NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 16 I 4.3181 7.8827 121.4529 61.1925 38.8270 173.8057 17 V 4.4147 8.5579 125.3968 61.6341 33.1214 174.2544 18 G 3.8611 8.4156 113.6289 46.2550 0.0000 173.2266 19 G 4.2797 7.8137 110.2150 44.0423 0.0000 172.5148 20 Y 4.9699 7.7847 116.6906 55.1668 42.2122 174.8432 21 T 4.2692 8.5869 117.0730 64.0241 68.3723 175.5682 22 C 4.3733 8.7253 125.0605 59.0302 35.3503 175.3705 23 G 4.0374 8.5493 106.3924 44.8446 0.0000 172.7366 24 A 4.3039 8.4561 125.6879 53.2478 18.7572 176.5538 25 N 4.2558 8.8483 117.9716 54.4119 36.3263 175.4808 26 T 4.1724 7.6175 107.5761 62.8483 69.9466 175.1371 27 V 4.0422 7.0618 122.3371 60.1669 31.2187 173.6707 28 P 4.5826 0.0000 0.0000 63.7659 32.0895 178.2390 29 Y 4.9840 6.8424 115.8463 56.7663 38.9057 174.9409 30 Q 4.6381 7.1615 122.7265 56.4023 29.4998 175.4883 31 V 4.8774 8.8793 118.1559 59.6924 36.6072 174.0914 32 S 4.8759 8.6371 116.6459 56.5816 65.0594 172.5580 33 L 4.6581 8.4508 127.2778 53.0878 43.5137 174.8997 34 N 5.8337 9.0105 122.6720 50.0802 42.0177 175.0089 *37 S 4.4018 8.4861 120.6478 58.3757 64.1961 174.5041 38 G 4.0299 9.7491 108.9538 46.1522 0.0000 173.0894 39 Y 4.5403 6.7107 115.0728 56.1476 40.0183 172.6932 40 H 4.5797 8.8492 121.8248 56.0840 30.4208 174.7474 41 F 4.9111 7.8717 120.5283 57.4882 40.1749 173.9727 42 C 4.7555 6.7734 114.6251 55.9011 45.1681 173.0724 43 G 4.2115 8.5865 108.7248 45.5569 0.0000 172.3211 44 G 4.4477 7.9861 105.2417 46.3598 0.0000 172.6716 45 S 5.5047 8.7160 115.5300 56.3639 66.7514 173.6489 46 L 4.6033 9.3284 127.9033 54.9074 42.2705 177.1253 47 I 4.3439 8.7013 119.8072 61.2490 38.8824 174.5664 48 N 4.9376 7.6621 117.2508 51.6530 39.8708 174.8239 49 S 4.3895 8.7058 111.4286 60.0364 63.2968 174.5275 50 Q 4.5883 9.0896 121.6313 55.4361 30.8304 174.3179 51 W 5.5842 8.3634 116.4068 55.6028 33.6114 174.3543 52 V 5.1626 8.9598 122.5242 61.0818 34.8125 174.3871 53 V 4.9492 8.7552 125.6654 60.4795 33.7561 174.8851 54 S 5.1270 8.8981 116.5381 57.6882 66.1929 171.8367 55 A 4.8002 8.7080 119.8670 49.7009 20.6414 178.3236 56 A 3.8282 8.2940 124.5790 55.3570 18.4204 179.0107 57 H 4.5523 8.3496 108.5818 56.9419 28.5240 175.1719 58 C 4.7938 7.9081 116.8211 56.9426 40.6515 173.4698 59 Y 4.1743 7.8192 121.8394 57.3602 38.8406 175.0336 60 K 3.5062 5.8452 123.1741 56.5970 34.1241 173.8324 61 S 4.3458 8.1736 114.5704 57.6255 65.1366 173.1876 62 G 3.6328 8.2905 105.6664 46.6502 0.0000 173.6387 63 I 4.4529 7.2624 118.6671 59.4853 40.1411 175.8757 64 Q 4.6295 8.7212 126.8490 54.2310 32.0346 174.0694 65 V 4.4281 8.7867 126.8992 61.6848 33.6395 174.5496 65A R 5.0630 8.7201 126.9757 54.6968 32.4608 175.1878 66 L 4.6780 8.9217 124.5588 52.8139 44.7006 177.4069 *69 G 4.0643 8.2520 106.2758 46.2218 0.0000 172.9263 70 E 4.5859 8.2376 119.5481 55.8138 29.8287 174.9953 71 D 4.8602 7.9603 117.8116 54.6303 45.5033 173.9108 72 N 5.2516 8.3995 119.9220 52.1928 39.2525 176.1360 73 I 4.0412 8.3449 119.3891 61.7588 37.8550 176.2692 74 N 4.7649 8.7130 118.0877 53.0310 39.2193 174.7821 75 V 4.3951 7.3285 116.8065 60.7131 34.3288 174.7679 76 V 4.1705 8.3873 126.6346 62.4205 32.0228 175.2197 77 E 4.5461 9.5976 125.1711 54.8356 31.3571 176.1694 78 G 4.0168 9.0251 107.0624 45.8844 0.0000 174.2266 79 N 4.6141 9.0667 117.4152 52.5314 36.5083 174.2169 80 E 4.6189 7.6133 117.3577 56.1447 30.8126 176.1584 81 Q 4.4637 8.8577 121.1092 54.2015 32.7011 174.0692 82 F 5.5561 8.8796 122.7713 55.9593 41.0890 175.1108 83 I 4.7350 8.6983 124.1770 59.5316 41.2762 175.3843 84 S 4.7615 8.5911 121.1176 57.8016 64.6112 173.2541 85 A 4.3891 8.0301 124.7162 52.4383 18.3889 177.7280 86 S 4.3759 9.1596 118.7219 60.3919 62.9194 174.2299 87 K 4.8380 7.6755 116.8627 55.3632 36.3868 174.5268 88 S 5.1563 8.7836 116.2150 56.8893 66.2673 173.7147 89 I 4.5018 9.1652 125.4714 59.5519 39.2739 175.0278 90 V 4.2157 8.3412 127.3785 61.8972 32.8420 175.3553 91 H 3.8036 8.5546 126.2779 55.8208 