NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 E 4.3471 8.4444 120.2230 55.9993 31.2346 176.8842 6 K 3.5881 8.3050 122.1113 58.2613 32.5601 176.3506 7 F 4.8077 7.8899 118.7987 56.7370 40.6482 176.8206 8 A 4.2031 8.3208 125.9716 54.7367 18.3363 178.7798 9 N 5.0455 8.0181 112.2342 53.0419 39.8737 174.3811 10 H 4.9087 8.3284 119.2995 54.6702 30.8308 173.8918 11 F 4.3070 9.6678 131.9199 61.7169 39.0837 177.3609 12 G 3.5658 8.1184 103.6233 47.7833 0.0000 174.7216 13 Y 4.3172 8.3838 120.5291 60.7993 39.0888 177.5873 14 N 4.7672 8.3871 115.7057 55.7292 38.8061 177.0328 15 R 3.8982 7.4973 117.7672 56.0822 29.7629 175.2090 *17 F 4.9254 7.5595 114.5139 57.1603 40.3037 174.2291 18 A 4.4594 8.2999 125.4381 50.3744 21.8460 175.3841 19 K 3.4725 7.5890 122.3180 57.9315 32.3477 176.9058 20 D 4.6350 8.9150 123.9409 54.7789 39.0288 173.6366 21 Q 4.7035 7.8951 118.6388 54.2302 30.7846 174.0327 22 L 5.4448 8.3966 121.1940 53.6668 45.1334 175.4743 23 T 4.8489 8.8763 115.1588 59.9486 72.5304 172.5197 24 L 5.2117 8.3997 120.9805 53.1668 45.1671 175.8987 25 G 5.1288 9.1756 108.6784 44.8275 0.0000 171.2585 26 V 5.0411 8.8675 117.7541 60.1454 35.0134 173.9440 27 H 5.4849 8.8088 122.6739 54.8652 31.2035 174.3535 28 I 4.5306 8.8935 127.0974 60.2711 38.1229 174.1886 29 P 4.5977 0.0000 0.0000 62.5669 31.8163 177.6074 30 I 4.2464 8.3589 124.6409 59.8673 35.7779 174.0989 31 E 4.7821 8.1708 121.4613 55.4495 32.9008 175.6171 32 N 5.1635 8.3380 124.6862 52.0173 36.6717 175.7527 33 Y 4.2717 7.4568 117.6870 58.5081 40.8181 180.4639 34 Q 3.5823 8.1233 119.3045 57.2473 28.0689 174.7335 35 F 4.5071 9.7213 126.1790 58.6003 40.5767 175.0010 36 H 4.8686 8.0546 119.7465 53.5748 31.6598 174.0145 37 A 4.1452 8.3549 126.0088 50.8638 18.7352 176.0340 38 P 4.5988 0.0000 0.0000 62.3677 33.4406 175.5385 39 T 3.6606 9.1377 112.7987 63.4824 67.6566 175.8208 *41 E 4.0756 8.9357 116.5931 56.8066 31.6128 176.2992 42 K 4.1019 8.8153 118.7975 57.5993 30.2568 177.7106 43 Q 4.0954 7.9181 119.4556 59.0096 28.5480 178.8222 44 V 3.5448 7.8932 118.7628 65.9116 31.5421 177.2831 45 E 3.9237 8.2362 118.4451 59.6309 29.4735 178.8048 46 L 4.0124 8.1945 118.8787 57.6456 41.6086 179.7143 47 V 3.6610 8.0255 118.4694 65.8406 31.3812 178.1537 48 Q 3.9804 8.1917 117.9404 58.8448 28.4695 178.9082 49 K 3.7094 8.3293 119.5049 59.2938 32.1881 179.0833 50 A 4.3083 8.4419 121.5016 55.3039 18.2928 179.3309 51 E 3.9301 8.3770 117.6180 59.5417 29.5473 178.8306 52 Q 3.9927 7.9226 116.8432 59.5102 29.0223 178.7093 53 Y 4.6613 8.3255 117.3061 59.4390 38.1975 177.5786 54 G 4.1873 8.0674 107.8643 44.9160 0.0000 173.3643 55 F 4.4120 7.9697 118.2937 58.0532 39.5710 175.3607 56 T 4.3777 9.0519 114.5443 62.4751 70.3362 174.4164 57 G 4.1443 7.9052 108.2636 44.9392 0.0000 171.9208 58 V 4.7676 7.6610 121.3594 60.3818 34.3959 174.3822 59 W 5.1733 8.9576 126.7352 54.8561 32.4600 174.5206 60 L 5.3893 8.8273 122.3137 53.2188 45.4233 175.6554 61 R 5.0844 8.7457 118.7591 54.8669 33.2127 175.8131 62 D 4.8529 8.7067 120.7434 52.6009 41.9870 174.7991 63 V 4.4285 7.8984 123.4273 61.1137 34.4540 174.7426 64 L 4.1603 9.2987 128.4084 56.9268 42.0155 176.9077 65 L 4.5900 7.6171 117.3285 52.3403 43.5813 176.3769 66 Q 3.8119 8.5366 123.7101 56.2752 29.1888 175.0675 67 D 4.7840 8.4162 125.1410 51.6395 42.3591 173.9867 68 P 4.2223 0.0000 0.0000 65.8159 31.4664 178.3100 69 D 4.2790 8.0784 115.5498 55.7610 41.0050 177.1755 70 F 4.0045 8.3625 121.8577 58.7724 39.6046 175.3904 71 G 3.5876 7.7595 107.5254 46.6106 0.0000 173.3072 72 D 4.7567 7.9185 119.3965 51.1912 41.9976 174.0057 73 P 4.1863 0.0000 0.0000 64.7919 31.8597 178.4879 74 A 3.6087 8.1300 120.3868 52.2744 19.4434 176.7080 75 T 3.6076 8.3899 111.6040 64.3172 67.1975 172.5303 76 G 3.8363 9.7377 112.2383 46.0276 0.0000 173.4814 77 Q 4.2223 8.3008 116.1637 55.0882 29.5861 176.6531 78 I 3.2484 7.7091 124.0245 63.8720 36.2922 174.4670 79 Y 4.4551 6.6188 116.2235 57.4358 40.1771 175.9452 80 D 4.4538 9.0949 120.7744 56.0945 40.6087 178.2037 *83 I 4.1137 9.0565 117.6898 61.5042 39.6624 177.0616 84 Y 4.3179 8.3082 120.7807 60.2801 38.5102 177.1687 85 L 3.7158 8.0539 120.9638 58.5340 42.1036 178.7027 86 T 3.8317 7.9350 114.9189 66.9611 68.1735 175.6156 87 Y 3.9716 7.4986 119.4903 60.7900 39.1821 177.7848 88 L 3.6853 7.8669 120.0548 57.4643 41.7798 179.3668 89 A 3.1581 7.4501 122.6627 53.9110 17.7853 179.6391 90 S 4.3098 7.5297 111.6948 60.3873 63.1000 175.7237 91 K 4.3598 7.1568 120.5704 55.2926 32.6422 