NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.3990 8.3193 115.4013 58.2590 64.2913 171.9459 3 Q 4.4924 8.1770 117.8302 52.6330 31.4544 172.8625 4 T 4.6614 8.6575 108.5036 59.3564 73.0292 174.7901 5 I 3.8340 7.9438 122.7096 62.0267 38.0953 175.1387 6 T 5.0411 8.5382 123.6458 61.8397 70.7612 173.9411 7 V 4.1652 8.9541 119.8852 60.6532 35.4154 177.1257 8 G 2.6418 8.0686 109.5199 43.3836 0.0000 171.2692 9 P 4.2326 0.0000 0.0000 62.1739 32.3950 175.4408 10 W 4.2876 9.4168 120.8194 54.6186 30.7862 175.7676 11 G 3.9322 8.1864 109.5379 44.2709 0.0000 172.3732 12 G 4.1123 8.0217 110.0093 42.6465 0.0000 171.8364 13 P 4.4618 0.0000 0.0000 62.7188 31.5946 176.3163 14 G 3.7467 7.8047 108.6883 45.7671 0.0000 173.9345 15 G 3.9642 8.3632 107.4441 44.9672 0.0000 171.8411 16 N 5.0578 8.5323 116.0489 51.1821 41.1695 175.0910 17 G 4.1578 8.7447 110.9142 46.0706 0.0000 172.6908 18 W 5.5626 8.7887 119.8272 54.8621 32.3699 173.7139 19 D 5.0338 8.8652 120.3833 53.2959 42.6624 174.9253 20 D 4.7468 9.7020 126.9612 55.6451 41.8402 177.5220 21 G 3.6818 9.0847 106.9570 44.2197 0.0000 172.1465 22 S 4.9879 7.6026 113.4788 56.9426 65.8748 173.6655 23 Y 4.4058 8.3174 121.0242 57.5103 40.3901 174.9810 24 T 4.3022 8.4197 110.0286 63.0160 70.0980 174.5857 25 G 4.1449 6.9763 108.1584 45.9099 0.0000 170.7561 26 I 4.7283 8.5612 119.3039 59.7024 40.0921 175.1309 27 R 4.4518 8.7032 123.5970 57.4938 32.3307 176.1554 28 Q 4.8099 7.4951 118.1460 54.4893 33.1105 173.1542 29 I 4.3586 8.4522 125.8982 59.2500 40.7252 174.1475 30 E 5.0468 8.6618 126.6399 54.3097 32.3233 175.1392 31 L 5.9225 8.6421 123.8412 53.2008 44.7816 175.2117 32 S 5.5619 8.6666 113.6984 57.1413 66.4781 172.2331 33 Y 5.0948 8.6823 118.7684 58.4451 41.9284 174.8010 34 K 4.1313 8.8312 126.0309 56.6429 39.1541 176.3002 35 E 4.4637 9.0113 121.9312 56.2243 31.2906 175.1510 36 A 4.9780 6.9407 119.7375 50.6080 22.6608 174.0091 37 I 4.4593 8.5719 120.0297 62.0241 38.3232 175.3785 38 G 3.9194 9.9699 115.5010 47.7052 0.0000 174.7804 39 S 4.8895 7.5570 115.4678 58.2698 65.5551 174.3233 40 F 5.0214 8.9685 124.4220 57.5014 42.8179 173.0947 41 S 4.5276 8.2180 119.8724 57.3260 66.6758 173.5771 42 V 4.4504 7.8622 112.8536 59.6954 36.4582 174.4046 43 I 4.4766 8.2964 124.3644 60.0718 38.7604 175.3395 44 Y 4.7706 8.7153 125.8822 57.0757 40.3240 173.8711 45 D 4.9502 8.7309 120.4691 52.7273 43.7243 174.9559 46 L 4.8945 8.8165 127.6622 53.0701 44.0464 175.8116 47 N 4.5501 10.9700 128.2294 54.1294 36.7096 175.8385 48 G 4.1672 9.0413 106.9214 45.0508 0.0000 173.8783 49 D 5.0425 7.6966 118.8852 51.5470 43.1778 174.0204 50 P 4.8288 0.0000 0.0000 62.8882 32.4559 175.8290 51 F 4.6453 9.0840 125.0202 56.7850 42.8929 173.5150 52 S 4.4269 8.2844 123.2039 58.2462 63.0772 174.6384 53 G 4.2553 8.7149 112.9987 44.6300 0.0000 171.5234 54 P 4.4045 0.0000 0.0000 62.4135 31.8869 176.6140 55 K 4.0298 8.1683 121.0947 56.3294 33.4603 177.4117 56 H 4.6967 7.8746 120.0164 54.4109 28.5229 173.3154 57 T 4.3736 7.4553 116.7977 63.1232 69.6692 174.4823 58 S 4.7553 8.9591 120.7480 56.5178 64.0481 174.4521 59 K 4.1437 8.4089 125.3031 58.0026 32.4318 177.6915 60 L 3.9533 7.0392 119.2896 54.3790 42.0435 176.3688 61 P 4.5654 0.0000 0.0000 62.0941 29.7476 174.7315 62 Y 4.8754 7.5242 122.4282 56.9842 41.0409 175.4633 63 K 4.1694 8.1894 120.6952 56.3820 33.1712 176.4084 64 N 5.2574 8.6533 122.0457 52.5204 40.1330 174.8957 65 V 4.5856 8.6126 114.2354 59.4959 36.5749 174.2777 66 