30.1108 174.6678 92 P 4.3185 0.0000 0.0000 65.3019 31.3603 177.1798 93 S 4.7040 7.9032 112.2346 58.2137 63.0034 173.3245 94 Y 4.3159 7.8034 122.3029 57.5612 39.0136 174.7685 95 N 4.5059 8.0990 125.6114 51.3375 40.1247 175.2155 96 S 3.7939 7.9484 120.8967 60.3308 63.5229 175.1277 97 N 4.4034 8.7651 119.1740 55.2418 38.6342 176.0942 98 T 4.0010 7.7305 105.5844 60.7795 69.9409 174.7252 99 L 3.7566 7.7791 121.0199 55.6489 39.5952 174.0372 100 N 4.5303 7.6598 117.0697 54.4377 39.7320 174.2654 101 N 4.5873 8.6296 118.4569 53.9598 36.3006 175.6825 102 D 4.7381 7.6959 118.0053 53.1088 40.1227 174.6474 103 I 4.9120 7.1006 120.8802 59.3547 42.5537 173.2422 104 M 5.3818 9.0075 125.9041 54.2047 36.2599 173.3570 105 L 5.3694 9.1433 124.2694 53.1559 45.2731 175.4068 106 I 5.0529 8.8850 122.6533 59.4941 40.6919 174.4111 107 K 3.7430 8.6143 128.1292 54.5556 33.8983 175.3695 108 L 4.5829 8.0278 126.5870 53.4197 42.5543 176.9569 109 K 4.1691 8.9370 124.1043 59.1254 32.6058 177.1342 110 S 4.6010 7.6940 111.3077 55.9712 66.0651 173.2604 111 A 4.4419 8.3367 122.7876 52.1099 18.9011 177.0899 112 A 4.5059 8.6604 122.0758 51.3941 20.4785 177.2543 113 S 4.6249 8.6939 115.9831 57.2238 63.7500 174.6209 114 L 4.7379 8.4591 125.2644 54.1413 43.7096 176.3673 115 N 4.4583 8.8066 121.2192 53.4069 41.4110 176.3310 116 S 4.5099 8.8429 108.9527 59.5495 64.0857 175.6822 117 R 4.1650 8.9732 119.7439 56.9931 30.5675 176.0357 118 V 4.6531 7.8628 117.1647 60.9035 34.0301 173.5912 119 A 5.1185 8.5914 128.0732 50.5704 23.0005 175.1995 120 S 5.1081 8.6739 114.2673 57.6381 65.0408 172.9698 121 I 4.5129 8.0360 120.4096 59.2387 40.2223 175.2390 122 S 4.5251 8.3794 121.9559 57.7557 63.8884 174.2172 123 L 4.4253 8.0510 122.8059 53.1464 42.6349 175.0661 124 P 4.6143 0.0000 0.0000 62.7642 32.5086 175.9230 125 T 4.2756 8.1756 107.0265 61.8948 70.5261 174.1777 *127 S 5.0069 7.6027 114.5470 58.2750 63.9909 173.6783 128 C 4.4829 8.3777 117.8476 56.2428 40.9902 173.2210 129 A 4.4645 7.9237 124.0753 51.2161 20.3533 176.6742 130 S 4.4178 7.9577 114.8706 56.9206 65.1207 173.5916 *132 A 4.2710 8.1195 123.6219 53.3598 19.1302 177.4030 133 G 4.0139 9.1619 108.7598 45.7356 0.0000 174.6803 134 T 3.9792 7.5426 117.3139 63.7196 69.5031 173.2936 135 Q 4.7191 8.5323 126.8281 55.5085 30.4174 175.1137 136 C 5.2387 9.2433 122.3565 55.2037 46.7965 172.2269 137 L 5.1729 8.9811 122.4792 53.5646 43.9658 175.0175 138 I 5.2894 9.1764 127.2091 58.8077 40.1400 174.8081 139 S 4.9198 8.7942 119.2416 56.2444 66.5722 173.0505 140 G 3.8978 7.2809 108.9570 45.8511 0.0000 172.5398 141 W 4.6524 8.4624 118.1109 56.1677 29.6476 176.8778 142 G 4.2246 8.0425 107.9966 43.7575 0.0000 173.5571 143 N 3.8202 8.7681 118.2036 54.4132 38.9336 174.4952 144 T 5.2326 8.1639 112.2872 60.5531 69.7421 174.2756 145 K 4.6431 7.9261 121.3368 54.8546 34.7557 176.0590 146 S 4.5275 8.5188 115.3302 59.1080 63.9216 174.6764 147 S 4.4461 7.8822 116.5951 55.1381 63.0168 172.2578 148 G 4.0618 8.0861 109.9548 43.5580 0.0000 170.6078 149 T 4.4324 8.2048 110.0775 59.8605 70.6423 174.3036 150 S 4.3629 9.1396 121.2942 57.0094 65.1375 171.6078 151 Y 4.9888 8.5565 125.0977 55.7464 39.4209 174.4515 152 P 4.7481 0.0000 0.0000 62.2299 33.2925 175.2674 153 D 4.7086 8.6684 116.7768 55.4130 41.8725 177.1601 154 V 5.8205 7.4018 109.7952 58.3248 34.6551 175.8604 155 L 3.0756 8.5236 124.6491 55.3707 42.8857 175.9510 156 K 4.9273 8.2467 125.1482 54.9020 35.2775 174.5939 157 C 5.2954 8.4007 119.3882 55.2506 41.8248 172.9156 158 L 4.9836 8.5281 122.0196 53.8456 45.6980 174.2871 159 K 5.1907 8.9357 124.8356 54.9552 33.8434 175.6461 160 A 4.8240 9.0404 126.2005 49.5844 23.0428 173.4389 161 P 4.9845 0.0000 0.0000 62.0627 33.6544 175.3855 162 I 4.3802 8.3019 122.6787 61.4884 38.1741 175.8022 163 L 4.8510 8.7907 127.1416 53.1727 43.6258 176.6921 164 S 4.4310 8.3841 114.5689 57.9400 64.1636 175.0592 165 D 4.4187 8.7356 121.7840 57.5858 40.5224 179.2562 166 S 4.1631 