175.4688 92 T 4.7392 7.1244 109.2323 59.9494 71.7811 174.1634 93 E 4.6248 9.0238 120.5511 56.8849 31.0438 176.8310 94 K 4.7829 8.2488 113.5214 57.5351 38.4765 176.2824 95 I 3.8097 9.0648 120.5706 61.2461 38.3950 175.9081 96 A 4.5030 8.5332 130.2138 51.9771 19.8152 176.1157 97 F 4.6259 9.4932 119.0473 55.4191 42.2248 175.0258 98 G 3.2850 8.2107 109.8734 44.1031 0.0000 171.3750 99 T 4.9108 8.4612 112.5327 60.0216 70.8246 174.1984 100 S 5.3828 9.6682 120.7082 56.2371 61.3800 172.3469 101 A 5.0429 7.8683 122.0204 50.0469 23.2349 176.6735 102 T 3.9516 8.9645 117.3505 63.8143 69.6926 174.3912 103 V 4.5059 8.8547 128.0560 61.8323 31.0160 176.6005 104 L 4.0800 9.1148 128.8199 56.8305 41.6972 178.6848 105 S 4.5816 8.1787 111.3209 58.8141 63.5670 174.3775 106 L 4.5226 8.0538 119.3745 54.0122 43.7196 176.5574 107 R 4.5651 7.6767 117.0100 53.9235 32.3941 175.7763 108 H 4.0705 8.6141 122.2387 55.4380 31.5657 174.3781 109 P 4.0745 0.0000 0.0000 65.9088 30.7625 178.5507 110 L 3.9390 7.6616 119.6434 57.9639 42.0091 178.9578 111 R 3.8539 7.8291 117.6402 59.0318 30.0053 178.8217 112 V 3.5294 7.8847 117.8729 66.0428 31.4419 177.8154 113 A 3.8753 8.2075 120.6821 55.0642 18.1218 179.5168 114 K 3.8222 8.2333 118.2419 59.6677 32.2472 178.9614 115 E 3.9434 8.3995 119.0458 59.4943 29.3392 179.4141 116 I 3.7151 8.0173 119.8237 64.3648 37.1721 178.4164 117 A 3.9808 8.2541 121.8360 55.3515 18.0856 179.8578 118 T 3.7734 8.2111 114.6100 66.7686 68.5052 176.9142 119 L 4.0305 8.1237 121.0229 57.9070 41.6684 179.1244 120 D 4.5640 8.5156 118.1523 57.0768 40.8838 178.4034 121 Q 3.9351 7.7095 118.2192 58.9644 28.8221 178.2986 122 L 3.8309 7.6846 118.8269 56.1257 43.0055 177.5859 123 F 4.9679 8.0908 116.7491 54.3504 39.2878 172.1154 124 P 4.8743 0.0000 0.0000 63.5539 32.2127 176.4908 125 E 3.8235 9.1982 120.9340 57.7375 27.5327 175.5998 126 R 4.6241 8.0867 114.8791 55.8224 31.2881 175.0154 127 I 5.0908 7.5667 118.0902 58.4037 40.4501 175.1322 *129 L 4.1902 8.0600 121.5572 55.2502 42.5416 175.3275 130 G 5.0445 9.0846 111.3022 45.3760 0.0000 170.3630 131 V 5.4255 9.2308 123.0663 60.2141 35.4071 174.4162 132 S 5.2890 9.8382 117.1386 58.0968 66.9828 174.6705 133 S 4.5918 8.6127 113.0064 58.2412 63.5711 175.3002 134 G 4.5836 9.2675 106.2909 46.5818 0.0000 173.5339 135 D 4.7542 8.3365 114.4868 53.2972 42.3162 176.0022 136 R 4.1842 8.0716 120.4864 55.3866 29.3282 176.8651 137 R 4.0342 8.8226 123.3553 59.3171 30.1390 178.6955 138 A 4.1064 8.0734 119.8235 54.9749 18.3370 179.4207 139 D 4.1849 8.1419 117.6934 57.5416 40.9132 178.4472 140 F 3.9209 8.4031 117.8714 60.7678 38.9900 177.7878 141 K 3.9706 8.2308 117.3205 59.7129 31.7247 179.3888 142 A 4.0972 7.8848 119.2142 54.2782 18.3841 178.6229 143 L 4.4202 7.8389 115.2075 53.6926 42.3038 176.7102 144 G 3.8963 7.7704 106.5047 46.6969 0.0000 173.7200 145 V 4.3759 8.0009 119.0124 60.2967 33.4720 174.9719 146 S 4.3720 8.6854 121.8730 58.1784 63.1331 173.2738 147 H 3.4999 8.9430 128.0368 58.8959 30.0121 176.5457 148 E 3.8183 8.3001 119.1731 59.1571 29.7238 177.2417 149 T 4.5262 7.5552 106.0772 61.4940 69.1538 176.7005 150 R 4.2188 7.9283 122.4579 59.7966 29.2441 178.9390 151 G 3.5487 8.0105 106.2446 47.4243 0.0000 175.2304 152 E 3.9448 8.0987 121.2147 59.1111 29.8599 178.7415 153 K 4.0331 8.0629 119.4264 59.2555 32.1221 178.5322 154 F 4.1002 8.6987 121.5062 61.3947 39.4229 177.3389 155 R 3.9699 7.9366 117.2151 59.1123 29.8621 178.6990 156 E 3.9479 8.2751 118.7958 59.3969 29.6981 178.6491 157 A 3.9494 8.5362 121.1208 55.1253 18.5112 179.3519 158 F 3.8519 8.4328 119.2020 61.1617 39.4591 177.2225 159 A 4.0262 8.1548 120.2348 55.3583 18.1906 178.7715 160 Y 3.9725 8.0515 117.9852 60.8807 38.8298 177.9656 161 L 3.8885 8.2200 121.4608 58.5528 41.8241 178.8958 162 E 4.0027 7.8603 117.3615 58.7126 29.4481 179.1611 163 E 3.9715 7.9775 118.6673 59.2898 29.4977 178.9145 164 I 3.6988 7.8159 117.6245 63.9202 38.0779 177.6314 165 L 3.8946 7.5940 119.3786 56.7216 41.4382 177.2458 166 Y 4.8713 7.1972 112.4143 57.1147 39.7940 175.3211 167 K 4.6017 7.6881 119.5008 54.3684 33.9107 175.8493 168 N 4.5435 8.7743 121.2180 54.5363 39.7190 175.5399 169 F 3.8217 8.9748 120.8016 56.8958 36.7903 173.0137 170 P 4.4372 0.0000 0.0000 62.4978 32.5789 176.4268 171 S 4.8251 8.3883 113.0965 56.7630 64.2041 172.8756 172 I 4.4744 9.0577 128.8087 59.4311 40.1742 174.6626 173 Q 4.9546 8.6505 125.7884 54.1444 30.9323 175.0613 174 S 4.7635 8.5744 117.3316 56.6588 65.7957 174.8184 175 