K 4.5436 8.6008 123.8592 54.7276 34.6793 175.2158 67 I 4.0733 8.7116 129.2289 59.7968 38.7085 174.5004 68 E 4.6305 8.5196 127.5269 54.7387 30.4253 176.1429 69 L 4.5405 8.4669 125.2753 53.3404 43.4064 178.0803 70 K 4.3622 8.9196 123.2732 54.8222 30.6460 176.3599 71 F 4.4948 8.0662 122.0482 57.9746 40.3138 172.6988 72 P 4.0754 0.0000 0.0000 62.2243 31.3593 175.6732 73 D 4.4319 7.9920 119.9440 56.2921 41.4711 175.6880 74 E 4.5418 8.1219 119.5422 53.9960 31.9019 174.6163 75 F 5.0880 7.3991 118.6797 54.9996 40.9666 173.1775 76 L 4.6662 8.8051 121.8336 55.5131 41.1462 176.7426 77 E 4.8460 9.5969 124.0866 56.6312 32.1033 175.2735 78 S 5.4586 7.9413 111.0507 58.4534 66.1519 174.7168 79 V 4.9985 8.1052 120.9372 60.1081 34.4384 174.4277 80 S 3.8703 8.1103 117.6054 56.8960 67.1636 173.7313 81 G 3.3417 5.5318 106.4209 45.7015 0.0000 171.3316 82 Y 5.3498 7.9822 115.9386 56.3011 42.1793 174.9987 83 T 5.2130 8.8438 113.2663 59.9413 71.9806 173.2155 84 G 4.3485 8.4603 110.4565 45.2014 0.0000 170.8415 85 P 4.9933 0.0000 0.0000 62.3412 32.6975 176.5352 86 F 5.0569 8.5642 122.0430 56.9394 41.0021 175.3524 87 S 3.9712 9.0553 124.5710 61.7486 62.6514 176.6005 88 A 3.7947 6.9406 120.3989 54.2294 17.9637 177.7846 89 L 4.2126 7.6728 114.1659 55.7256 41.9721 178.0159 90 A 3.7859 7.5998 121.0169 53.8635 16.2066 177.0024 91 T 3.8250 8.5940 117.8167 65.0340 70.8147 173.2326 92 P 3.2475 0.0000 0.0000 59.3821 34.3307 177.1826 93 T 3.9135 9.1805 101.2124 61.4324 69.3507 173.9569 94 P 4.6286 0.0000 0.0000 63.0616 32.8811 175.5659 95 V 4.6947 8.6176 114.6700 59.5042 37.0724 174.9605 96 V 4.0562 8.6784 122.6987 63.1979 31.6949 176.7427 97 R 4.1970 9.4771 129.1333 58.4576 31.5299 176.6630 98 S 5.7075 7.9350 111.2009 56.6408 66.5111 172.5836 99 L 5.0468 8.3667 124.7213 53.8573 45.6738 174.8811 100 T 4.9366 8.6604 121.2851 61.8802 73.1450 172.6953 101 F 5.2987 8.8238 123.1675 55.6559 42.4240 174.3815 102 K 5.2241 9.1093 122.3355 55.0675 35.3941 175.5615 103 T 5.1377 8.7394 120.5150 61.7330 70.8923 175.7162 104 N 4.5420 8.1696 120.1912 54.7487 37.3942 176.1549 105 K 4.1236 7.8573 116.7730 56.3766 32.2967 177.4758 106 G 3.9306 8.0260 107.9143 45.0421 0.0000 174.0064 107 R 4.2393 7.5778 118.8998 55.8315 31.7541 175.3914 108 T 4.9273 8.0912 118.6573 61.8004 71.1839 173.5251 109 F 4.2908 9.5990 125.9516 56.3365 40.2325 175.9648 110 G 3.1349 7.4688 116.3010 46.9315 0.0000 171.1072 111 P 3.8841 0.0000 0.0000 64.3495 30.7598 174.5298 112 Y 4.0574 8.6291 121.8506 56.9981 39.4458 176.6142 113 G 4.2876 8.8461 110.9354 44.0225 0.0000 171.5137 114 D 4.4666 8.0049 118.2764 53.6219 41.6482 177.3003 115 E 3.9368 8.2620 128.3283 54.6675 28.1551 175.1213 116 E 4.4661 7.5069 119.7025 54.9770 33.8719 173.9152 117 G 4.1274 8.8093 109.5723 44.6730 0.0000 172.6803 118 T 4.6044 9.1216 119.1177 62.4459 70.1786 174.2281 119 Y 4.2059 8.5899 128.0082 57.2172 39.9212 174.4363 120 F 4.6137 7.4310 119.4418 54.9873 41.7374 173.2559 121 N 4.5305 8.0153 118.9171 52.2006 41.9911 173.5164 122 L 4.5745 8.9790 129.2602 52.6813 43.4343 172.1036 123 P 4.9026 0.0000 0.0000 61.4728 32.6026 175.2484 124 I 4.3528 8.6603 126.2484 59.8472 38.0098 175.3684 125 E 4.2289 9.0290 128.5242 58.0675 30.1720 176.2106 126 N 4.8032 8.1359 115.7893 52.0740 41.8552 172.5573 127 G 4.1530 8.1157 110.3883 43.4382 0.0000 172.4140 128 L 4.8642 8.7305 118.9342 52.6550 45.9695 176.4314 129 I 4.5406 8.5542 123.8309 61.1622 37.7857 176.0426 130 V 4.5136 