8.0163 114.3245 61.6955 63.0475 176.6838 167 S 4.1445 8.0001 118.4470 61.0773 62.5577 175.7692 168 C 4.2875 8.3981 121.3320 59.8670 39.4410 175.9702 169 K 3.9802 8.5243 120.3183 59.4749 31.3393 179.6074 170 S 4.1555 8.1271 114.7689 61.1983 62.7910 176.1292 171 A 4.0132 7.7626 123.0239 53.7381 19.8127 177.4108 172 Y 4.8699 7.8501 113.7463 55.3723 38.2146 173.4868 173 P 4.7241 0.0000 0.0000 63.5497 32.1503 178.0371 174 G 3.9818 8.9685 108.5656 46.1371 0.0000 173.7059 175 Q 4.5235 8.2431 116.6992 55.4567 30.1738 175.3571 176 I 4.3868 7.8591 119.9380 60.1051 38.0264 175.4983 177 T 4.5326 8.2440 116.0996 59.9224 70.9232 174.9901 178 S 4.5264 8.5403 113.7624 59.5139 63.2076 173.9221 179 N 5.1424 8.2624 118.0096 53.4781 39.6907 173.8015 180 M 5.9139 8.2609 117.1629 52.9463 36.4382 174.4135 181 F 5.0706 8.1882 113.7456 56.0892 41.8000 173.5612 182 C 5.8094 9.3144 116.3898 54.9123 42.5224 172.6854 183 A 5.0589 9.0214 122.0025 51.1044 22.5836 176.4035 184 G 3.8911 6.9261 106.2056 44.3996 0.0000 172.2258 184A Y 4.6254 8.3272 119.1998 55.9980 40.0009 176.5920 185 L 4.0743 8.5793 125.9532 57.0196 41.9859 178.8709 186 E 4.1785 8.2319 115.2618 56.9093 30.1217 177.1488 187 G 3.8052 7.8803 107.1405 45.1509 0.0000 171.7200 188 G 4.1981 9.1195 105.8601 44.5628 0.0000 173.6323 188A K 4.7952 7.2713 117.5074 54.7572 35.0706 175.3286 189 D 4.6744 8.8232 123.4497 53.8722 45.6702 174.5297 190 S 4.9206 8.6910 116.5062 57.9914 65.3764 172.9122 191 C 4.7322 9.2061 118.5679 55.5345 45.2924 172.0991 192 Q 4.3479 8.6297 120.8981 58.0970 28.8618 176.3816 193 G 4.2938 9.2362 112.0676 46.1080 0.0000 174.3802 194 D 4.6006 8.5707 118.9419 56.1708 41.5369 176.6278 195 S 4.3740 8.0417 114.6229 60.2359 63.2128 175.4486 196 G 4.1334 8.8479 113.3084 46.3127 0.0000 173.6027 197 G 4.4098 7.9250 107.5529 44.6472 0.0000 171.1563 198 P 5.1470 0.0000 0.0000 62.2581 33.6024 175.7126 199 V 4.5559 8.4229 120.5620 61.4115 34.3557 174.1029 200 V 4.8724 8.6766 128.6490 61.2463 34.0238 173.6823 201 C 5.1599 8.6869 124.4016 55.8933 44.1802 174.4503 202 S 3.6900 9.8444 117.9618 59.6658 60.2430 173.0333 203 G 3.9149 8.4240 103.7171 45.9478 0.0000 174.0646 204 K 4.3943 7.9041 118.5792 53.9434 35.1750 175.4904 *209 L 4.1728 8.2870 122.7573 55.4186 42.2868 175.7992 210 Q 4.5721 8.8718 125.7196 56.4696 31.3524 175.8144 211 G 5.2730 8.0465 104.2707 45.5468 0.0000 171.3989 212 I 5.1965 8.1301 119.4252 58.8722 41.0979 175.4133 213 V 3.8152 8.9438 127.6417 63.9361 31.8081 174.0974 214 S 4.8307 8.5205 120.8428 58.6209 64.3404 174.3855 215 W 5.1037 7.6185 114.0868 55.8144 32.0757 172.6160 216 G 3.9733 8.4072 106.4510 46.6652 0.0000 173.2688 217 S 4.6855 8.5584 116.9513 57.0415 63.0178 173.8848 *219 G 4.3529 8.0106 115.5732 45.5677 0.0000 171.0436 220 C 4.9777 8.0869 114.9174 56.4358 45.3731 173.8197 221 A 3.9715 9.2847 125.4999 53.1876 16.6364 177.0376 221A Q 4.5624 7.3296 117.5772 56.1668 29.8574 175.9677 222 K 4.1726 8.4240 122.0255 57.9104 32.6980 176.5185 223 N 4.2313 9.2186 121.2985 53.9037 37.1570 175.2045 224 K 4.2476 7.4444 117.6698 53.2520 32.0101 173.4546 225 P 4.5687 0.0000 0.0000 62.3974 33.0373 176.7639 226 G 3.7446 8.4108 105.8256 45.6092 0.0000 172.9146 227 V 4.3976 7.4928 121.6795 60.6523 34.1209 174.0950 228 Y 4.9356 7.9996 124.3348 56.0013 41.9161 175.0931 229 T 4.3495 8.4781 119.3402 63.6169 70.0744 174.4842 230 K 5.0665 9.1265 127.7935 55.0627 30.9630 177.1082 231 V 3.9145 8.6523 125.1503 65.9520 31.4137 174.7318 232 C 4.3855 8.4036 112.5565 58.6165 41.3825 175.0128 233 N 4.2524 8.1349 116.8468 54.4909 38.5070 175.0987 234 Y 4.7581 8.0562 117.7484 57.5367 39.2192 177.5626 235 V 3.6941 8.0622 121.4004 66.3688 31.4823 178.0296 236 S 4.1305 8.1151 114.3210 61.2155 62.7186 176.4036 237 W 4.0998 8.2328 130.5288 60.4905 30.5521 177.7836 238 I 3.1487 8.2234 119.9702 64.2356 36.5770 178.3616 239 K 3.7249 8.0411 119.0777 59.6260 31.8633 179.3974 240 Q 3.8568 8.0769 118.1219 59.2422 