NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 G 3.8892 8.2085 109.7343 45.1359 0.0000 177.9174 3 A 4.0123 8.8031 128.6187 53.9114 18.2949 176.7092 4 R 4.5310 7.7266 116.0013 55.1257 35.4970 172.6890 5 A 4.6739 8.2569 124.7697 51.0637 21.8522 171.8476 6 S 3.7451 8.4740 123.7159 58.0080 62.5119 170.6786 7 V 3.7345 8.0411 124.8141 62.4299 32.2151 175.5751 8 L 3.5363 6.7226 122.0945 52.8211 40.5129 177.6843 9 S 4.6606 8.4529 120.3159 57.3012 66.4777 174.1736 10 G 3.6993 8.6721 107.1874 48.3054 0.0000 175.5505 11 G 3.9366 8.1157 107.9542 47.4201 0.0000 174.4413 12 E 4.1834 7.7546 120.3162 58.6224 29.7644 178.0648 13 L 4.0190 8.4685 120.8261 58.4721 41.8077 178.2676 14 D 4.5109 7.9660 116.9292 57.5283 41.3438 178.3480 15 K 4.2066 8.4284 119.0933 58.6351 31.9040 179.0746 16 W 4.1259 8.0871 128.7331 60.4101 30.8501 176.9493 17 E 5.0525 8.6392 114.8467 56.5995 29.0726 177.2449 18 K 4.1646 7.5998 119.7775 57.5689 33.0918 176.7556 19 I 3.9659 7.1505 120.6279 60.6995 37.9142 176.1707 20 R 4.6669 8.3397 123.8794 56.2121 31.4609 177.1608 21 L 3.9929 8.5539 117.8097 55.5079 42.4751 177.6835 22 R 4.6974 7.3177 114.8466 53.5034 32.4764 174.9278 23 P 4.8767 0.0000 0.0000 65.4331 31.4095 178.4427 24 G 4.0340 8.0037 106.0051 44.4659 0.0000 173.2675 25 G 4.1560 7.6924 110.4482 43.6456 0.0000 173.9503 26 K 4.5001 8.2392 118.8435 55.4654 33.7875 177.1456 27 K 4.1123 7.7729 117.4955 57.0561 32.6541 175.8539 28 Q 4.9615 8.1249 120.3541 54.4011 32.3396 173.9964 29 Y 4.4136 8.0587 116.3560 57.1392 39.9069 175.5716 30 K 5.1068 8.9323 120.4538 53.9216 36.6606 176.8708 31 L 3.8937 9.1693 123.8036 58.9453 41.7486 179.6137 32 K 4.0440 8.2224 117.5321 60.1005 31.9877 178.4640 33 H 4.4709 8.8639 116.5494 59.1507 28.9019 177.6777 34 I 3.4200 7.9228 121.6312 64.4201 36.7662 178.6540 35 V 3.5800 7.7061 118.2412 65.6971 31.4377 177.6530 36 W 4.2482 8.4351 126.6646 59.9971 30.5745 177.2867 37 A 4.2052 8.2332 120.7812 54.6409 18.8691 179.4002 38 S 4.0420 7.8268 112.5979 61.6665 62.6859 176.3246 39 R 3.9775 8.1256 120.6265 57.7950 30.0604 177.2618 40 E 3.9515 8.0305 119.3496 58.8479 29.8306 177.6251 41 L 3.9244 7.1507 118.1445 57.9995 41.5036 179.2319 42 E 3.9768 8.1489 116.3550 59.4712 29.5067 178.3757 43 R 4.1692 7.8272 116.5680 58.1547 30.4888 176.2221 44 F 4.4402 8.3378 115.6242 57.1925 38.8558 175.4532 45 A 3.7952 8.1976 120.2066 52.8095 16.0441 177.6300 46 V 4.4293 7.9915 117.6363 62.0203 33.6058 175.4123 47 N 4.5261 8.5879 124.7528 52.5838 38.8640 174.1308 48 P 4.4127 0.0000 0.0000 64.3582 31.6877 177.4411 49 G 3.9177 7.8873 107.3688 45.9101 0.0000 174.3630 50 L 4.3109 7.6581 121.6521 56.4247 42.2204 178.6938 51 L 4.2833 7.2810 117.3687 56.2170 41.7199 178.0098 52 E 4.0842 8.1443 116.8500 58.0576 29.7471 177.0713 53 T 4.5703 7.4405 108.6387 59.0802 71.4006 174.8816 54 S 4.2566 8.7145 120.0759 62.0620 62.9852 176.6316 55 E 4.3230 8.2739 120.8811 59.2710 29.0898 179.2275 56 G 4.2630 8.0289 107.1411 47.6097 0.0000 175.4782 57 C 4.2069 7.9414 118.4741 62.4371 27.6304 175.8420 58 R 3.7153 7.8545 120.4890 59.8998 29.1596 178.5273 59 Q 4.0881 8.0258 116.9618 58.6072 28.8176 178.4538 60 I 3.7934 7.4394 120.9807 64.5330 37.1965 178.2811 61 L 4.3455 8.4230 120.3129 58.0145 41.1757 180.0178 62 G 3.6353 7.6462 104.1267 47.8646 0.0000 175.5790 63 Q 4.1894 7.5772 119.1114 58.7786 29.1637 178.4543 64 L 4.2565 8.2084 119.4223 57.1417 41.6527 178.9147 65 Q 3.6353 8.2422 119.1685 58.5152 28.5512 176.8443 66 P 4.4572 0.0000 0.0000 64.1901 31.8423 176.7386 67 S 5.0701 7.7331 114.4721 58.0240 63.9539 175.8822 68 L 4.0766 7.4187 120.2850 57.2438 41.6204 178.0468 69 Q 4.2714 7.9340 118.1651 58.0622 30.1382 176.7997 70 T 3.9555 7.8474 107.8542 64.5261 69.2129 174.9466 71 G 4.0796 8.1498 111.6427 44.9412 0.0000 174.3048 72 S 4.5776 8.2125 114.5721 57.5595 66.8344 173.9486 73 E 4.0334 8.8524 