9.3154 125.0081 60.4615 33.0430 175.1818 131 G 4.9221 7.0516 108.6764 46.5786 0.0000 172.1186 132 F 5.6559 9.0143 118.9315 55.5583 43.0077 174.4380 133 K 4.5638 9.0340 121.1943 54.8054 36.3029 176.2758 134 G 3.1274 6.1230 110.4386 45.4394 0.0000 171.5615 135 R 5.0443 7.6286 116.9644 54.7383 34.4548 174.9960 136 T 5.0397 9.4017 119.1343 63.3526 72.7122 171.8213 137 G 3.9850 9.6024 110.8699 46.9125 0.0000 173.9895 138 D 4.7151 9.7066 124.0949 55.2331 42.4583 175.4139 139 L 4.7559 7.4114 117.4852 53.6779 43.7085 174.3841 140 L 4.6947 8.5129 121.3335 55.0333 41.9693 177.5076 141 D 4.5811 9.3783 128.2552 57.0264 42.0704 176.5553 142 A 5.0874 7.6951 117.5122 50.6562 23.1542 174.8684 143 I 4.7817 8.6527 118.7217 59.4294 42.0375 174.3263 144 G 4.5747 9.6481 115.2895 44.8286 0.0000 170.9998 145 I 5.1611 8.5658 119.4201 59.6680 41.5818 174.4568 146 H 5.3787 8.9118 122.5717 54.5976 30.8524 173.8478 147 M 5.3861 9.2140 121.2397 54.1503 36.6164 174.4071 148 S 4.5549 8.7705 116.0604 57.5386 68.6768 174.6459 149 L 4.1957 8.2885 119.5888 55.1635 41.6158 177.0184 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 S 8.32 4.40 0.00 3.94 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 3 Q 8.18 4.49 0.00 2.16 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.79 0.00 0.00 0.00 0.00 0.00 2.17 2.37 0.00 4 T 8.66 4.66 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 1.12 0.00 0.00 5 I 7.94 3.83 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.53 0.91 0.00 0.00 6 T 8.54 5.04 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 7 V 8.95 4.17 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 0.78 0.00 0.00 1.05 0.00 0.00 8 G 8.07 2.64 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 9 P 0.00 4.23 0.00 1.95 1.79 0.00 3.46 0.00 0.00 3.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.76 0.00 10 W 9.42 4.29 0.00 2.56 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 0.00 0.00 0.00 0.00 11 G 8.19 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 0.00 0.00 0.00 12 G 8.02 4.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 P 0.00 4.46 0.00 2.17 2.14 0.00 3.78 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 14 G 7.80 3.75 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 0.00 0.00 0.00 15 G 8.36 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 0.00 0.00 0.00 16 N 8.53 5.06 0.00 2.80 2.80 0.00 0.00 7.35 7.12 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 17 G 8.74 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 18 W 8.79 5.56 0.00 3.44 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19 D 8.87 5.03 0.00 2.70 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 20 D 9.70 4.75 0.00 3.35 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 G 9.08 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 0.00 0.00 0.00 0.00 22 S 7.60 4.99 0.00 3.55 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Y 8.32 4.41 0.00 2.72 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 24 T 8.42 4.30 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 1.24 0.00 0.00 25 G 6.98 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 26 I 8.56 4.73 2.01 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 1.65 0.96 0.88 0.00 0.00 27 R 8.70 4.45 0.00 1.75 1.82 0.00 3.08 0.00 0.00 2.96 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.91 0.00 28 Q 7.50 4.81 0.00 1.94 1.