.9904 175.8504 119 S 4.4691 8.8245 118.8824 57.3235 64.7516 173.3748 120 V 4.5888 7.8447 123.7679 61.2567 33.5209 173.9847 121 Y 5.0899 8.8634 126.3485 55.4458 40.8723 173.3425 122 P 4.7962 0.0000 0.0000 62.6276 32.8527 175.7991 123 L 4.6632 9.3613 124.1343 53.3042 42.8931 175.0440 124 A 4.8182 8.3903 125.6641 49.5312 20.6638 174.9905 125 P 4.4693 0.0000 0.0000 62.3965 32.3811 177.6556 126 V 3.5973 8.3741 112.9948 64.4665 31.6649 176.7406 *132 G 3.8431 7.5765 105.2521 45.2153 0.0000 171.9146 133 S 4.3410 8.5092 112.1711 60.4997 64.1602 174.3960 134 S 5.3547 8.0387 114.9845 56.5765 65.8388 173.9561 135 V 4.5088 8.8842 120.5902 60.3817 34.5102 174.3783 136 T 4.9060 8.5212 120.4118 61.8264 70.3461 173.7485 137 L 4.6152 8.5590 126.2565 52.9204 45.1652 175.5445 138 G 4.7603 9.0516 107.4205 44.9153 0.0000 170.6359 139 C 5.5226 9.5850 119.6411 54.6442 44.7280 172.2479 140 L 5.0172 9.3979 128.6757 53.4332 44.2571 175.0628 141 V 4.7295 9.0873 128.0520 61.3354 33.0665 174.1748 142 K 4.8351 9.1004 130.1986 54.8556 35.5198 175.9696 143 G 3.9791 8.6130 113.6895 47.2343 0.0000 172.6899 144 Y 5.1553 7.2225 115.8138 55.2871 41.9076 174.3804 145 F 5.1243 9.0737 119.3820 57.2119 43.5353 171.8584 146 P 3.7114 0.0000 0.0000 61.0721 33.8649 174.9520 147 E 4.1027 8.1018 118.4315 56.0047 29.9276 174.1282 148 P 4.8239 0.0000 0.0000 61.2140 33.9771 174.0459 149 V 4.5892 7.8580 110.9354 59.6616 34.7668 175.4112 150 T 4.5752 8.7953 112.8223 59.8224 71.0931 172.8007 151 L 5.2107 8.4678 127.1522 53.3551 44.8913 175.1762 152 T 4.7884 8.9414 115.2908 59.8088 73.3084 172.3264 153 W 4.9573 8.5247 120.9509 55.2935 32.3070 175.9587 154 N 4.0787 10.0270 122.9392 55.3294 36.1250 174.5136 155 S 3.7478 10.6054 107.3487 59.5148 61.3247 174.5176 156 G 4.0333 8.1647 109.5897 45.4433 0.0000 175.9177 157 S 4.1404 7.8843 112.7790 58.9608 63.3522 173.8714 158 L 4.5872 7.4440 123.2975 53.6812 42.4675 174.9857 159 S 4.6466 8.4535 120.0513 58.6822 64.2458 174.7850 160 S 4.1901 7.9100 116.0354 59.2715 63.3658 174.3181 161 G 3.8426 8.5814 110.4839 46.3053 0.0000 172.3952 162 V 4.5309 6.9276 119.6798 61.1722 33.1925 174.9293 163 H 4.6594 9.4086 124.9118 54.4176 31.5590 172.7210 164 T 4.7819 8.2733 120.8364 61.8970 69.6485 174.6420 165 F 4.6500 9.0028 126.2264 55.6923 40.2369 174.5492 166 P 4.3960 0.0000 0.0000 62.3740 31.8798 176.2922 167 A 4.5620 8.5590 123.6837 52.2572 19.3141 176.8242 168 V 4.4396 8.9957 121.2410 60.9548 34.5257 174.3264 169 L 4.2455 8.5474 129.8965 53.8875 42.7186 175.6241 170 Q 4.2250 8.8112 128.7557 54.9964 30.8072 175.2336 171 S 3.6263 8.8980 123.4161 60.3187 59.5030 171.5731 172 D 4.2532 8.0152 113.0278 54.8115 39.0908 173.9622 173 L 4.9454 7.1639 118.1291 53.2107 46.0923 175.3791 174 Y 4.7446 8.7771 121.0326 57.5114 39.7489 174.6545 175 T 5.2315 8.9158 119.1666 61.8390 72.3700 172.8642 176 L 5.3958 9.5623 127.1140 53.5378 46.2877 175.0155 177 S 5.3809 8.7422 116.7573 56.9816 67.1935 172.4298 178 S 5.4873 9.3936 114.9412 56.9374 66.1386 172.7688 179 S 5.5306 9.8139 121.0697 56.5795 66.3973 173.1925 180 V 4.5413 8.2119 120.3514 60.2217 34.3473 174.1019 181 T 4.8996 8.5638 121.8567 61.8555 70.5320 173.9846 182 V 4.5711 8.3798 118.3988 59.1817 36.8222 175.0262 183 T 4.3014 8.4226 117.9478 63.7971 68.7643 176.1751 184 S 4.2262 9.0883 120.5955 60.8936 63.0425 175.2501 185 S 4.7995 7.9898 114.0199 58.4167 63.4892 174.6911 186 T 4.4017 8.1471 120.0665 64.6028 69.7936 174.6126 187 W 5.0724 7.9376 128.6578 55.1212 33.3413 172.7926 188 P 3.5126 0.0000 0.0000 61.9976 30.9201 176.9720 189 S 4.1204 7.9900 114.9266 60.7358 62.7745 174.6306 190 Q 4.5950 8.2707 120.4964 53.3177 29.8657 175.7312 191 S 4.4973 8.6464 118.0928 58.3695 64.0163 173.4221 192 I 5.0574 8.6274 122.5396 60.0670 40.7967 174.4031 193 T 5.1487 9.7210 122.9051 61.9303 72.7788 171.8752 194 C 4.3763 9.1246 125.6585 54.8734 42.9314 171.8723 195 N 5.4163 8.9705 124.0440 51.4206 41.0017 173.7367 196 V 4.7683 8.8464 123.7965 60.8522 34.8590 173.8268 197 A 5.0240 9.1604 129.7163 50.4885 21.9297 174.5153 198 H 4.8404 9.0234 