T 4.0480 8.9800 115.3414 64.0301 68.4312 175.1634 176 L 4.2717 9.0480 121.3248 54.9904 42.0757 176.5162 177 G 4.5085 6.4151 105.8663 43.4921 0.0000 171.2443 178 E 4.9156 8.1122 117.3413 54.4421 32.7537 175.1109 179 V 4.2905 8.4779 122.9049 61.5268 34.0017 174.1824 180 H 4.7105 9.0611 128.7393 58.9253 30.5609 171.2680 181 G 3.8656 8.8237 117.3934 45.6068 0.0000 172.3697 182 A 4.6548 7.9071 122.6746 50.7121 20.8594 174.7781 183 N 4.4835 7.7679 115.7513 51.8771 41.7263 173.1630 184 L 4.2821 8.0903 125.6232 54.0770 42.9535 176.2880 185 V 4.3937 7.9918 118.9161 58.7588 34.5535 173.8849 186 P 4.5924 0.0000 0.0000 62.0060 32.9192 175.0405 187 K 4.6147 8.0113 116.9610 53.5790 34.3874 174.7526 188 P 4.4852 0.0000 0.0000 62.7405 31.8256 177.0393 189 S 4.3339 8.3826 114.8057 60.5222 63.3670 174.3022 190 K 4.6934 7.6414 118.1960 53.9305 36.0075 175.4921 191 R 3.7959 8.3975 120.2993 57.0095 30.2976 175.6761 192 V 4.4335 8.7895 124.0318 60.3249 32.6133 173.9926 193 P 4.2165 0.0000 0.0000 63.1052 31.8120 175.6132 194 T 4.7938 8.9557 119.7655 61.6614 71.9382 172.9592 195 F 5.6330 9.3173 124.8225 55.7072 42.6822 174.4374 196 I 4.6326 8.8710 124.7972 61.2829 38.2537 174.8737 197 T 4.2655 8.6867 117.6887 60.8423 70.4720 176.3663 198 G 3.7194 8.0936 113.0748 46.0041 0.0000 173.0776 199 F 4.1228 9.2618 115.6583 57.7741 40.1879 175.9868 200 S 3.8499 8.8425 115.0221 58.4886 60.0930 172.8786 201 Q 3.5862 8.3343 112.8969 56.8776 26.1637 173.6424 202 Q 4.7052 8.0542 117.0363 54.3370 32.5787 177.2875 203 N 5.1041 8.0447 117.4120 53.1101 36.2596 177.1806 *205 E 4.3063 8.9741 116.2068 56.0409 31.6056 177.3415 206 W 3.9197 8.4014 128.6967 60.4400 30.7580 177.2134 207 F 4.9180 7.9843 109.1643 57.2011 37.7072 175.7898 208 A 4.4423 7.6229 124.8694 54.4265 19.1406 178.6824 209 E 4.1864 7.8051 114.5084 57.8435 30.0457 176.4772 210 H 4.5943 8.0907 115.1140 54.7711 30.7918 174.8785 211 G 4.1910 9.0406 108.8643 45.5530 0.0000 172.4688 212 D 4.9931 8.8900 116.5590 53.5989 42.3092 176.6727 213 G 4.4443 7.6053 104.9246 46.5460 0.0000 170.5734 214 W 5.7743 7.5355 128.4176 54.8645 34.5589 172.5801 *216 Y 4.0668 8.1193 119.3689 57.4605 38.8629 173.8730 217 Y 4.2442 5.8383 116.2960 55.9127 39.0861 173.3911 218 P 4.2483 0.0000 0.0000 63.4080 31.2855 176.2255 219 R 4.8378 8.2230 121.5360 53.2271 33.9001 176.4560 220 S 4.5918 8.4230 116.3374 57.4048 64.9102 173.4581 221 P 4.1265 0.0000 0.0000 65.9380 30.8287 178.9365 222 V 3.5620 7.6251 114.9133 66.5121 31.5476 177.2486 223 H 4.5926 7.9566 112.6077 57.4381 28.8174 176.2904 224 Q 4.4615 7.8207 120.7042 57.1037 30.0377 176.8778 225 A 4.0755 8.1993 122.3011 55.0821 18.3080 179.8128 226 G 3.5623 8.1148 103.2442 48.0398 0.0000 175.5204 227 A 4.2047 8.1074 123.4178 54.8463 18.4122 179.6291 228 I 3.9659 7.6482 118.5157 64.5279 37.1690 178.9244 229 G 3.6715 8.0236 106.0439 47.8574 0.0000 175.6837 230 Q 4.0052 8.3314 120.7636 58.4059 28.7485 178.6845 231 W 4.1487 8.4493 129.2089 60.7613 30.6939 178.1028 232 R 3.3922 8.2936 117.8270 59.0247 29.3870 178.8869 233 E 3.8662 8.0759 118.2815 59.4627 29.5720 179.3137 234 L 3.7163 7.6532 118.8692 57.7370 41.6053 179.8403 235 V 3.4111 7.5901 118.4543 65.8845 31.1448 177.7245 236 E 3.8460 8.3724 118.6487 59.0741 29.4541 178.2161 237 D 4.2826 7.5638 118.3753 57.5652 40.9220 178.0149 238 Y 4.6463 7.0203 115.2611 59.4907 38.9817 175.5223 239 H 4.7799 8.2378 117.3960 52.5612 29.8501 170.2583 240 P 4.5843 0.0000 0.0000 63.7777 31.7979 176.9590 241 D 4.5873 9.2198 120.8541 54.4964 39.4939 174.5347 242 V 4.0165 7.3173 119.7027 60.8065 32.4311 175.3630 243 F 4.7837 8.7870 125.4442 57.0275 40.3633 174.6271 244 K 4.5620 7.8125 126.7196 53.6870 34.8055 174.3396 245 P 4.3403 0.0000 0.0000 62.4940 33.1194 174.5797 246 F 5.0066 8.8297 122.8369 56.5870 41.8052 174.2106 247 I 4.8975 6.8555 125.5546 59.4256 40.7332 174.8238 248 Q 4.0535 8.4741 126.0235 54.0492 32.2697 172.8483 249 P 4.0241 0.0000 0.0000 60.9484 34.4682 174.4287 *251 H 4.4713 8.5428 114.6010 56.1219 30.4576 172.3450 252 L 5.0852 8.6615 123.7412 53.5033 45.1094 175.4230 253 D 4.7338 9.1789 127.0323 52.5315 42.1341 173.7626 254 L 4.8532 8.2011 127.4720 53.9621 42.7688 176.0858 255 S 4.3309 8.8846 122.3718 58.0018 62.6810 173.8872 256 E 3.9682 8.9681 125.1706 59.3701 29.7225 177.0856 257 D 4.5589 8.0368 120.0281 52.5794 40.9807 174.9965 258 P 4.4197 0.0000 0.0000 64.8367 31.5743 177.4382 259 N 4.6264 8.4664 115.7274 53.6296 39.5268 174.9977 260 E 4.0066 7.9461 