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.86 0.00 0.00 0.00 0.00 0.00 2.11 2.36 0.00 29 I 8.45 4.36 1.30 0.00 0.00 0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.14 0.21 0.00 0.00 30 E 8.66 5.05 0.00 1.70 1.62 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 2.05 2.02 0.00 31 L 8.64 5.92 0.00 1.95 1.73 0.80 1.12 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 32 S 8.67 5.56 0.00 3.99 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 33 Y 8.68 5.09 0.00 3.16 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 34 K 8.83 4.13 0.00 0.79 0.74 0.00 1.52 0.00 0.00 1.55 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.11 1.10 7.81 35 E 9.01 4.46 0.00 1.91 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 0.00 2.48 2.31 0.00 36 A 6.94 4.98 0.96 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 0.00 0.00 37 I 8.57 4.46 2.04 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.33 1.16 0.00 0.00 38 G 9.97 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 39 S 7.56 4.89 0.00 3.77 3.77 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 40 F 8.97 5.02 0.00 3.17 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 S 8.22 4.53 0.00 3.66 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 42 V 7.86 4.45 1.62 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 0.45 0.00 0.00 -0.47 0.00 0.00 43 I 8.30 4.48 1.67 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.47 0.80 0.00 0.00 44 Y 8.72 4.77 0.00 2.45 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 45 D 8.73 4.95 0.00 1.71 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 46 L 8.82 4.89 0.00 1.70 1.58 0.85 0.33 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 47 N 10.97 4.55 0.00 2.77 2.90 0.00 0.00 7.25 7.53 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 48 G 9.04 4.17 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 0.00 49 D 7.70 5.04 0.00 2.87 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 50 P 0.00 4.83 0.00 1.91 1.93 0.00 3.66 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.06 0.00 51 F 9.08 4.65 0.00 3.06 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 52 S 8.28 4.43 0.00 3.51 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 G 8.71 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 54 P 0.00 4.40 0.00 1.98 1.99 0.00 4.16 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 2.20 2.24 0.00 55 K 8.17 4.03 0.00 1.60 1.58 0.00 1.56 0.00 0.00 1.54 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.30 1.29 7.81 56 H 7.87 4.70 0.00 3.10 2.84 0.00 5.81 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 T 7.46 4.37 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 1.17 0.00 0.00 58 S 8.96 4.76 0.00 3.83 3.69 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 59 K 8.41 4.14 0.00 1.74 1.81 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.41 1.43 7.81 60 L 7.04 3.95 0.00 0.49 1.00 0.78 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 61 P 0.00 4.57 0.00 2.23 2.11 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.03 0.00 62 Y 7.52 4.88 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 63 K 8.19 4.17 0.00 0.96 1.51 0.00 1.49 0.00 0.00 1.22 0.00 0.00 2.73 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.12 7.81 64 N 8.65 5.26 0.00 2.58 2.70 0.00 0.00 6.83 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 65 V 8.61 4.59 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 0.98 0.00 0.00 0.54 0.00 0.00 66 K 8.60 4.54 0.00 1.66 1.60 