28.4361 179.0232 241 T 3.5148 7.4000 115.5062 66.5478 68.7161 176.4870 242 I 2.7843 7.3375 121.6742 63.7809 36.7401 178.2869 243 A 3.9404 7.5586 120.7681 55.0625 18.3533 179.1105 244 S 4.4367 7.9436 109.3490 59.0086 63.3995 174.0601 245 N 4.6714 7.8409 125.4808 53.7963 39.1816 174.0037 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 4.32 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 1.42 0.53 0.91 0.00 0.00 17 V 8.56 4.41 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 1.04 0.00 0.00 0.95 0.00 0.00 18 G 8.42 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 0.00 0.00 0.00 19 G 7.81 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 7.78 4.97 0.00 2.92 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 21 T 8.59 4.27 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 1.26 0.00 0.00 22 C 8.73 4.37 0.00 2.75 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 8.55 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 0.00 0.00 0.00 24 A 8.46 4.30 1.33 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 0.00 0.00 25 N 8.85 4.26 0.00 2.84 2.89 0.00 0.00 7.24 7.56 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 26 T 7.62 4.17 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 1.35 0.00 0.00 27 V 7.06 4.04 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 0.25 0.00 0.00 0.76 0.00 0.00 28 P 0.00 4.58 0.00 2.39 2.43 0.00 3.79 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.95 0.00 29 Y 6.84 4.98 0.00 3.16 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 30 Q 7.16 4.64 0.00 1.82 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.53 0.00 0.00 0.00 0.00 0.00 1.94 2.51 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 0.77 0.00 0.00 1.00 0.00 0.00 32 S 8.64 4.88 0.00 3.05 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 33 L 8.45 4.66 0.00 0.55 0.87 0.75 0.14 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 34 N 9.01 5.83 0.00 2.43 2.47 0.00 0.00 6.55 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 *37 S 8.49 4.40 0.00 3.72 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 38 G 9.75 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 39 Y 6.71 4.54 0.00 3.02 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 40 H 8.85 4.58 0.00 2.86 3.17 0.00 5.86 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 7.87 4.91 0.00 2.99 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 42 C 6.77 4.76 0.00 2.26 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 43 G 8.59 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 G 7.99 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 0.00 0.00 0.00 0.00 45 S 8.72 5.50 0.00 3.82 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 46 L 9.33 4.60 0.00 1.84 1.67 1.08 0.78 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 47 I 8.70 4.34 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 0.90 1.01 0.00 0.00 48 N 7.66 4.94 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 8.71 4.39 0.00 4.16 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 50 Q 9.09 4.59 0.00 2.10 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 6.67 0.00 0.00 0.00 0.00 0.00 2.07 2.19 0.00 51 W 8.36 5.58 0.00 3.27 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 52 V 8.96 5.16 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 1.08 0.00 0.00 0.98 0.00 0.00 53 V 8.76 4.95 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 1.01 0.00 0.00 54 S 8.90 5.13 0.00 3.87 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 55 A 8.71 4.80 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 56 A 8.29 3.83 0.19 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 57 H 8.35 4.55 0.00 3.37 3.55 0.00 5.54 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 58 C 7.91 4.79 0.00 3.14 3.26 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 59 Y 7.82 4.17 0.00 2.99 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 60 K 5.85 