122.9820 52.9932 30.2263 171.9440 199 P 4.1115 0.0000 0.0000 65.1532 31.7299 178.3938 200 A 3.8548 7.8570 119.3596 54.7971 17.8315 178.1739 201 S 4.6199 7.7806 107.2800 57.3353 63.4672 174.1715 202 S 3.4127 7.8298 115.4223 60.2593 60.9058 172.1318 203 T 4.5554 7.7253 115.4375 62.2955 70.6408 174.9828 204 K 4.8202 8.4017 126.4929 55.4975 34.7154 174.9797 205 V 4.4259 9.1106 128.2714 61.0775 34.6860 174.2002 206 D 5.1798 8.6760 125.9968 52.5818 43.4179 175.0730 207 K 4.4671 8.9607 126.8762 54.1694 34.1587 175.1585 208 K 4.6204 8.6818 129.4665 56.3441 33.2695 176.6494 209 I 4.3150 8.8316 128.7459 60.7848 37.0733 175.1236 210 E 4.6463 8.7561 127.0333 54.1286 30.7977 175.1868 211 P 4.7493 0.0000 0.0000 62.6782 32.0590 176.5704 212 R 4.3108 8.4726 119.9999 55.2924 31.0563 177.1223 213 G 3.9092 8.6780 107.5713 46.2861 0.0000 173.4816 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 1 D 8.22 4.50 0.00 2.64 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 V 7.95 4.45 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 0.73 0.00 0.00 0.59 0.00 0.00 3 Q 9.92 4.87 0.00 2.03 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.52 0.00 0.00 0.00 0.00 0.00 2.30 2.32 0.00 4 L 8.63 5.27 0.00 1.61 1.63 1.26 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 5 Q 8.58 4.36 0.00 2.10 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.97 0.00 0.00 0.00 0.00 0.00 2.25 2.40 0.00 6 E 8.89 5.03 0.00 1.95 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 2.52 2.33 0.00 7 S 8.64 4.62 0.00 3.84 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 8 G 8.48 4.32 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 9 P 0.00 4.21 0.00 1.97 1.96 0.00 3.74 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.03 0.00 10 G 8.63 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 11 L 7.72 5.34 0.00 1.55 1.50 1.15 1.06 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 12 V 8.81 4.56 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 0.73 0.00 0.00 0.90 0.00 0.00 13 K 8.56 4.61 0.00 1.85 1.67 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.51 1.48 7.81 14 P 0.00 4.56 0.00 2.09 2.00 0.00 3.79 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 2.05 2.15 0.00 15 S 9.18 4.28 0.00 3.99 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 16 Q 7.58 4.55 0.00 2.06 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.74 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 17 S 8.37 5.06 0.00 3.62 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 18 L 8.96 4.30 0.00 1.57 1.44 0.63 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 19 S 8.26 4.85 0.00 3.78 3.55 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 20 L 8.65 4.96 0.00 0.84 0.92 0.61 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 21 T 9.15 5.01 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 1.14 0.00 0.00 22 C 8.89 5.04 0.00 1.89 1.26 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 23 T 8.57 4.65 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 1.17 0.00 0.00 24 V 8.13 4.76 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 0.81 0.00 0.00 0.85 0.00 0.00 25 T 8.96 4.59 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 26 G 10.68 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 0.00 0.00 0.00 27 Y 7.04 4.50 0.00 2.84 2.83 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 28 S 7.65 4.37 0.00 3.60 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 29 I 8.73 3.44 0.72 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.36 -0.28 0.00 0.00 30 T 7.32 4.67 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 1.15 0.00 0.00 31 S 7.86 4.01 0.00 3.26 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 D 7.88 3.37 0.00 2.11 1.54 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 33 Y 8.05 4.16 0.00 2.76 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.92 4.27 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 W 9.08 4.50 0.00 2.40 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35A S 9.17 5.58 0.00 3.77 4.05 