NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2591 8.2493 123.5728 52.1056 19.5640 175.3994 2 S 4.6455 7.8679 113.1985 53.5736 66.5087 173.6216 3 K 4.2730 8.6846 120.6556 60.0531 33.2158 180.5656 4 G 4.2525 8.0544 107.7783 47.0855 0.0000 174.9928 5 E 4.1455 7.9876 120.5089 59.0894 29.3483 178.6596 6 E 4.1044 7.9974 117.6809 58.7559 29.5491 178.4038 7 L 4.0683 7.9277 117.4072 55.7401 40.9843 177.3180 8 F 4.9359 8.1334 117.7120 57.3049 39.7313 177.1729 9 T 4.1770 8.2173 112.6322 63.3901 69.1357 173.6918 10 G 4.3770 7.1309 107.3502 43.6164 0.0000 171.4274 11 V 4.1418 8.4147 119.4962 62.7420 32.3530 176.5622 12 V 4.6573 8.7839 128.2024 60.2664 34.2151 173.0470 13 P 4.8461 0.0000 0.0000 62.9014 33.1732 175.0384 14 I 5.0506 8.6585 122.0479 59.5727 40.9130 174.3890 15 L 5.2109 8.9209 125.6933 52.8686 45.3041 175.5777 16 V 4.9424 8.8994 123.1071 61.1571 34.7387 173.9823 17 E 5.1581 9.4830 126.8350 54.5266 33.3052 174.4146 18 L 5.2058 9.1042 125.9793 53.3073 45.7461 174.5545 19 D 5.1623 9.0634 125.6849 52.4432 43.8266 175.4619 20 G 3.5973 8.4434 109.5812 44.2447 0.0000 171.3594 21 D 5.0552 8.6714 120.7801 52.8793 44.6232 174.2666 22 V 4.6938 8.8123 127.1282 61.2669 33.9836 175.1102 23 N 4.3472 10.2477 127.0757 54.4209 36.6304 175.8282 24 G 3.8188 8.5428 104.6321 45.7836 0.0000 174.2733 25 H 4.5160 8.2682 118.4010 54.8963 28.2667 174.3648 26 K 5.1269 8.3848 124.4802 55.5522 33.5587 176.2958 27 F 5.0022 8.3851 117.0479 56.0821 41.6999 173.0398 28 S 5.2736 8.6165 114.0641 56.8103 66.8235 173.2982 29 V 5.1110 8.8488 122.2624 61.3553 34.8160 174.2518 30 S 5.2977 9.4006 123.4636 56.7431 65.7988 173.3380 31 G 4.3533 9.6087 111.4270 44.4583 0.0000 171.6639 32 E 5.0263 8.8685 120.5812 53.7146 33.9987 175.8964 33 G 4.0898 7.8267 109.6177 46.1673 0.0000 171.3480 34 E 4.8995 7.9991 119.6967 55.2258 33.5231 174.9337 35 G 3.3337 8.4943 107.4137 44.2523 0.0000 171.5001 36 D 5.2509 9.1162 122.6635 51.7480 42.0260 175.7008 37 A 4.5407 9.0238 127.9298 54.8727 19.0584 179.9828 38 T 3.7373 8.1387 111.8736 66.3307 68.4234 174.3997 39 Y 4.6702 7.9696 115.6671 56.7155 38.7113 175.5448 40 G 4.6288 8.0974 108.3942 46.5054 0.0000 172.7294 41 K 4.6001 8.1415 119.5596 54.0540 34.8685 174.4692 42 L 5.0687 8.4826 127.1535 52.9354 45.4000 175.5133 43 T 4.8339 8.5282 113.2515 59.9094 71.4883 172.8949 44 L 4.9678 8.7504 125.7004 52.4922 46.7177 175.2935 45 K 4.7484 8.5628 123.8158 54.5769 34.8772 174.5379 46 F 5.4394 9.1568 126.3407 55.8082 41.8869 174.6872 47 I 5.0516 8.9942 123.4639 59.5630 40.7867 174.2424 48 C 5.0225 9.6592 128.7379 59.5849 31.3825 173.2231 49 T 4.5226 9.0340 117.1876 62.2849 69.0452 175.5014 50 T 4.5151 8.0271 111.2100 61.0574 70.4581 173.6090 51 G 4.0748 7.8985 107.5226 44.4078 0.0000 175.3045 52 K 4.1843 8.5770 126.8134 55.5524 32.6926 176.1419 53 L 3.6827 9.0563 129.2819 54.3142 42.1804 175.3683 54 P 4.3627 0.0000 0.0000 63.1997 31.8091 175.8242 55 V 4.1695 6.2612 111.5068 58.5699 35.5608 173.5159 56 P 4.4163 0.0000 0.0000 62.0702 32.1030 177.5700 57 W 4.3216 9.1243 122.8951 59.9410 28.9353 177.0613 58 P 4.4251 0.0000 0.0000 65.6195 30.5624 178.2723 59 T 4.3979 7.9678 107.2127 63.4844 69.0639 175.4968 60 L 4.6503 8.0742 121.3209 54.8005 42.3300 178.3018 61 V 3.4689 7.7317 119.7376 66.2825 31.4583 177.9789 62 T 4.0790 7.8592 108.9582 65.0399 68.4241 176.5565 63 T 4.0584 7.9314 117.4323 66.6670 68.7597 176.4079 64 L 4.2060 8.1881 119.9405 56.9012 41.8961 178.5162 65 T 4.5460 8.0132 107.9643 61.2553 69.2443 176.0056 66 F 4.4969 8.4047 125.5942 61.8170 39.3374 177.0821 67 G 3.8095 8.2166 104.8424 46.2038 0.0000 174.1596 68 V 4.5282 7.7757 113.1839 61.3065 32.0762 177.6879 69 Q 3.9057 7.8352 121.3882 58.1006 28.4474 178.1300 70 C 4.0430 7.8802 111.9584 60.1231 29.8172 174.1417 71 F 4.6243 8.1113 119.1061 57.3749 38.8699 175.5784 72 S 4.6449 7.6987 117.8808 58.8429 63.6003 174.2565 73 R 4.3838 9.0802 125.0849 56.1443 30.7719 174.6810 74 Y 4.5242 8.6220 125.1528 55.8840 39.0690 174.2626 75 P 4.3115 0.0000 0.0000 62.5736 32.5443 176.5045 76 D 4.4112 9.1055 121.6187 57.9428 40.9691 178.4297 77 H 4.4940 8.2700 111.2000 57.4362 28.8592 175.3636 78 M 4.6572 8.1894 120.1746 54.8963 32.4943 177.6750 79 K 3.9769 8.0837 120.1037 59.5553 32.8189 178.5475 80 Q 4.2030 8.0010 116.4438 57.2990 