120.1408 56.8886 30.4443 176.7826 261 R 4.5246 8.5174 125.1286 55.0063 31.5238 174.5042 262 P 4.8424 0.0000 0.0000 63.0900 31.9046 175.9763 263 T 4.9389 8.8727 114.1849 58.7968 72.3421 171.5146 264 P 4.7447 0.0000 0.0000 62.8557 32.4722 175.3159 265 I 4.5057 8.0317 115.2589 58.1713 40.6074 174.5200 266 R 3.9521 8.3065 120.8261 57.5220 29.9593 175.8289 267 L 3.6400 8.6623 123.3840 54.6609 40.2158 174.9065 268 G 4.5111 6.6902 106.6723 47.1524 0.0000 172.8468 269 Y 5.2796 7.9401 120.3251 56.1198 42.7806 174.3274 270 R 4.5486 8.9754 124.0907 56.3432 31.6346 175.0502 271 T 4.6404 8.6976 118.7700 61.1819 71.5890 172.7580 272 G 4.2156 8.5724 113.9694 45.3694 0.0000 175.1013 273 R 4.0733 8.6398 117.4390 59.0399 29.2578 179.3020 274 K 3.8997 7.8932 118.6980 59.3730 32.0342 179.2516 275 A 3.9997 7.9037 120.4594 54.6152 18.2879 179.2494 276 L 3.7902 7.7759 119.1491 58.4350 42.1950 179.0681 277 I 3.8746 7.9922 119.9891 64.6020 37.1872 178.0868 278 E 3.9309 7.9414 118.7032 59.3505 29.3562 179.0849 279 L 3.7424 7.9823 120.2921 58.3456 42.0579 179.0873 280 L 4.0822 8.3131 119.0638 57.9049 41.3767 179.3451 281 D 4.6019 8.2672 119.0231 57.2052 40.7043 178.8394 282 I 3.6536 7.6599 120.1387 64.6289 37.1442 177.8313 283 Y 4.2396 7.7878 117.4835 61.1844 37.5721 178.8992 284 K 4.2500 8.6122 120.9670 59.6516 32.1305 179.0224 285 S 4.2678 8.0985 113.7043 60.8760 63.1456 175.6690 286 I 4.1329 7.6271 114.8174 60.9072 37.7115 176.2217 287 G 4.3044 7.4332 110.6110 45.7518 0.0000 173.7691 288 V 4.1981 8.0025 119.8077 62.3852 32.3033 175.4889 289 N 5.5679 9.3962 123.7443 53.5310 41.2568 174.2763 290 H 5.3933 8.1123 118.0712 54.4541 33.8132 171.7298 291 L 5.1730 8.6502 127.1111 53.0297 44.7449 174.7491 292 F 5.3354 8.4199 121.1206 55.0066 40.9541 174.0201 293 L 4.7499 8.9066 122.1189 53.1571 43.7186 175.1112 294 A 4.2450 8.1146 125.6976 50.1908 20.7148 176.8009 295 L 4.6158 7.8926 121.2488 54.6714 42.8007 178.4432 296 F 4.5040 7.3783 120.2001 59.6907 38.8154 176.4266 297 D 4.8763 7.8444 116.3778 53.6836 41.1853 176.7784 298 G 3.7977 7.6477 108.9046 45.4846 0.0000 174.5234 299 Q 4.1014 8.8555 120.9734 58.0334 29.0477 177.3738 300 R 4.4524 7.6039 115.5357 54.2686 31.4870 175.0580 301 P 4.7929 0.0000 0.0000 61.9649 33.4267 177.7810 302 A 4.0618 8.5514 121.9677 55.0678 18.4070 179.7066 303 D 4.4010 8.2392 117.7050 56.9451 39.3025 178.8290 304 E 4.0484 8.1627 118.8474 58.8203 29.7661 179.0298 305 V 3.6187 7.6351 119.2728 65.5355 31.5908 177.8004 306 L 4.0308 8.4558 120.5638 58.2073 41.8962 178.5662 307 D 4.5208 8.2346 120.1484 56.8423 40.9470 178.4145 308 E 3.8807 8.2042 119.5665 59.2582 29.5198 178.8750 309 L 4.0503 8.4092 119.4646 57.7114 41.5171 179.5958 310 G 2.5444 7.8680 104.5421 47.6729 0.0000 175.2020 311 E 4.1453 7.9211 120.0772 57.9196 29.6437 178.1237 312 E 4.5802 7.9776 115.8698 55.9635 31.9885 177.4417 313 V 4.2269 7.9090 117.7507 64.4198 32.6875 177.6451 314 L 3.9228 7.6658 118.1987 57.2838 41.2720 177.4378 315 P 4.1896 0.0000 0.0000 65.2411 31.3119 177.3184 316 H 4.2613 7.8775 113.0311 56.0055 30.2018 175.6350 317 F 4.8142 7.7700 119.4744 55.6261 40.2379 172.0501 318 P 4.6836 0.0000 0.0000 61.9273 32.9498 177.8778 319 A 4.0586 7.6411 121.6198 52.5184 19.0345 177.8021 320 L 4.2197 8.5272 120.5468 54.9728 41.4369 176.9896 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 5 E 8.44 4.35 0.00 1.94 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 2.22 2.31 0.00 6 K 8.31 3.59 0.00 1.51 1.36 0.00 1.46 0.00 0.00 1.42 0.00 0.00 2.47 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.30 0.98 7.81 7 F 7.89 4.81 0.00 2.39 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 8 A 8.32 4.20 1.38 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 9 N 8.02 5.05 0.00 2.71 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 10 H 8.33 4.91 0.00 3.55 3.56 0.00 5.80 0.00 0.00 0.00 0.00 6.