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 36 W 9.14 5.41 0.00 3.34 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 37 I 9.47 5.30 1.96 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.12 1.26 0.00 0.00 38 R 9.01 4.95 0.00 0.81 1.03 0.00 2.21 0.00 0.00 2.78 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.71 0.00 39 Q 8.90 4.97 0.00 2.36 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.95 0.00 0.00 0.00 0.00 0.00 2.34 2.62 0.00 40 F 9.03 4.86 0.00 3.14 2.93 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 41 P 0.00 4.48 0.00 2.14 2.11 0.00 3.91 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 2.17 2.22 0.00 42 G 8.86 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 43 N 8.60 4.62 0.00 2.90 3.13 0.00 0.00 6.88 7.54 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 44 K 7.97 4.24 0.00 1.96 1.95 0.00 1.72 0.00 0.00 1.92 0.00 0.00 3.09 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.76 1.61 7.81 45 L 8.64 5.30 0.00 1.66 1.73 0.85 1.01 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 46 E 9.19 4.82 0.00 2.27 1.82 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 2.32 2.41 0.00 47 W 9.23 4.62 0.00 3.40 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 48 M 9.01 4.10 0.00 1.94 2.20 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 2.68 2.47 0.00 49 G 5.67 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 8.07 5.79 0.00 3.02 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 51 I 8.85 5.26 2.06 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 1.35 1.75 1.00 0.00 0.00 52 N 9.55 4.96 0.00 2.64 2.88 0.00 0.00 6.37 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 53 Y 8.33 5.06 0.00 3.27 3.49 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 0.00 54 S 7.53 4.04 0.00 3.48 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 G 7.98 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 Y 8.15 4.70 0.00 3.15 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 57 T 8.56 5.01 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 1.32 0.00 0.00 58 S 7.83 4.27 0.00 3.53 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 59 Y 8.18 5.13 0.00 2.86 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 60 N 8.76 4.54 0.00 2.89 2.71 0.00 0.00 7.21 7.25 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 61 P 0.00 4.54 0.00 2.29 2.18 0.00 3.82 0.00 0.00 4.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 62 S 8.48 4.39 0.00 4.05 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 63 L 8.33 4.73 0.00 1.68 1.59 0.98 0.93 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 64 K 7.94 3.80 0.00 1.91 1.97 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.28 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.65 1.63 7.81 65 S 8.05 4.33 0.00 3.96 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 66 R 8.51 4.55 0.00 1.80 1.99 0.00 3.18 0.00 0.00 3.10 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.54 0.00 67 I 7.27 4.91 1.68 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.74 1.02 0.40 0.00 0.00 68 S 8.67 4.34 0.00 3.81 3.59 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 69 I 9.24 5.33 2.27 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.12 1.44 0.00 0.00 70 T 8.96 5.12 4.40 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 1.31 0.00 0.00 71 R 8.54 5.24 0.00 1.96 2.02 0.00 2.94 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.68 0.00 72 D 9.43 4.83 0.00 3.01 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 T 8.66 3.98 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 1.18 0.00 0.00 74 S 8.03 4.22 0.00 4.00 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 75 E 8.30 4.30 0.00 2.03 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 0.00 2.27 2.30 0.00 76 N 7.47 4.04 0.00 2.88 2.69 0.00 0.00 6.87 6.68 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 77 Q 7.87 5.02 0.00 1.78 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.44 0.00 0.00 0.00 0.00 0.00 2.12 2.33 0.00 78 F 8.20 5.26 0.00 3.31 