28.6896 175.8276 81 H 4.6911 8.1672 114.7189 55.5424 28.9927 175.1455 82 D 3.8347 7.1244 122.0724 52.0830 39.6051 176.2905 83 F 4.1637 8.1357 127.7930 60.0753 39.2944 176.1131 84 F 3.9253 7.6324 115.3398 60.7130 39.1654 177.5143 85 K 4.0198 8.1120 117.9119 59.1526 31.5316 179.6250 86 S 4.1769 7.4777 113.6662 60.3343 63.1751 175.7438 87 A 4.0302 7.4099 123.4263 52.7549 18.3113 177.0593 88 M 4.7169 7.1556 116.7443 53.8827 33.4787 174.6893 89 P 4.7923 0.0000 0.0000 64.2553 32.3208 178.1864 90 E 3.8624 8.1688 118.8551 57.9027 29.8846 177.1089 91 G 4.3040 10.2311 104.6410 45.5770 0.0000 171.1304 92 Y 5.3904 7.6209 114.3544 55.8346 41.8100 173.8355 93 V 4.7318 8.9885 120.7969 61.7675 33.8365 174.6423 94 Q 5.2085 9.1041 125.4518 54.2644 32.6361 174.1681 95 E 5.4735 9.4969 121.6236 54.8177 33.9359 174.6456 96 A 5.1720 8.9241 122.6099 50.8228 23.6201 175.0700 97 T 4.9599 8.8175 116.2522 61.8144 71.8639 173.2516 98 I 4.4106 9.0259 127.9751 59.6367 39.8699 174.9118 99 S 4.7117 8.5627 124.9808 56.6667 64.8770 173.6803 100 F 4.6951 8.7005 125.2695 55.9834 39.9115 175.7785 101 K 4.0518 8.7350 126.1625 58.0485 32.3671 175.8869 102 D 4.5205 9.0292 123.8374 54.9315 38.6289 173.1440 103 D 4.3204 7.8335 118.4988 53.8850 43.8405 173.4011 104 G 2.9506 7.4514 106.7264 44.4048 0.0000 171.5924 105 N 5.6099 7.8843 115.0105 51.4752 41.1733 173.0612 106 Y 5.6350 9.0794 118.7925 56.8227 40.5750 174.7000 107 K 5.3305 9.4586 123.0672 54.8486 35.6460 175.3557 108 T 5.2677 9.1462 114.4708 59.9252 72.6927 172.7788 109 R 5.2477 8.9328 122.2714 54.8455 33.6073 173.7804 110 A 5.1730 9.2969 126.5442 50.5797 23.5944 174.4320 111 E 5.0779 9.1302 118.6438 54.3585 33.4250 175.5150 112 V 4.8864 8.1724 123.8236 59.7529 34.2484 174.7733 113 K 4.6557 8.4272 122.0659 55.9614 36.2973 174.3618 114 F 4.6906 8.7633 120.0875 57.1748 40.1885 176.0256 115 E 4.5255 9.2926 122.8203 55.0455 31.2922 176.9684 116 G 3.8244 8.1736 116.6517 47.2911 0.0000 172.5619 117 D 4.8256 8.9255 124.6231 54.1726 41.0695 175.4185 118 T 4.7826 7.8094 117.3260 61.7616 71.0000 173.4886 119 L 3.9354 8.6264 128.8532 54.2122 43.3857 175.3307 120 V 4.7788 8.5736 126.9534 60.9911 34.0429 173.6145 121 N 5.3139 9.1939 126.1985 51.9298 41.6654 172.9068 122 R 5.1866 8.8510 125.5099 54.4933 33.1620 175.1162 123 I 5.0560 8.9003 124.1698 59.5068 41.6422 174.0736 124 E 5.0349 9.4476 125.6605 54.4059 32.4670 174.6505 125 L 5.1883 8.8368 126.3793 52.9855 45.4282 174.7898 126 K 5.0199 9.3514 127.3597 54.6146 35.0732 174.6770 127 G 5.5950 9.5873 115.3936 45.5291 0.0000 171.9270 128 I 5.2030 8.1220 115.8736 59.4195 41.8508 174.3421 129 D 4.4224 8.8306 118.9972 55.2422 39.3867 173.7162 130 F 4.4312 8.3151 115.1169 56.4043 39.8222 175.4498 131 K 4.3441 9.3321 124.1862 55.6464 32.7564 178.1177 132 E 4.0280 9.0401 123.4781 59.0076 29.5324 177.3259 133 D 4.8805 7.8333 116.9321 53.6538 42.1571 175.7484 134 G 4.0033 7.7682 108.1253 44.2543 0.0000 174.7915 135 N 4.3769 8.0157 112.2968 55.7817 38.5530 177.2409 136 I 3.7811 7.2275 119.2385 63.4278 37.8783 177.9512 137 L 3.7714 7.5883 121.2290 57.2236 41.7497 178.4370 138 G 3.7080 7.9824 105.6267 45.2095 0.0000 173.0151 139 H 3.9243 7.5605 116.0836 57.3603 26.4481 174.9175 140 K 4.5988 8.3229 114.7674 56.1504 33.9665 177.3048 141 L 5.0957 7.7000 120.1374 52.9089 43.2705 176.4566 142 E 4.1010 8.9871 123.2948 56.7618 30.4065 177.3766 143 Y 4.5100 8.5956 124.8857 55.4936 37.3236 173.4310 144 N 4.9212 7.6768 119.9459 52.2581 40.2983 174.3825 145 Y 4.5169 8.0661 118.9378 56.6868 40.4456 173.8696 146 N 4.5680 8.2662 125.1176 52.9478 39.4200 175.3170 147 S 4.6661 8.3240 117.0157 59.4606 63.7938 173.0253 148 H 4.7739 8.7593 117.3278 55.1317 32.0067 171.8783 149 N 5.1790 8.5312 115.5656 51.5042 41.6383 174.4558 150 V 4.0499 8.0201 121.1661 61.2549 34.1752 174.0396 151 Y 4.8503 8.6839 126.8393 57.3751 39.1555 174.7733 152 I 5.1972 9.0222 126.4485 59.8798 39.7563 175.0636 153 T 4.9642 8.8465 115.4159 59.6812 72.4052 173.1806 154 A 4.3027 8.6344 124.6003 52.0986 19.7703 177.1278 155 D 4.7499 8.7415 120.7553 52.0579 41.0633 176.5841 156 K 4.0567 8.3374 123.1210 58.7323 32.9334 179.4224 157 Q 3.9782 8.3673 117.1453 58.5403 28.5992 177.6147 158 K 4.3867 7.9372 112.9673 55.2411 32.5965 175.2831 159 N 4.2601 8.0201 116.3342 54.0365 