3.51 0.00 1.50 1.38 0.00 0.61 0.00 0.00 1.23 0.00 0.00 2.48 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.88 0.86 7.81 61 S 8.17 4.35 0.00 3.95 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 G 8.29 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 0.00 0.00 0.00 63 I 7.26 4.45 1.84 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 1.36 1.38 0.91 0.00 0.00 64 Q 8.72 4.63 0.00 1.99 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.88 0.00 0.00 0.00 0.00 0.00 2.07 2.21 0.00 65 V 8.79 4.43 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 0.00 0.00 0.89 0.00 0.00 65A R 8.72 5.06 0.00 1.65 1.66 0.00 2.67 0.00 0.00 2.41 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 1.14 0.00 66 L 8.92 4.68 0.00 1.64 1.62 0.96 0.74 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 4.06 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 70 E 8.24 4.59 0.00 2.14 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.06 0.00 71 D 7.96 4.86 0.00 2.73 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 72 N 8.40 5.25 0.00 2.68 2.83 0.00 0.00 7.19 7.74 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 73 I 8.34 4.04 1.45 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.96 -0.47 0.00 0.00 74 N 8.71 4.76 0.00 2.79 2.88 0.00 0.00 6.64 7.72 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 75 V 7.33 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 0.95 0.00 0.00 76 V 8.39 4.17 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 0.98 0.00 0.00 77 E 9.60 4.55 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 2.42 0.00 78 G 9.03 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 0.00 0.00 0.00 79 N 9.07 4.61 0.00 2.90 3.18 0.00 0.00 7.00 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 7.61 4.62 0.00 1.60 1.77 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 2.64 2.46 0.00 81 Q 8.86 4.46 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.65 6.77 0.00 0.00 0.00 0.00 0.00 2.24 2.30 0.00 82 F 8.88 5.56 0.00 2.78 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 8.70 4.74 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 0.80 0.95 0.00 0.00 84 S 8.59 4.76 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 8.03 4.39 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 86 S 9.16 4.38 0.00 3.71 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 7.68 4.84 0.00 1.86 1.84 0.00 1.70 0.00 0.00 1.97 0.00 0.00 2.86 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.45 7.81 88 S 8.78 5.16 0.00 4.10 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 89 I 9.17 4.50 2.05 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.95 1.10 0.00 0.00 90 V 8.34 4.22 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.76 0.00 0.00 91 H 8.55 3.80 0.00 2.82 3.10 0.00 5.65 0.00 0.00 0.00 0.00 6.76 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 4.32 0.00 2.06 2.12 0.00 3.09 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 2.09 2.20 0.00 93 S 7.90 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 7.80 4.32 0.00 2.99 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 N 8.10 4.51 0.00 2.58 2.43 0.00 0.00 6.58 7.60 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 96 S 7.95 3.79 0.00 3.93 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 97 N 8.77 4.40 0.00 2.71 2.78 0.00 0.00 6.81 7.76 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 98 T 7.73 4.00 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 1.14 0.00 0.00 99 L 7.78 3.76 0.00 1.51 1.91 0.75 1.39 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 0.00 100 N 7.66 4.53 0.00 2.74 2.64 0.00 0.00 7.26 6.56 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 0.00 101 N 8.63 4.59 0.00 3.07 2.59 0.00 0.00 7.23 8.31 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 0.00 102 D 7.70 4.74 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 4.91 1.45 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 