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 79 F 9.75 5.51 0.00 3.02 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 80 L 8.32 4.66 0.00 0.27 0.13 0.69 0.23 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 81 Q 8.81 4.79 0.00 1.88 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.52 0.00 0.00 0.00 0.00 0.00 2.22 2.39 0.00 82 L 8.65 4.94 0.00 1.57 1.32 0.89 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 82A H 9.08 4.83 0.00 3.01 3.18 0.00 5.86 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82B S 8.36 3.68 0.00 3.96 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82C V 7.65 4.08 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 0.71 0.00 0.00 0.96 0.00 0.00 83 T 8.88 4.98 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 1.28 0.00 0.00 84 P 0.00 5.08 0.00 2.24 2.22 0.00 3.90 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.13 0.00 85 E 7.82 4.14 0.00 1.97 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.42 0.00 86 D 8.44 4.92 0.00 2.87 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 87 T 8.05 4.41 4.43 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 1.36 0.00 0.00 88 A 8.76 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 T 8.27 4.64 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 0.61 0.00 0.00 90 Y 9.15 4.87 0.00 2.91 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 91 F 10.03 5.57 0.00 3.25 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 92 C 9.42 4.84 0.00 2.45 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 93 A 8.53 5.10 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.26 4.75 0.00 1.74 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 7.50 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 96 N 8.04 5.45 0.00 2.61 2.71 0.00 0.00 6.80 7.54 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 97 Y 7.54 4.62 0.00 2.68 2.54 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 98 L 7.74 3.87 0.00 1.59 1.49 0.83 0.93 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 99 P 0.00 4.06 0.00 1.84 1.42 0.00 3.45 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.94 0.00 100 A 8.57 4.42 0.74 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 0.00 0.00 101 Y 7.06 4.82 0.00 2.20 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 W 9.15 5.18 0.00 2.99 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 0.00 103 G 9.12 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 0.00 104 Q 8.80 4.20 0.00 2.26 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.59 0.00 0.00 0.00 0.00 0.00 2.49 2.44 0.00 105 G 9.30 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 T 8.32 4.60 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 107 L 8.51 4.68 0.00 1.78 1.47 0.98 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 108 V 9.00 4.81 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 0.78 0.00 0.00 0.70 0.00 0.00 109 T 9.14 4.96 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 110 V 8.32 5.04 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 1.36 0.00 0.00 1.00 0.00 0.00 111 S 8.48 4.93 0.00 4.08 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 0.00 112 A 8.81 4.29 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 0.00 113 A 7.62 3.96 0.43 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 0.00 0.00 114 K 8.01 4.51 0.00 1.76 1.78 0.00 1.80 0.00 0.00 1.73 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.38 1.39 7.81 115 T 8.45 4.57 4.32 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 1.35 0.00 0.00 116 T 9.37 4.79 4.40 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 1.32 0.00 0.00 117 A 8.76 4.64 1.26 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 0.00 118 P 0.00 4.82 0.00 1.82 1.93 0.00 3.60 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 1.73 1.66 0.00 119 S 8.82 4.47 0.00 3.63 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 0.00 120 V 7.84 4.59 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 0.68 0.00 0.00 0.77 0.00 0.00 121 Y 8.86 5.09 0.00 2.92 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 P 0.00 4.80 0.00 2.17 2.16 0.00 3.64 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 2.09 2.19 0.00 123 L 9.36 4.66 0.00 1.72 1.69 0.99 0.86 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 0.00 124 A 8.39 4.82 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 0.00 125 P 0.00 4.47 0.00 2.15 2.03 0.00 3.79 0.00 0.00 3.