38.2866 173.6362 160 G 3.9095 7.8930 104.6753 45.0908 0.0000 172.4126 161 I 5.0234 7.5262 112.4486 59.1017 41.6045 174.6027 162 K 5.2591 9.0510 121.5855 54.6913 36.0585 175.1445 163 A 5.4573 9.1949 123.1744 50.5456 23.1452 174.9029 164 N 5.6774 9.1821 117.4555 51.6897 42.9053 173.6266 165 F 5.1800 8.2064 115.3342 56.5190 41.8182 172.5049 166 K 4.9564 9.0034 118.8493 54.7746 34.4417 175.6963 167 I 4.2971 8.5936 125.4171 59.7150 39.7088 175.1074 168 R 4.9011 8.2553 125.1089 54.6336 31.5963 175.0083 169 H 4.5834 9.1248 122.4368 55.4759 30.4563 174.5685 170 N 5.1212 8.7410 119.7973 52.8171 39.9800 174.5226 171 I 4.5406 8.7062 125.3609 60.6111 38.2415 177.3845 172 E 4.0274 9.0181 125.7282 59.1494 29.4318 177.8444 173 D 4.5314 8.0238 116.1512 53.6228 39.7490 177.0687 174 G 3.9351 8.3368 109.1957 45.2568 0.0000 173.7733 175 S 4.6154 8.3721 114.8887 57.3776 65.1934 172.2248 176 V 4.8406 8.2100 118.2160 61.2596 34.4070 175.2242 177 Q 4.5644 9.2413 129.4023 54.3014 30.6300 174.0833 178 L 4.6835 8.5172 129.3512 54.7242 43.9022 175.2643 179 A 4.6049 9.0717 127.4957 49.9058 21.7625 174.4513 180 D 4.5865 8.6783 123.1836 54.7837 42.8868 174.8017 181 H 5.0255 8.8744 123.1005 53.9424 32.0118 172.3859 182 Y 5.3103 8.6701 123.3391 56.0798 41.7545 173.8882 183 Q 5.0761 9.0913 125.4166 54.1497 32.8195 174.6040 184 Q 4.9357 9.3354 121.4456 54.1842 33.0811 174.0082 185 N 5.5847 9.2568 120.7931 51.7948 42.3936 173.5834 186 T 5.0094 9.0687 119.4938 60.9610 72.4750 171.9696 187 P 4.8882 0.0000 0.0000 63.1976 31.6628 176.4592 188 I 4.0647 8.8647 124.2955 63.6166 38.0027 177.0827 189 G 3.9152 8.0383 109.4194 45.1423 0.0000 172.8140 190 D 4.6176 8.4139 117.6398 54.4404 41.5220 177.6383 191 G 3.8594 7.7316 108.2211 43.9139 0.0000 171.6224 192 P 4.3970 0.0000 0.0000 62.6672 31.8347 175.9830 193 V 4.4011 7.9156 112.2734 59.3230 34.9481 175.0242 194 L 4.2477 8.5148 121.8308 53.9201 42.0073 176.3305 195 L 4.5713 8.3601 124.5848 52.2856 42.2466 174.6081 196 P 4.6970 0.0000 0.0000 61.9301 32.4195 175.9762 197 D 4.6535 8.6049 119.4467 53.8662 41.5302 175.9971 198 N 4.8474 8.5390 118.5511 54.7131 39.3291 174.0904 199 H 4.9283 8.6013 116.9756 55.5739 32.5635 171.6080 200 Y 5.2198 8.3479 115.2811 55.6351 42.0623 173.9793 201 L 4.8004 8.6557 120.5314 53.1573 43.9504 175.6969 202 S 4.9922 8.9667 120.3590 57.1446 63.7858 172.8261 203 T 5.2788 8.8671 124.3499 61.6633 71.7139 173.0756 204 Q 5.0195 9.2163 123.3198 54.6114 31.8968 174.4250 205 S 5.2565 8.9426 116.9960 56.7508 67.3599 173.0568 206 A 4.7361 9.1407 125.0885 50.1873 21.5911 174.8132 207 L 5.1077 8.5070 122.8769 53.4015 43.8418 176.0343 208 S 4.8871 9.1562 117.0563 57.4483 67.0909 172.4309 209 K 4.9381 8.4824 117.8170 54.5377 35.4904 176.0253 210 D 4.5445 8.9423 123.4400 52.8206 41.3337 175.3289 211 P 4.4032 0.0000 0.0000 64.8329 31.5155 176.5599 212 N 4.6597 8.4866 115.5402 52.8714 38.9170 173.9169 213 E 4.3958 7.9431 120.6764 54.6390 30.2323 175.7378 214 K 4.3107 8.4561 125.2917 57.3084 33.0996 177.4825 215 R 4.2053 8.0636 117.8255 55.4717 30.7693 175.6540 216 D 4.7995 8.6487 120.6692 54.9754 42.2363 174.7548 217 H 4.9304 8.5258 119.8520 55.1679 31.9102 172.3913 218 M 4.5928 8.1117 117.8176 53.0096 35.5607 173.4550 219 V 4.6288 8.5872 126.2916 61.2653 33.9196 174.0571 220 L 5.1202 9.0467 129.8780 53.1037 45.2213 174.4443 221 L 5.0124 8.6949 128.3726 53.2884 44.2278 174.5605 222 E 5.1504 8.8642 126.8515 54.3833 33.5685 173.9402 223 F 5.3160 9.2466 124.4435 55.6906 42.4798 174.4930 224 V 4.8538 9.1235 122.7688 61.5578 34.7869 174.1833 225 T 5.0539 8.8040 123.7113 61.5617 72.1914 173.4340 226 A 4.3430 8.5851 128.2966 52.0111 19.4714 176.1676 227 A 4.1161 8.5144 121.4013 51.1065 23.1622 177.2777 228 G 4.0774 9.0506 106.2111 45.2442 0.0000 173.6715 229 I 4.5103 7.4445 120.2310 59.5557 39.7893 174.9573 230 T 4.7198 8.1559 116.4017 60.0362 71.0806 173.5398 *236 L 4.0351 8.3035 118.8785 54.6854 43.5157 176.4286 237 Y 4.3707 7.6373 120.3455 58.0533 38.6405 175.1355 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 A 8.25 4.26 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 2 S 7.87 4.65 0.00 3.98 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 3 K 8.68 4.27 0.00 2.02 2.08 0.00 1.37 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.46 1.54 7.81 4 G 8.05 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 0.00 0.00 0.00 0.00 5 E 7.99 4.15 0.00 2.04 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 0.00 2.35 2.39 0.00 6 E 8.00 4.10 0.00 2.05 1.99 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 2.35 2.43 0.00 7 L 7.93 4.07 0.00 1.28 0.94 0.46 0.29 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 8 F 8.13 4.94 0.00 3.26 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 9 T 8.22 4.18 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 10 G 7.13 4.