1.34 1.25 0.12 0.00 0.00 104 M 9.01 5.38 0.00 2.13 1.81 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 2.74 2.64 0.00 105 L 9.14 5.37 0.00 1.78 1.80 0.21 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.88 5.05 1.92 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 1.17 0.89 0.00 0.00 107 K 8.61 3.74 0.00 0.79 1.07 0.00 1.28 0.00 0.00 1.36 0.00 0.00 2.65 0.00 0.00 2.93 0.00 0.00 0.00 0.00 0.65 0.21 7.81 108 L 8.03 4.58 0.00 1.47 1.53 0.96 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 109 K 8.94 4.17 0.00 1.72 1.80 0.00 1.74 0.00 0.00 1.73 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.35 7.81 110 S 7.69 4.60 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 8.34 4.44 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 8.66 4.51 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 8.69 4.62 0.00 3.78 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 8.46 4.74 0.00 1.66 1.62 0.99 1.08 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 0.00 115 N 8.81 4.46 0.00 2.71 2.56 0.00 0.00 6.90 7.70 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 0.00 116 S 8.84 4.51 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 8.97 4.16 0.00 2.00 2.02 0.00 3.12 0.00 0.00 3.10 7.38 0.00 0.00 0.00 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1.20 0.00 0.00 *127 S 7.60 5.01 0.00 4.00 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 0.00 128 C 8.38 4.48 0.00 2.95 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 0.00 129 A 7.92 4.46 1.05 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 0.00 0.00 130 S 7.96 4.42 0.00 3.83 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 *132 A 8.12 4.27 1.25 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 0.00 0.00 133 G 9.16 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 0.00 134 T 7.54 3.98 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 1.14 0.00 0.00 135 Q 8.53 4.72 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.90 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 136 C 9.24 5.24 0.00 2.78 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 8.98 5.17 0.00 1.76 1.57 1.04 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 138 I 9.18 5.29 1.88 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 0.76 1.65 0.97 0.00 0.00 139 S 8.79 4.92 0.00 3.51 3.61 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 0.00 140 G 7.28 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 141 W 8.46 4.65 0.00 3.12 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 0.00 142 G 8.04 4.22 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 0.00 0.00 0.00 143 N 8.77 3.82 0.00 2.26 2.67 0.00 0.00 7.00 7.51 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 0.00 144 T 8.16 5.23 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 1.31 0.00 0.00 145 K 7.93 4.64 0.00 1.87 1.69 0.00 1.70 0.00 0.00 1.70 0.00 0.00 3.05 0.00 0.00 3.32 0.00 0.00 0.00 0.00 1.30 1.32 7.81 146 S 8.52 4.53 0.00 3.99 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 0.00 147 S 7.88 4.45 0.00 3.82 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 0.00 148 G 8.09 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 0.00 149 T 8.20 4.43 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 1.29 0.00 0.00 150 S 9.14 4.36 0.00 3.75 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 8.56 4.99 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 0.00 152 P 0.00 4.75 0.00 2.41 2.12 0.00 4.18 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 2.17 2.06 0.00 153 D 8.67 4.71 0.00 2.80 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 0.00 154 V 7.40 5.82 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 0.97 0.00 0.00 155 L 8.52 3.08 0.00 1.21 1.26 -0.75 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.25 4.93 0.00 1.67 1.51 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.84 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.48 