119.9712 59.8681 28.8204 179.2531 74 E 4.3031 8.2127 120.5565 58.6264 29.2785 178.4500 75 L 4.3372 8.1585 120.3085 57.7448 42.1081 179.1204 76 R 4.1196 7.9745 118.3041 59.0915 29.9269 178.7289 77 S 4.2721 8.2762 113.8534 61.2346 62.9134 176.7124 78 L 4.3062 7.9553 121.5269 58.0647 41.5012 178.3931 79 Y 4.1991 7.8766 118.8791 61.2750 38.4119 178.2832 80 N 4.4735 8.1014 115.5866 56.3617 38.7882 177.2083 81 T 4.2285 7.7291 117.4248 66.4002 68.9132 176.8520 82 I 3.6936 8.5326 121.6720 64.7334 36.7875 178.2917 83 A 3.8846 7.8768 121.3736 55.1713 17.9397 179.9001 84 V 3.4625 7.6743 115.9587 65.6622 31.6821 177.9086 85 L 4.2207 7.8908 119.8742 58.3827 42.1629 177.7400 86 Y 4.1442 8.0924 119.4160 61.3988 38.5078 178.3381 87 C 4.0600 7.9535 116.8105 62.7368 28.2417 176.2627 88 V 3.5566 7.8973 120.0128 66.2242 30.8703 177.7498 89 H 4.5496 7.8814 114.5918 58.0438 28.7321 176.4068 90 Q 4.2188 7.3485 118.1838 55.0155 28.5871 175.9573 91 R 3.8174 7.1474 116.5727 56.9566 29.2775 175.5171 92 I 4.0968 7.7653 117.2776 59.9821 37.9852 174.6873 93 D 4.6548 8.5141 124.8617 52.6509 41.6844 176.3556 94 V 4.1381 8.0757 120.2080 60.5669 33.0872 175.9037 95 K 4.2841 8.0937 118.8621 57.0394 33.1275 176.0687 96 D 4.5828 7.1696 115.8900 52.2366 41.2920 176.8292 97 T 4.0815 7.4901 114.3974 65.4501 68.0701 176.2909 98 K 4.1151 7.8977 121.9995 58.9896 32.7507 177.9246 99 E 3.9846 8.7402 119.2771 58.7689 29.3293 178.8809 100 A 3.9091 8.0053 121.1896 55.0325 18.5218 179.1694 101 L 3.8577 7.4278 117.8497 58.4621 42.1969 178.7598 102 D 4.3312 8.2454 117.8553 57.3085 40.2997 178.2251 103 K 4.1789 8.1708 118.9868 59.2075 31.7627 178.9356 104 I 4.2243 7.3976 119.7915 63.4698 37.5290 177.7650 105 E 4.0117 8.3982 120.4599 59.1037 28.9244 178.3895 106 E 4.0145 8.8175 119.8309 58.7729 29.5569 178.2604 107 E 4.0288 7.6399 120.1507 59.0407 29.5903 178.4319 108 Q 4.0081 7.9171 119.6578 58.8664 28.5970 177.7488 109 N 4.4310 7.8083 117.3089 56.0314 38.1493 177.5054 110 K 3.8208 7.8280 119.1078 59.2460 32.1599 179.3055 111 S 4.1746 7.9627 113.6205 60.6269 62.0268 176.0604 112 K 3.9219 7.6213 121.7832 59.4182 32.2621 178.6284 113 K 4.1232 7.5821 118.3831 59.4285 31.8090 179.4001 114 K 3.9979 7.6178 117.7962 59.2024 32.1104 178.3042 115 A 4.2377 7.9820 120.5016 53.5768 18.4446 177.5832 116 Q 4.5869 7.6195 117.2955 56.1316 29.8638 176.3778 117 Q 4.4664 7.9728 118.0969 56.5428 30.6592 176.2781 118 A 4.0434 7.9903 121.0509 54.7111 18.4153 178.9857 119 A 3.9782 8.1737 118.9049 55.1963 17.7555 179.5907 120 A 3.9147 7.9111 119.1129 55.6132 18.3096 179.5768 121 D 4.5489 7.6982 115.5221 57.7227 40.8493 179.0299 122 T 4.2095 7.2202 116.2845 65.3757 68.7927 175.5854 123 G 3.7900 7.3214 108.1795 45.0297 0.0000 172.3006 124 N 4.4477 8.5196 118.5926 53.3458 39.2775 174.9401 125 N 4.7331 8.5911 124.1919 51.0737 38.1257 172.4813 126 S 4.5071 8.0934 114.5532 56.2825 63.9720 174.8139 127 Q 4.4184 8.2616 125.0541 54.9246 30.0611 175.7807 128 V 4.2758 7.6888 113.9837 61.5158 33.3636 172.3767 129 S 4.5604 8.5333 118.5786 57.1852 66.7397 173.8321 130 Q 4.4389 8.2879 122.5522 55.2607 30.4886 173.2497 131 N 4.7285 8.0033 114.9462 52.5787 41.7673 173.5133 132 Y 4.1575 8.6491 117.3104 58.4880 37.9112 176.7717 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 2 G 8.21 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 3 A 8.80 4.01 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 4 R 7.73 4.53 0.00 1.95 1.78 0.00 3.27 0.00 0.00 3.21 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 5 A 8.26 4.67 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.47 3.75 0.00 4.00 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 7 V 8.04 3.73 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 0.77 0.00 0.00 0.89 0.00 0.00 8 L 6.72 3.54 0.00 1.54 1.55 0.66 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.45 