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 F 9.67 4.31 0.00 3.24 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 G 8.12 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Y 8.38 4.32 0.00 2.86 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 N 8.39 4.77 0.00 2.86 2.97 0.00 0.00 7.06 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 15 R 7.50 3.90 0.00 1.40 1.51 0.00 2.72 0.00 0.00 2.84 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.49 0.00 *17 F 7.56 4.93 0.00 2.75 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 18 A 8.30 4.46 1.20 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 19 K 7.59 3.47 0.00 0.85 1.43 0.00 1.91 0.00 0.00 1.63 0.00 0.00 2.78 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.46 7.81 20 D 8.91 4.64 0.00 2.88 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 21 Q 7.90 4.70 0.00 2.24 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.94 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 22 L 8.40 5.44 0.00 1.81 1.71 1.01 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 23 T 8.88 4.85 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 24 L 8.40 5.21 0.00 1.37 1.61 0.79 0.51 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 25 G 9.18 5.13 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 26 V 8.87 5.04 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 0.51 0.00 0.00 0.75 0.00 0.00 27 H 8.81 5.48 0.00 3.49 3.27 0.00 5.75 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 I 8.89 4.53 2.14 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 1.51 1.13 1.23 0.00 0.00 29 P 0.00 4.60 0.00 2.23 2.03 0.00 3.50 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 1.69 1.93 0.00 30 I 8.36 4.25 1.96 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.58 0.94 0.00 0.00 31 E 8.17 4.78 0.00 2.09 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 2.53 2.35 0.00 32 N 8.34 5.16 0.00 3.06 2.99 0.00 0.00 5.97 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 33 Y 7.46 4.27 0.00 3.41 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 Q 8.12 3.58 0.00 2.29 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.56 0.00 35 F 9.72 4.51 0.00 2.97 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 36 H 8.05 4.87 0.00 3.17 3.27 0.00 5.96 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.35 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 P 0.00 4.60 0.00 2.05 1.54 0.00 3.33 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.11 0.00 39 T 9.14 3.66 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 1.28 0.00 0.00 *41 E 8.94 4.08 0.00 2.14 2.01 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 2.35 2.39 0.00 42 K 8.82 4.10 0.00 2.02 1.96 0.00 1.98 0.00 0.00 1.87 0.00 0.00 2.98 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.44 7.81 43 Q 7.92 4.10 0.00 2.40 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.80 0.00 0.00 0.00 0.00 0.00 2.58 2.82 0.00 44 V 7.89 3.54 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 0.94 0.00 0.00 0.89 0.00 0.00 45 E 8.24 3.92 0.00 2.10 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 46 L 8.19 4.01 0.00 1.78 1.73 1.05 0.90 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 47 V 8.03 3.66 2.18 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 1.11 0.00 0.00 0.97 0.00 0.00 48 Q 8.19 3.98 0.00 2.37 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.58 0.00 0.00 0.00 0.00 0.00 2.35 2.46 0.00 49 K 8.33 3.71 0.00 1.87 1.77 0.00 1.69 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.23 1.36 7.81 50 A 8.44 4.31 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 51 E 8.38 3.93 0.00 2.15 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.40 0.00 52 Q 7.92 3.99 0.00 1.98 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.77 0.00 0.00 0.00 0.00 0.00 2.33 2.46 0.00 53 Y 8.33 4.66 0.00 3.50 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 54 G 8.07 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 F 7.97 4.41 0.00 3.25 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 56 T 9.05 4.38 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 1.24 0.00 0.00 57 G 7.91 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 0.00 0.00 0.00 58 V 7.66 4.77 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 0.90 0.00 0.00 0.31 0.00 0.00 59 W 8.96 5.17 0.00 2.80 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 L 8.83 5.39 0.00 1.78 1.69 1.10 1.12 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 61 R 8.75 5.08 0.00 1.76 1.92 0.00 3.52 0.00 0.00 3.30 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.92 0.00 62 D 8.71 4.85 0.00 2.77 2.