7.81 157 C 8.40 5.30 0.00 1.60 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 0.00 0.00 0.00 0.00 158 L 8.53 4.98 0.00 1.71 1.45 1.01 0.71 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 8.94 5.19 0.00 1.82 1.81 0.00 1.89 0.00 0.00 1.78 0.00 0.00 2.79 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.62 7.81 160 A 9.04 4.82 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 0.00 161 P 0.00 4.98 0.00 2.03 2.27 0.00 3.11 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.79 0.00 162 I 8.30 4.38 1.86 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.81 0.71 0.00 0.00 163 L 8.79 4.85 0.00 1.53 1.61 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 164 S 8.38 4.43 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 8.74 4.42 0.00 2.76 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 0.00 166 S 8.02 4.16 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 8.00 4.14 0.00 3.90 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 0.00 168 C 8.40 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 8.52 3.98 0.00 1.95 1.89 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.53 1.67 7.81 170 S 8.13 4.16 0.00 3.88 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 7.76 4.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 172 Y 7.85 4.87 0.00 3.11 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173 P 0.00 4.72 0.00 2.21 2.10 0.00 3.61 0.00 0.00 2.15 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 8.97 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 0.00 175 Q 8.24 4.52 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 7.04 0.00 0.00 0.00 0.00 0.00 2.28 2.57 0.00 176 I 7.86 4.39 1.98 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.09 1.00 0.00 0.00 177 T 8.24 4.53 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 8.54 4.53 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 8.26 5.14 0.00 2.94 3.07 0.00 0.00 6.70 7.51 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 0.00 180 M 8.26 5.91 0.00 1.82 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 2.44 0.00 181 F 8.19 5.07 0.00 2.96 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 0.00 182 C 9.31 5.81 0.00 2.98 3.09 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 0.00 183 A 9.02 5.06 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 0.00 184 G 6.93 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 184A Y 8.33 4.63 0.00 3.02 3.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 185 L 8.58 4.07 0.00 1.73 1.73 0.92 0.86 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 0.00 186 E 8.23 4.18 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 7.88 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 188 G 9.12 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 0.00 0.00 0.00 188A K 7.27 4.80 0.00 1.43 1.67 0.00 0.85 0.00 0.00 1.37 0.00 0.00 2.43 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.18 7.81 189 D 8.82 4.67 0.00 2.81 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 0.00 190 S 8.69 4.92 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 0.00 191 C 9.21 4.73 0.00 2.96 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 0.00 192 Q 8.63 4.35 0.00 2.24 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.15 5.27 0.00 0.00 0.00 0.00 0.00 2.64 2.52 0.00 193 G 9.24 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 0.00 0.00 0.00 194 D 8.57 4.60 0.00 3.00 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 0.00 195 S 8.04 4.37 0.00 3.93 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 0.00 196 G 8.85 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 0.00 197 G 7.92 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 0.00 198 P 0.00 5.15 0.00 2.28 2.31 0.00 3.70 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.26 0.00 199 V 8.42 4.56 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.63 0.00 0.00 200 V 8.68 4.87 