4.66 0.00 4.04 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 G 8.67 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 G 8.12 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 12 E 7.75 4.18 0.00 2.17 1.96 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 2.33 2.39 0.00 13 L 8.47 4.02 0.00 2.01 1.74 1.14 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 14 D 7.97 4.51 0.00 2.86 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 15 K 8.43 4.21 0.00 2.08 1.89 0.00 1.63 0.00 0.00 1.58 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.49 7.81 16 W 8.09 4.13 0.00 3.36 3.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 E 8.64 5.05 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.45 0.00 18 K 7.60 4.16 0.00 1.98 1.92 0.00 1.90 0.00 0.00 1.68 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.54 7.81 19 I 7.15 3.97 1.57 0.00 0.00 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 1.14 0.74 0.89 0.00 0.00 20 R 8.34 4.67 0.00 2.03 1.78 0.00 3.14 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.59 0.00 21 L 8.55 3.99 0.00 1.42 1.33 0.67 -0.61 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 22 R 7.32 4.70 0.00 1.70 1.79 0.00 3.12 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.52 0.00 23 P 0.00 4.88 0.00 2.16 2.16 0.00 3.30 0.00 0.00 3.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.90 0.00 24 G 8.00 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 25 G 7.69 4.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.24 4.50 0.00 1.61 1.70 0.00 1.65 0.00 0.00 1.68 0.00 0.00 3.09 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.28 1.45 7.81 27 K 7.77 4.11 0.00 1.68 1.57 0.00 1.59 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.32 7.81 28 Q 8.12 4.96 0.00 1.83 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.78 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 29 Y 8.06 4.41 0.00 2.39 1.73 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 30 K 8.93 5.11 0.00 1.79 1.74 0.00 1.63 0.00 0.00 1.77 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.56 7.81 31 L 9.17 3.89 0.00 1.74 1.75 0.88 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 32 K 8.22 4.04 0.00 1.80 1.82 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.58 1.59 7.81 33 H 8.86 4.47 0.00 4.03 3.84 0.00 5.83 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 I 7.92 3.42 1.72 0.00 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.02 0.59 0.00 0.00 35 V 7.71 3.58 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 1.18 0.00 0.00 0.93 0.00 0.00 36 W 8.44 4.25 0.00 3.44 3.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 A 8.23 4.21 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.83 4.04 0.00 4.04 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 39 R 8.13 3.98 0.00 1.80 1.81 0.00 3.10 0.00 0.00 3.09 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.57 0.00 40 E 8.03 3.95 0.00 1.39 1.55 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 1.47 1.47 0.00 41 L 7.15 3.92 0.00 1.93 1.92 0.94 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 42 E 8.15 3.98 0.00 1.92 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 2.32 2.30 0.00 43 R 7.83 4.17 0.00 1.80 2.14 0.00 3.28 0.00 0.00 3.23 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 44 F 8.34 4.44 0.00 3.13 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 45 A 8.20 3.80 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 46 V 7.99 4.43 2.24 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 0.85 0.00 0.00 1.09 0.00 0.00 47 N 8.59 4.53 0.00 2.88 2.73 0.00 0.00 6.90 8.03 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 48 P 0.00 4.41 0.00 2.18 2.26 0.00 3.67 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 49 G 7.89 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 50 L 7.66 4.31 0.00 1.67 1.87 