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 V 8.41 4.14 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 0.83 0.00 0.00 1.02 0.00 0.00 12 V 8.78 4.66 2.57 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 1.27 0.00 0.00 1.09 0.00 0.00 13 P 0.00 4.85 0.00 2.14 2.14 0.00 3.91 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 2.10 2.01 0.00 14 I 8.66 5.05 1.75 0.00 0.00 0.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.13 0.91 0.00 0.00 15 L 8.92 5.21 0.00 1.53 1.51 0.91 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 16 V 8.90 4.94 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 1.17 0.00 0.00 1.08 0.00 0.00 17 E 9.48 5.16 0.00 1.87 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.38 0.00 18 L 9.10 5.21 0.00 1.76 1.67 0.93 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 19 D 9.06 5.16 0.00 2.50 2.38 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 20 G 8.44 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 0.00 0.00 0.00 21 D 8.67 5.06 0.00 2.61 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 22 V 8.81 4.69 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 0.72 0.00 0.00 0.94 0.00 0.00 23 N 10.25 4.35 0.00 2.99 2.97 0.00 0.00 7.14 8.19 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 24 G 8.54 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 0.00 0.00 0.00 25 H 8.27 4.52 0.00 3.42 3.31 0.00 5.80 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.38 5.13 0.00 1.64 1.68 0.00 1.76 0.00 0.00 1.72 0.00 0.00 2.96 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.58 7.81 27 F 8.39 5.00 0.00 2.97 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.62 5.27 0.00 3.84 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 29 V 8.85 5.11 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 1.13 0.00 0.00 30 S 9.40 5.30 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 31 G 9.61 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 32 E 8.87 5.03 0.00 1.76 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.18 0.00 33 G 7.83 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 34 E 8.00 4.90 0.00 2.01 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 2.08 2.15 0.00 35 G 8.49 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 0.00 0.00 0.00 36 D 9.12 5.25 0.00 2.79 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 37 A 9.02 4.54 1.49 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 0.00 0.00 38 T 8.14 3.74 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 39 Y 7.97 4.67 0.00 3.13 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 40 G 8.10 4.63 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 41 K 8.14 4.60 0.00 2.04 1.73 0.00 1.83 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.18 0.81 7.81 42 L 8.48 5.07 0.00 1.54 1.37 0.94 0.48 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 43 T 8.53 4.83 4.12 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 1.07 0.00 0.00 44 L 8.75 4.97 0.00 1.36 0.70 1.00 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 45 K 8.56 4.75 0.00 1.64 1.45 0.00 1.51 0.00 0.00 1.56 0.00 0.00 2.75 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.20 1.29 7.81 46 F 9.16 5.44 0.00 2.74 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 47 I 8.99 5.05 1.97 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 1.14 0.76 1.00 0.00 0.00 48 C 9.66 5.02 0.00 3.10 3.13 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 49 T 9.03 4.52 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 1.34 0.00 0.00 50 T 8.03 4.52 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 1.27 0.00 0.00 51 G 7.90 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 K 8.58 4.18 0.00 1.70 1.69 