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 0.77 0.00 0.00 0.58 0.00 0.00 201 C 8.69 5.16 0.00 2.81 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 0.00 202 S 9.84 3.69 0.00 3.92 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 0.00 203 G 8.42 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 7.90 4.39 0.00 1.68 1.64 0.00 1.84 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.44 7.81 *209 L 8.29 4.17 0.00 1.51 1.63 0.99 0.74 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 0.00 210 Q 8.87 4.57 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.69 6.36 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 211 G 8.05 5.27 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 0.00 212 I 8.13 5.20 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 1.06 0.97 0.00 0.00 213 V 8.94 3.82 2.35 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 0.88 0.00 0.00 1.20 0.00 0.00 214 S 8.52 4.83 0.00 3.87 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 W 7.62 5.10 0.00 3.34 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 G 8.41 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 0.00 217 S 8.56 4.69 0.00 4.14 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 4.35 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 0.00 220 C 8.09 4.98 0.00 2.95 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 0.00 221 A 9.28 3.97 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221A Q 7.33 4.56 0.00 2.27 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.14 6.95 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 222 K 8.42 4.17 0.00 1.72 1.72 0.00 1.93 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.42 1.48 7.81 223 N 9.22 4.23 0.00 2.82 2.84 0.00 0.00 6.77 7.47 0.00 0.00 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 7.44 4.25 0.00 1.70 1.81 0.00 1.67 0.00 0.00 1.40 0.00 0.00 2.97 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.45 1.49 7.81 225 P 0.00 4.57 0.00 2.13 2.12 0.00 3.66 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 2.10 1.99 0.00 226 G 8.41 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 0.00 0.00 0.00 227 V 7.49 4.40 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 0.26 0.00 0.00 -0.66 0.00 0.00 228 Y 8.00 4.94 0.00 1.43 2.35 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 0.00 229 T 8.48 4.35 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 1.17 0.00 0.00 230 K 9.13 5.07 0.00 2.03 1.89 0.00 1.83 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.68 7.81 231 V 8.65 3.91 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 1.13 0.00 0.00 1.11 0.00 0.00 232 C 8.40 4.39 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 8.13 4.25 0.00 2.33 2.43 0.00 0.00 7.00 7.77 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 0.00 234 Y 8.06 4.76 0.00 3.06 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 0.00 235 V 8.06 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 1.12 0.00 0.00 1.15 0.00 0.00 236 S 8.12 4.13 0.00 3.98 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 8.23 4.10 0.00 3.49 3.61 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 0.00 238 I 8.22 3.15 2.04 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 1.68 1.13 0.79 0.00 0.00 239 K 8.04 3.72 0.00 1.86 1.79 0.00 1.66 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 1.40 1.64 7.81 240 Q 8.08 3.86 0.00 1.96 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.50 0.00 241 T 7.40 3.51 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 0.68 0.00 0.00 242 I 7.34 2.78 1.44 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.31 0.43 0.00 0.00 243 A 7.56 3.94 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 0.00 244 S 7.94 4.44 0.00 3.99 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 7.84 4.67 0.00 2.99 3.01 0.00 0.00 6.75 7.61 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 * Residues marked with a * may have inaccurate shift predictions.