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.28 4.28 0.00 1.64 1.69 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 52 E 8.14 4.08 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.25 0.00 53 T 7.44 4.57 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 1.18 0.00 0.00 54 S 8.71 4.26 0.00 3.86 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 55 E 8.27 4.32 0.00 2.04 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.44 0.00 56 G 8.03 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 0.00 0.00 0.00 0.00 57 C 7.94 4.21 0.00 3.30 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 58 R 7.85 3.72 0.00 1.89 2.10 0.00 3.14 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 59 Q 8.03 4.09 0.00 2.27 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.71 0.00 0.00 0.00 0.00 0.00 2.46 2.46 0.00 60 I 7.44 3.79 2.03 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.03 0.96 0.00 0.00 61 L 8.42 4.35 0.00 1.61 1.81 0.63 0.19 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 62 G 7.65 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 7.58 4.19 0.00 2.23 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.98 0.00 0.00 0.00 0.00 0.00 2.43 2.47 0.00 64 L 8.21 4.26 0.00 1.93 1.86 1.06 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 65 Q 8.24 3.64 0.00 2.30 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.93 0.00 0.00 0.00 0.00 0.00 2.34 2.73 0.00 66 P 0.00 4.46 0.00 2.16 2.15 0.00 3.72 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 2.13 1.98 0.00 67 S 7.73 5.07 0.00 4.07 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 68 L 7.42 4.08 0.00 1.61 1.62 0.06 0.65 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 69 Q 7.93 4.27 0.00 1.97 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.06 0.00 0.00 0.00 0.00 0.00 2.27 2.31 0.00 70 T 7.85 3.96 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 1.19 0.00 0.00 71 G 8.15 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 72 S 8.21 4.58 0.00 4.11 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 73 E 8.85 4.03 0.00 2.11 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 0.00 2.43 2.42 0.00 74 E 8.21 4.30 0.00 2.30 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 75 L 8.16 4.34 0.00 1.95 1.85 1.07 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 76 R 7.97 4.12 0.00 2.13 2.03 0.00 3.22 0.00 0.00 3.43 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.72 0.00 77 S 8.28 4.27 0.00 4.06 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 78 L 7.96 4.31 0.00 1.97 1.83 0.88 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 79 Y 7.88 4.20 0.00 3.10 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 80 N 8.10 4.47 0.00 3.04 2.95 0.00 0.00 7.13 8.52 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 81 T 7.73 4.23 4.59 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 1.59 0.00 0.00 82 I 8.53 3.69 1.83 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 1.48 1.05 0.91 0.00 0.00 83 A 7.88 3.88 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 84 V 7.67 3.46 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 0.77 0.00 0.00 85 L 7.89 4.22 0.00 1.91 1.90 0.65 0.90 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 86 Y 8.09 4.14 0.00 3.11 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 87 C 7.95 4.06 0.00 3.19 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 88 V 7.90 3.56 2.19 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 1.08 0.00 0.00 1.07 0.00 0.00 89 H 7.88 4.55 0.00 3.17 3.23 0.00 5.74 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 7.35 4.22 0.00 1.67 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.97 6.42 0.00 0.00 0.00 0.00 0.00 2.13 2.24 0.00 91 R 7.15 3.82 0.00 1.93 1.96 0.00 3.28 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 92 I 7.77 4.10 1.94 