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.80 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.31 1.34 7.81 53 L 9.06 3.68 0.00 1.14 0.92 -0.03 -1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 54 P 0.00 4.36 0.00 1.96 2.00 0.00 2.65 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 1.46 1.92 0.00 55 V 6.26 4.17 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 0.35 0.00 0.00 0.46 0.00 0.00 56 P 0.00 4.42 0.00 2.16 2.01 0.00 3.41 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 1.99 1.99 0.00 57 W 9.12 4.32 0.00 3.66 3.35 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 58 P 0.00 4.43 0.00 2.28 2.48 0.00 3.71 0.00 0.00 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.23 0.00 59 T 7.97 4.40 4.52 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 1.06 0.00 0.00 60 L 8.07 4.65 0.00 1.88 1.74 0.67 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.73 3.47 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 0.38 0.00 0.00 0.79 0.00 0.00 62 T 7.86 4.08 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 1.48 0.00 0.00 63 T 7.93 4.06 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 64 L 8.19 4.21 0.00 1.26 1.19 0.43 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 65 T 8.01 4.55 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 1.29 0.00 0.00 66 F 8.40 4.50 0.00 3.47 3.20 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 67 G 8.22 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 68 V 7.78 4.53 2.41 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 0.94 0.00 0.00 1.07 0.00 0.00 69 Q 7.84 3.91 0.00 1.47 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.82 0.00 0.00 0.00 0.00 0.00 2.25 2.39 0.00 70 C 7.88 4.04 0.00 2.31 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 71 F 8.11 4.62 0.00 3.29 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 72 S 7.70 4.64 0.00 3.97 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 73 R 9.08 4.38 0.00 2.11 1.84 0.00 3.07 0.00 0.00 3.30 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.62 0.00 74 Y 8.62 4.52 0.00 2.83 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 75 P 0.00 4.31 0.00 1.99 2.00 0.00 3.47 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 2.01 2.03 0.00 76 D 9.11 4.41 0.00 2.77 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.27 4.49 0.00 3.33 3.44 0.00 5.54 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 M 8.19 4.66 0.00 2.13 2.19 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.34 0.00 79 K 8.08 3.98 0.00 1.93 2.09 0.00 1.30 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.54 1.39 7.81 80 Q 8.00 4.20 0.00 1.83 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.07 0.00 0.00 0.00 0.00 0.00 2.32 2.40 0.00 81 H 8.17 4.69 0.00 3.30 3.28 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 82 D 7.12 3.83 0.00 1.58 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 0.00 0.00 0.00 83 F 8.14 4.16 0.00 3.00 2.40 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 84 F 7.63 3.93 0.00 3.09 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 85 K 8.11 4.02 0.00 1.64 1.75 0.00 1.55 0.00 0.00 1.45 0.00 0.00 2.89 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 1.06 7.81 86 S 7.48 4.18 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 87 A 7.41 4.03 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 88 M 7.16 4.72 0.00 2.41 2.45 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.13 2.88 0.00 89 P 0.00 4.79 0.00 2.23 2.07 0.00 3.68 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 2.04 1.89 0.00 90 E 8.17 3.86 0.00 1.98 2.08 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 2.33 2.39 0.00 91 G 10.23 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 92 Y 7.62 5.39 0.00 3.26 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 93 V 8.99 4.73 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 1.13 0.00 0.00 0.96 0.00 0.00 94 Q 9.10 5.21 0.00 1.64 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.51 0.00 0.00 0.00 0.00 0.00 2.43 2.09 0.00 95 E 9.50 5.47 0.00 1.90 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.28 0.00 96 A 8.92 5.17 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 8.82 4.96 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 98 I 9.03 4.41 1.80 