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 V 7.90 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 0.72 0.00 0.00 0.85 0.00 0.00 64 L 9.30 4.16 0.00 1.90 1.65 0.86 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 65 L 7.62 4.59 0.00 1.58 1.52 0.94 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 66 Q 8.54 3.81 0.00 1.93 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.29 0.00 67 D 8.42 4.78 0.00 2.69 2.52 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 68 P 0.00 4.22 0.00 2.21 2.09 0.00 3.65 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 2.11 2.11 0.00 69 D 8.08 4.28 0.00 2.85 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 70 F 8.36 4.00 0.00 2.98 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 71 G 7.76 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 0.00 0.00 0.00 72 D 7.92 4.76 0.00 2.92 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 P 0.00 4.19 0.00 2.26 2.19 0.00 3.72 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 1.92 0.00 74 A 8.13 3.61 0.71 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 75 T 8.39 3.61 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 1.13 0.00 0.00 76 G 9.74 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 77 Q 8.30 4.22 0.00 2.05 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.09 0.00 0.00 0.00 0.00 0.00 2.20 2.56 0.00 78 I 7.71 3.25 0.99 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.23 0.57 0.00 0.00 79 Y 6.62 4.46 0.00 2.49 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 80 D 9.09 4.45 0.00 2.76 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *83 I 9.06 4.11 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 1.31 0.75 0.89 0.00 0.00 84 Y 8.31 4.32 0.00 3.19 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 85 L 8.05 3.72 0.00 1.79 1.63 0.97 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 86 T 7.93 3.83 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 87 Y 7.50 3.97 0.00 2.88 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 88 L 7.87 3.69 0.00 1.21 1.61 0.79 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 89 A 7.45 3.16 -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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 S 7.53 4.31 0.00 4.07 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 91 K 7.16 4.36 0.00 1.53 1.70 0.00 1.46 0.00 0.00 1.52 0.00 0.00 2.42 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.06 1.06 7.81 92 T 7.12 4.74 4.53 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 1.28 0.00 0.00 93 E 9.02 4.62 0.00 1.99 2.02 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 2.25 2.35 0.00 94 K 8.25 4.78 0.00 2.12 1.92 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.48 1.55 7.81 95 I 9.06 3.81 1.92 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.77 0.85 0.00 0.00 96 A 8.53 4.50 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 97 F 9.49 4.63 0.00 2.79 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 98 G 8.21 3.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 T 8.46 4.91 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 1.29 0.00 0.00 100 S 9.67 5.38 0.00 3.98 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 0.00 101 A 7.87 5.04 1.31 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 0.00 0.00 0.00 102 T 8.96 3.95 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 103 V 8.85 4.51 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 1.07 0.00 0.00 1.07 0.00 0.00 104 L 9.11 4.08 0.00 1.83 1.69 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 105 S 8.18 4.58 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 0.00 106 L 8.05 4.52 0.00 1.52 1.53 -0.10 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 107 R 7.68 4.57 0.00 1.75 1.80 0.00 3.23 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 108 H 8.61 4.07 0.00 3.12 3.06 0.00 5.68 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.07 0.00 1.86 2.22 0.00 2.87 0.00 0.00 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 1.44 0.00 110 L 7.66 3.94 0.00 1.75 1.61 0.96 1.02 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 0.00 111 R 7.83 3.85 0.00 1.98 2.09 0.00 3.16 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 112 V 7.88 3.53 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 1.08 0.00 0.00 0.97 0.00 0.00 113 A 8.21 3.88 1.31 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 0.00 0.00 0.00 114 K 8.23 3.82 0.00 1.91 1.91 0.00 1.59 0.00 0.00 1.61 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.49 7.81 115 E 8.40 3.94 0.00 2.10 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 2.32 2.38 0.00 116 I 8.02 3.72 1.92 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.96 0.94 0.00 0.00 117 A 8.25 3.98 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 8.21 3.77 4.36 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 1.16 0.00 0.00 