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 1.16 0.75 0.91 0.00 0.00 93 D 8.51 4.65 0.00 2.60 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 94 V 8.08 4.14 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 0.75 0.00 0.00 0.88 0.00 0.00 95 K 8.09 4.28 0.00 1.72 1.83 0.00 1.81 0.00 0.00 1.91 0.00 0.00 3.05 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.35 1.39 7.81 96 D 7.17 4.58 0.00 2.85 2.81 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 97 T 7.49 4.08 4.34 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 1.36 0.00 0.00 98 K 7.90 4.12 0.00 1.85 2.00 0.00 1.63 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.46 1.55 7.81 99 E 8.74 3.98 0.00 2.20 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 2.31 2.38 0.00 100 A 8.01 3.91 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 0.00 101 L 7.43 3.86 0.00 2.05 1.74 1.20 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 102 D 8.25 4.33 0.00 2.99 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 0.00 103 K 8.17 4.18 0.00 2.13 1.89 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.46 1.71 7.81 104 I 7.40 4.22 1.90 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 1.38 0.92 0.74 0.00 0.00 105 E 8.40 4.01 0.00 2.29 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 2.35 2.40 0.00 106 E 8.82 4.01 0.00 2.21 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 2.32 2.47 0.00 107 E 7.64 4.03 0.00 2.47 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 2.32 2.34 0.00 108 Q 7.92 4.01 0.00 2.12 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.60 0.00 0.00 0.00 0.00 0.00 2.36 2.56 0.00 109 N 7.81 4.43 0.00 3.31 2.86 0.00 0.00 6.91 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 0.00 110 K 7.83 3.82 0.00 1.85 1.86 0.00 1.67 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.47 1.45 7.81 111 S 7.96 4.17 0.00 3.85 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 0.00 112 K 7.62 3.92 0.00 1.88 2.03 0.00 1.86 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.49 7.81 113 K 7.58 4.12 0.00 1.74 1.84 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.63 7.81 114 K 7.62 4.00 0.00 1.90 1.85 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.46 1.46 7.81 115 A 7.98 4.24 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 Q 7.62 4.59 0.00 2.15 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.72 0.00 0.00 0.00 0.00 0.00 2.27 2.25 0.00 117 Q 7.97 4.47 0.00 2.30 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.68 0.00 0.00 0.00 0.00 0.00 2.32 2.38 0.00 118 A 7.99 4.04 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 0.00 119 A 8.17 3.98 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 0.00 120 A 7.91 3.91 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 D 7.70 4.55 0.00 2.82 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 T 7.22 4.21 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 1.21 0.00 0.00 123 G 7.32 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 N 8.52 4.45 0.00 2.68 2.74 0.00 0.00 6.85 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 N 8.59 4.73 0.00 2.70 2.74 0.00 0.00 6.91 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 0.00 126 S 8.09 4.51 0.00 3.93 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 0.00 127 Q 8.26 4.42 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 128 V 7.69 4.28 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 0.59 0.00 0.00 0.93 0.00 0.00 129 S 8.53 4.56 0.00 3.82 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 0.00 130 Q 8.29 4.44 0.00 2.12 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.68 0.00 0.00 0.00 0.00 0.00 2.23 2.28 0.00 131 N 8.00 4.73 0.00 2.68 2.74 0.00 0.00 6.94 7.58 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 0.00 132 Y 8.65 4.16 0.00 3.05 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