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 0.83 0.73 0.11 0.00 0.00 99 S 8.56 4.71 0.00 3.58 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 100 F 8.70 4.70 0.00 3.01 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.73 4.05 0.00 1.68 1.74 0.00 1.92 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.40 7.81 102 D 9.03 4.52 0.00 2.87 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 0.00 103 D 7.83 4.32 0.00 2.61 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 G 7.45 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 0.00 0.00 0.00 105 N 7.88 5.61 0.00 2.92 2.79 0.00 0.00 7.35 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 Y 9.08 5.64 0.00 3.03 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 0.00 107 K 9.46 5.33 0.00 1.71 1.74 0.00 1.65 0.00 0.00 1.76 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.59 7.81 108 T 9.15 5.27 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 1.32 0.00 0.00 109 R 8.93 5.25 0.00 1.91 1.77 0.00 3.08 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 110 A 9.30 5.17 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 E 9.13 5.08 0.00 1.84 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.20 0.00 112 V 8.17 4.89 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.21 0.00 0.00 0.79 0.00 0.00 113 K 8.43 4.66 0.00 2.04 1.94 0.00 1.31 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.26 1.39 7.81 114 F 8.76 4.69 0.00 2.92 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 0.00 115 E 9.29 4.53 0.00 1.94 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 2.21 2.35 0.00 116 G 8.17 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 0.00 0.00 0.00 117 D 8.93 4.83 0.00 2.71 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 0.00 118 T 7.81 4.78 4.39 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 1.25 0.00 0.00 119 L 8.63 3.94 0.00 1.23 1.53 0.94 0.16 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 0.00 120 V 8.57 4.78 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 0.86 0.00 0.00 0.96 0.00 0.00 121 N 9.19 5.31 0.00 2.79 2.66 0.00 0.00 6.72 8.47 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 0.00 122 R 8.85 5.19 0.00 1.76 1.78 0.00 3.11 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 123 I 8.90 5.06 1.90 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.78 0.97 0.00 0.00 124 E 9.45 5.03 0.00 1.83 1.79 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 2.18 2.20 0.00 125 L 8.84 5.19 0.00 1.58 1.28 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 126 K 9.35 5.02 0.00 1.87 1.66 0.00 1.72 0.00 0.00 1.66 0.00 0.00 3.00 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.36 1.47 7.81 127 G 9.59 5.60 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 0.00 0.00 0.00 128 I 8.12 5.20 1.93 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 1.32 0.92 1.00 0.00 0.00 129 D 8.83 4.42 0.00 2.77 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 0.00 130 F 8.32 4.43 0.00 3.26 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 0.00 131 K 9.33 4.34 0.00 1.81 1.74 0.00 1.76 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.39 7.81 132 E 9.04 4.03 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 133 D 7.83 4.88 0.00 2.58 2.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 G 7.77 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.02 4.38 0.00 2.92 2.87 0.00 0.00 7.44 7.30 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 0.00 136 I 7.23 3.78 1.67 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.35 0.37 0.26 0.00 0.00 137 L 7.59 3.77 0.00 1.75 1.62 0.98 0.62 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 0.00 138 G 7.98 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 H 7.56 3.92 0.00 3.28 3.31 0.00 5.62 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 140 K 8.32 4.60 0.00 1.80 1.79 0.00 1.83 0.00 0.00 1.65 0.00 0.00 2.91 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.36 1.30 7.81 141 L 7.70 5.10 0.00 1.56 1.63 0.85 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 0.00 142 E 8.99 4.10 0.00 1.91 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.32 0.00 143 Y 8.60 4.51 0.00 3.03 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 N 7.68 4.92 0.00 2.84 2.80 0.00 0.00 6.07 7.55 