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.24 0.00 126 V 8.37 3.60 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 0.70 0.00 0.00 0.96 0.00 0.00 *132 G 7.58 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 0.00 133 S 8.51 4.34 0.00 3.92 4.14 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 0.00 134 S 8.04 5.35 0.00 3.75 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 0.00 135 V 8.88 4.51 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 0.97 0.00 0.00 0.96 0.00 0.00 136 T 8.52 4.91 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 1.20 0.00 0.00 137 L 8.56 4.62 0.00 0.95 1.15 -0.30 -0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 138 G 9.05 4.76 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 0.00 139 C 9.59 5.52 0.00 2.82 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 0.00 140 L 9.40 5.02 0.00 1.86 1.72 1.07 0.85 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 0.00 141 V 9.09 4.73 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 0.69 0.00 0.00 0.85 0.00 0.00 142 K 9.10 4.84 0.00 1.98 1.77 0.00 1.94 0.00 0.00 1.82 0.00 0.00 2.89 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.42 1.45 7.81 143 G 8.61 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 Y 7.22 5.16 0.00 2.95 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 0.00 145 F 9.07 5.12 0.00 3.23 3.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 146 P 0.00 3.71 0.00 1.66 0.82 0.00 3.50 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.87 0.00 147 E 8.10 4.10 0.00 1.62 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 1.47 1.47 0.00 148 P 0.00 4.82 0.00 2.06 1.98 0.00 3.38 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.00 0.00 149 V 7.86 4.59 1.83 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 -0.27 0.00 0.00 0.68 0.00 0.00 150 T 8.80 4.58 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 1.15 0.00 0.00 151 L 8.47 5.21 0.00 1.49 1.45 0.79 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 152 T 8.94 4.79 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 1.17 0.00 0.00 153 W 8.52 4.96 0.00 3.49 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 0.00 154 N 10.03 4.08 0.00 2.94 2.92 0.00 0.00 6.71 7.43 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 0.00 155 S 10.61 3.75 0.00 3.91 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 0.00 156 G 8.16 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 0.00 0.00 0.00 157 S 7.88 4.14 0.00 4.04 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 0.00 158 L 7.44 4.59 0.00 1.52 1.93 0.89 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 159 S 8.45 4.65 0.00 3.85 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 0.00 160 S 7.91 4.19 0.00 3.89 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 0.00 161 G 8.58 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 0.00 162 V 6.93 4.53 2.21 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 0.96 0.00 0.00 0.84 0.00 0.00 163 H 9.41 4.66 0.00 2.91 2.51 0.00 5.84 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 T 8.27 4.78 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 1.25 0.00 0.00 165 F 9.00 4.65 0.00 3.07 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 0.00 166 P 0.00 4.40 0.00 2.14 2.06 0.00 3.89 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 167 A 8.56 4.56 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 0.00 168 V 9.00 4.44 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 1.00 0.00 0.00 169 L 8.55 4.25 0.00 1.19 1.43 0.13 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 170 Q 8.81 4.22 0.00 1.98 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.27 6.04 