119 L 8.12 4.03 0.00 1.91 1.86 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 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1.91 0.98 0.00 0.00 *129 L 8.06 4.19 0.00 1.89 1.69 0.97 1.06 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 0.00 130 G 9.08 5.04 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 0.00 131 V 9.23 5.43 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 1.36 0.00 0.00 1.19 0.00 0.00 132 S 9.84 5.29 0.00 3.87 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 0.00 133 S 8.61 4.59 0.00 4.05 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 0.00 134 G 9.27 4.58 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 0.00 0.00 0.00 135 D 8.34 4.75 0.00 2.92 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 0.00 136 R 8.07 4.18 0.00 1.81 1.76 0.00 2.57 0.00 0.00 2.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.37 0.00 137 R 8.82 4.03 0.00 1.86 1.98 0.00 2.93 0.00 0.00 3.03 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.62 0.00 138 A 8.07 4.11 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 0.00 139 D 8.14 4.18 0.00 2.90 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 0.00 140 F 8.40 3.92 0.00 3.35 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 0.00 141 K 8.23 3.97 0.00 2.00 1.90 0.00 1.88 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.52 7.81 142 A 7.88 4.10 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 0.00 143 L 7.84 4.42 0.00 1.62 1.66 0.78 0.83 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 0.00 144 G 7.77 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 0.00 145 V 8.00 4.38 2.09 0.00 0.00 0.00 0.00 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0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.47 1.49 7.81 154 F 8.70 4.10 0.00 3.29 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 155 R 7.94 3.97 0.00 2.10 2.10 0.00 3.35 0.00 0.00 2.88 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.50 0.00 156 E 8.28 3.95 0.00 2.17 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 157 A 8.54 3.95 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 0.00 158 F 8.43 3.85 0.00 2.83 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 0.00 159 A 8.15 4.03 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 160 Y 8.05 3.97 0.00 3.16 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 0.00 161 L 8.22 3.89 0.00 1.72 1.65 0.87 0.77 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 0.00 162 E 7.86 4.00 0.00 1.94 2.02 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 2.16 1.77 0.00 163 E 7.98 3.97 0.00 2.04 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 2.32 2.42 0.00 164 I 7.82 3.70 2.01 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.60 1.08 0.00 0.00 165 L 7.59 3.89 0.00 1.16 0.13 0.55 0.60 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 0.00 166 Y 7.20 4.87 0.00 2.80 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 0.00 167 K 7.69 4.60 0.00 1.98 1.72 0.00 1.63 0.00 0.00 1.90 0.00 0.00 3.45 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.40 1.45 7.81 168 N 8.77 4.54 0.00 2.81 2.89 0.00 0.00 7.33 7.45 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 0.00 169 F 8.97 3.82 0.00 3.05 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 0.00 170 P 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 187 K 8.01 4.61 0.00 1.75 1.76 0.00 1.95 0.00 0.00 1.80 0.00 0.00 3.14 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.31 1.32 7.81 188 P 0.00 4.49 0.00 2.60 2.13 0.00 3.87 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.02 0.00 189 S 8.38 4.33 0.00 4.06 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 0.00 190 K 7.64 4.69 0.00 1.79 1.84 0.00 1.72 0.00 0.00 1.82 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.51 7.81 191 R 8.40 3.80 0.00 1.49 1.80 0.00 2.46 0.00 0.00 2.68 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.27 0.00 192 V 8.79 4.43 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 0.97 0.00 0.00 1.08 0.00 0.00 193 P 0.00 4.22 0.00 1.94 1.54 0.00 3.90 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.25 0.00 194 T 8.96 4.79 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 1.50 0.00 0.00 195 F 9.32 5.63 0.00 3.14 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 0.00 196 I 8.87 4.63 1.93 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 1.57 1.38 0.99 0.00 0.00 197 T 8.69 4.27 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 