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 0.00 145 Y 8.07 4.52 0.00 2.86 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 0.00 146 N 8.27 4.57 0.00 2.59 2.67 0.00 0.00 7.20 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 S 8.32 4.67 0.00 3.76 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 0.00 148 H 8.76 4.77 0.00 3.20 3.27 0.00 5.43 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 N 8.53 5.18 0.00 2.14 1.86 0.00 0.00 6.20 7.68 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 0.00 150 V 8.02 4.05 1.86 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 1.03 0.00 0.00 0.13 0.00 0.00 151 Y 8.68 4.85 0.00 3.29 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 0.00 152 I 9.02 5.20 1.69 0.00 0.00 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 1.46 1.71 0.91 0.00 0.00 153 T 8.85 4.96 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 1.34 0.00 0.00 154 A 8.63 4.30 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 0.00 155 D 8.74 4.75 0.00 2.63 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 156 K 8.34 4.06 0.00 1.86 1.84 0.00 1.74 0.00 0.00 1.82 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.53 1.46 7.81 157 Q 8.37 3.98 0.00 2.04 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 7.07 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 158 K 7.94 4.39 0.00 1.71 1.80 0.00 1.91 0.00 0.00 1.65 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.36 1.40 7.81 159 N 8.02 4.26 0.00 2.87 2.89 0.00 0.00 6.81 8.05 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 0.00 160 G 7.89 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 I 7.53 5.02 1.63 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.80 0.35 0.00 0.00 162 K 9.05 5.26 0.00 1.77 1.89 0.00 1.70 0.00 0.00 1.92 0.00 0.00 3.07 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.38 1.37 7.81 163 A 9.19 5.46 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 164 N 9.18 5.68 0.00 2.83 2.73 0.00 0.00 6.59 7.75 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 0.00 165 F 8.21 5.18 0.00 3.25 3.20 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 0.00 166 K 9.00 4.96 0.00 1.66 1.73 0.00 1.70 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.29 1.37 7.81 167 I 8.59 4.30 1.79 0.00 0.00 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 1.17 0.86 0.57 0.00 0.00 168 R 8.26 4.90 0.00 1.59 1.84 0.00 3.18 0.00 0.00 3.21 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 169 H 9.12 4.58 0.00 3.25 3.26 0.00 5.61 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 0.00 170 N 8.74 5.12 0.00 2.73 2.83 0.00 0.00 7.10 7.21 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 0.00 171 I 8.71 4.54 2.02 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 1.27 0.79 0.99 0.00 0.00 172 E 9.02 4.03 0.00 1.97 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.45 0.00 173 D 8.02 4.53 0.00 2.79 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 0.00 174 G 8.34 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 S 8.37 4.62 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 0.00 176 V 8.21 4.84 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 0.90 0.00 0.00 0.94 0.00 0.00 177 Q 9.24 4.56 0.00 2.22 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.42 2.58 0.00 178 L 8.52 4.68 0.00 1.81 1.50 0.88 0.88 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 0.00 179 A 9.07 4.60 0.79 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 0.00 180 D 8.68 4.59 0.00 2.69 2.38 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 0.00 181 H 8.87 5.03 0.00 1.73 2.25 0.00 5.80 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 182 Y 8.67 5.31 0.00 2.89 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 0.00 183 Q 9.09 5.08 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.54 0.00 0.00 0.00 0.00 0.00 1.54 2.08 0.00 184 Q 9.34 4.94 0.00 1.86 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.76 0.00 0.00 0.00 0.00 0.00 1.91 1.61 0.00 185 N 9.26 5.58 0.00 2.19 2.47 0.00 0.00 6.45 6.65 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 0.00 186 T 9.07 5.01 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 1.31 0.00 0.00 187 P 0.00 4.89 0.00 2.00 2.02 0.00 3.78 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.39 2.32 0.00 188 I 8.86 