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 171 S 8.90 3.63 0.00 4.00 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 0.00 172 D 8.02 4.25 0.00 2.63 2.39 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 0.00 173 L 7.16 4.95 0.00 1.55 1.44 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 174 Y 8.78 4.74 0.00 1.57 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 0.00 0.00 0.00 0.00 175 T 8.92 5.23 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 1.30 0.00 0.00 176 L 9.56 5.40 0.00 1.87 1.70 1.05 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 177 S 8.74 5.38 0.00 3.99 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 178 S 9.39 5.49 0.00 4.04 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 0.00 179 S 9.81 5.53 0.00 3.91 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 0.00 180 V 8.21 4.54 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 -0.51 0.00 0.00 0.44 0.00 0.00 181 T 8.56 4.90 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 1.16 0.00 0.00 182 V 8.38 4.57 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 0.91 0.00 0.00 183 T 8.42 4.30 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 184 S 9.09 4.23 0.00 4.00 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 0.00 185 S 7.99 4.80 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 0.00 186 T 8.15 4.40 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 1.33 0.00 0.00 187 W 7.94 5.07 0.00 3.16 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 0.00 188 P 0.00 3.51 0.00 1.47 0.64 0.00 3.38 0.00 0.00 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.44 0.00 189 S 7.99 4.12 0.00 3.94 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 190 Q 8.27 4.60 0.00 2.18 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.89 0.00 0.00 0.00 0.00 0.00 2.33 2.37 0.00 191 S 8.65 4.50 0.00 4.08 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 0.00 192 I 8.63 5.06 1.96 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.25 1.04 0.00 0.00 193 T 9.72 5.15 4.32 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 1.26 0.00 0.00 194 C 9.12 4.38 0.00 2.01 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 0.00 195 N 8.97 5.42 0.00 2.56 2.71 0.00 0.00 6.00 8.06 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 0.00 196 V 8.85 4.77 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 0.61 0.00 0.00 0.72 0.00 0.00 197 A 9.16 5.02 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 0.00 198 H 9.02 4.84 0.00 2.96 3.07 0.00 5.64 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 199 P 0.00 4.11 0.00 2.12 2.05 0.00 3.71 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 2.05 2.05 0.00 200 A 7.86 3.85 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 201 S 7.78 4.62 0.00 4.04 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 0.00 202 S 7.83 3.41 0.00 3.98 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 0.00 203 T 7.73 4.56 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 1.17 0.00 0.00 204 K 8.40 4.82 0.00 1.64 1.62 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.28 1.45 7.81 205 V 9.11 4.43 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 0.91 0.00 0.00 0.86 0.00 0.00 206 D 8.68 5.18 0.00 2.53 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 0.00 207 K 8.96 4.47 0.00 1.76 1.61 0.00 1.55 0.00 0.00 1.59 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.35 1.43 7.81 208 K 8.68 4.62 0.00 1.88 1.76 0.00 1.90 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.56 1.79 7.81 209 I 8.83 4.32 2.07 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.14 0.94 0.00 0.00 210 E 8.76 4.65 0.00 2.06 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 2.36 2.33 0.00 211 P 0.00 4.75 0.00 1.96 1.82 0.00 3.65 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.28 0.00 212 R 8.47 4.31 0.00 1.86 1.91 0.00 3.53 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.82 0.00 213 G 8.68 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 * Residues marked with a * may have inaccurate shift predictions.