1.40 0.00 0.00 198 G 8.09 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 0.00 0.00 0.00 199 F 9.26 4.12 0.00 3.26 3.40 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 0.00 200 S 8.84 3.85 0.00 3.30 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 0.00 201 Q 8.33 3.59 0.00 2.10 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.34 6.82 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 202 Q 8.05 4.71 0.00 2.25 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.80 0.00 0.00 0.00 0.00 0.00 2.16 1.38 0.00 203 N 8.04 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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 0.00 281 D 8.27 4.60 0.00 2.95 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 0.00 282 I 7.66 3.65 1.77 0.00 0.00 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.67 0.73 0.00 0.00 283 Y 7.79 4.24 0.00 3.18 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 0.00 284 K 8.61 4.25 0.00 2.05 2.20 0.00 1.89 0.00 0.00 1.94 0.00 0.00 3.08 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.55 1.59 7.81 285 S 8.10 4.27 0.00 4.10 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 0.00 286 I 7.63 4.13 1.87 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.72 0.93 0.00 0.00 287 G 7.43 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 0.00 288 V 8.00 4.20 2.31 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 0.81 0.00 0.00 1.10 0.00 0.00 289 N 9.40 5.57 0.00 3.08 3.27 0.00 0.00 6.26 7.84 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 0.00 290 H 8.11 5.39 0.00 3.18 3.20 0.00 5.61 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 0.00 291 L 8.65 5.17 0.00 1.47 1.20 0.26 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 292 F 8.42 5.34 0.00 3.20 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 0.00 293 L 8.91 4.75 0.00 1.65 1.57 1.01 0.52 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 0.00 294 A 8.11 4.25 0.03 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 0.00 295 L 7.89 4.62 0.00 1.61 1.64 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 296 F 7.38 4.50 0.00 2.85 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 0.00 0.00 0.00 297 D 7.84 4.88 0.00 2.66 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 298 G 7.65 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 0.00 299 Q 8.86 4.10 0.00 2.07 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.74 0.00 0.00 0.00 0.00 0.00 2.71 2.47 0.00 300 R 7.60 4.45 0.00 1.81 1.86 0.00 3.22 0.00 0.00 3.46 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 301 P 0.00 4.79 0.00 2.40 2.01 0.00 4.05 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.04 0.00 302 A 8.55 4.06 1.38 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 0.00 303 D 8.24 4.40 0.00 2.98 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 0.00 304 E 8.16 4.05 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.38 0.00 305 V 7.64 3.62 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.95 0.00 0.00 306 L 8.46 4.03 0.00 1.91 1.90 0.69 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 307 D 8.23 4.52 0.00 2.96 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 0.00 308 E 8.20 3.88 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.34 0.00 309 L 8.41 4.05 0.00 1.99 1.80 1.05 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 310 G 7.87 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 0.00 0.00 0.00 311 E 7.92 4.15 0.00 1.98 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 2.39 2.37 0.00 312 E 7.98 4.58 0.00 2.01 1.94 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 2.22 2.31 0.00 313 V 7.91 4.23 2.20 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 1.15 0.00 0.00 0.94 0.00 0.00 314 L 7.67 3.92 0.00 1.67 1.57 0.55 0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 315 P 0.00 4.19 0.00 1.89 2.04 0.00 3.64 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 2.11 2.15 0.00 316 H 7.88 4.26 0.00 3.13 2.60 0.00 5.64 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 317 F 7.77 4.81 0.00 2.95 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 0.00 318 P 0.00 4.68 0.00 2.05 2.00 0.00 3.73 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 1.95 1.90 0.00 319 A 7.64 4.06 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 320 L 8.53 4.22 0.00 1.77 1.58 0.94 1.00 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 * Residues marked with a * may have inaccurate shift predictions.