4.06 2.14 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 1.20 0.56 0.93 0.00 0.00 189 G 8.04 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 0.00 190 D 8.41 4.62 0.00 2.68 2.72 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 0.00 191 G 7.73 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 0.00 192 P 0.00 4.40 0.00 2.17 2.06 0.00 3.69 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.97 0.00 193 V 7.92 4.40 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 0.63 0.00 0.00 1.09 0.00 0.00 194 L 8.51 4.25 0.00 1.61 1.66 0.88 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 195 L 8.36 4.57 0.00 1.62 1.61 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 196 P 0.00 4.70 0.00 2.37 2.40 0.00 3.71 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 2.00 1.99 0.00 197 D 8.60 4.65 0.00 2.59 2.66 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 0.00 198 N 8.54 4.85 0.00 2.67 2.86 0.00 0.00 6.77 8.16 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 0.00 199 H 8.60 4.93 0.00 3.29 3.36 0.00 5.21 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 0.00 200 Y 8.35 5.22 0.00 2.68 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 0.00 201 L 8.66 4.80 0.00 1.48 1.52 0.88 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 202 S 8.97 4.99 0.00 3.99 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 0.00 203 T 8.87 5.28 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 1.25 0.00 0.00 204 Q 9.22 5.02 0.00 2.15 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.76 0.00 0.00 0.00 0.00 0.00 2.42 2.55 0.00 205 S 8.94 5.26 0.00 3.91 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 0.00 206 A 9.14 4.74 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 0.00 207 L 8.51 5.11 0.00 0.99 0.77 0.48 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 208 S 9.16 4.89 0.00 3.86 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 0.00 209 K 8.48 4.94 0.00 1.60 1.70 0.00 1.34 0.00 0.00 1.26 0.00 0.00 2.13 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.17 1.14 7.81 210 D 8.94 4.54 0.00 2.64 2.42 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 0.00 211 P 0.00 4.40 0.00 2.21 2.16 0.00 3.78 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 1.97 1.98 0.00 212 N 8.49 4.66 0.00 2.81 2.85 0.00 0.00 6.81 7.99 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 0.00 213 E 7.94 4.40 0.00 1.89 1.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.24 0.00 214 K 8.46 4.31 0.00 1.78 1.84 0.00 1.79 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.38 1.43 7.81 215 R 8.06 4.21 0.00 1.97 1.94 0.00 3.20 0.00 0.00 3.17 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.58 0.00 216 D 8.65 4.80 0.00 2.84 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 0.00 217 H 8.53 4.93 0.00 3.22 3.23 0.00 5.54 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 M 8.11 4.59 0.00 1.30 0.82 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.26 0.00 219 V 8.59 4.63 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 0.89 0.00 0.00 0.93 0.00 0.00 220 L 9.05 5.12 0.00 1.78 1.54 0.85 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 221 L 8.69 5.01 0.00 1.74 1.47 0.73 0.56 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 0.00 222 E 8.86 5.15 0.00 1.94 1.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.45 0.00 223 F 9.25 5.32 0.00 3.10 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 0.00 224 V 9.12 4.85 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 1.00 0.00 0.00 0.93 0.00 0.00 225 T 8.80 5.05 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 1.19 0.00 0.00 226 A 8.59 4.34 0.13 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 0.00 227 A 8.51 4.12 0.63 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 0.00 228 G 9.05 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 229 I 7.44 4.51 1.83 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.70 0.92 0.00 0.00 230 T 8.16 4.72 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 1.25 0.00 0.00 *236 L 8.30 4.04 0.00 0.75 0.91 0.77 0.53 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 0.00 237 Y 7.64 4.37 0.00 2.93 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 * Residues marked with a * may have inaccurate shift predictions.