0.00 1.66 0.00 0.00 1.64 0.00 0.00 2.71 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.19 1.30 7.81 67 I 8.71 4.07 1.43 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.39 -0.59 0.00 0.00 68 E 8.52 4.63 0.00 1.85 1.87 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 2.16 2.28 0.00 69 L 8.47 4.54 0.00 1.71 1.68 0.78 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.92 4.36 0.00 1.81 1.80 0.00 1.73 0.00 0.00 1.61 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.56 7.81 71 F 8.07 4.49 0.00 3.01 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 72 P 0.00 4.08 0.00 1.63 0.49 0.00 3.66 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.54 0.00 73 D 7.99 4.43 0.00 2.64 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 74 E 8.12 4.54 0.00 1.94 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 2.24 2.15 0.00 75 F 7.40 5.09 0.00 3.35 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 76 L 8.81 4.67 0.00 1.78 1.90 1.05 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 77 E 9.60 4.85 0.00 2.00 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 2.26 2.30 0.00 78 S 7.94 5.46 0.00 3.98 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 79 V 8.11 5.00 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 0.97 0.00 0.00 80 S 8.11 3.87 0.00 3.36 3.56 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 81 G 5.53 3.34 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 0.00 82 Y 7.98 5.35 0.00 2.97 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 83 T 8.84 5.21 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 1.36 0.00 0.00 84 G 8.46 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 85 P 0.00 4.99 0.00 2.04 2.24 0.00 3.71 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 2.09 2.21 0.00 86 F 8.56 5.06 0.00 2.97 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 9.06 3.97 0.00 3.80 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 88 A 6.94 3.79 0.51 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 89 L 7.67 4.21 0.00 1.71 1.72 1.12 1.15 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 90 A 7.60 3.79 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 91 T 8.59 3.82 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 1.25 0.00 0.00 92 P 0.00 3.25 0.00 2.25 2.06 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 93 T 9.18 3.91 4.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 94 P 0.00 4.63 0.00 2.14 2.08 0.00 3.57 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 2.15 2.17 0.00 95 V 8.62 4.69 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 1.04 0.00 0.00 96 V 8.68 4.06 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 1.14 0.00 0.00 0.98 0.00 0.00 97 R 9.48 4.20 0.00 1.93 2.05 0.00 3.16 0.00 0.00 3.07 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.76 0.00 98 S 7.94 5.71 0.00 4.00 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 99 L 8.37 5.05 0.00 1.88 1.47 1.05 0.92 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 0.00 100 T 8.66 4.94 4.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 101 F 8.82 5.30 0.00 3.21 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 0.00 102 K 9.11 5.22 0.00 1.75 1.71 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.40 7.81 103 T 8.74 5.14 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 0.00 104 N 8.17 4.54 0.00 2.52 2.21 0.00 0.00 6.94 7.10 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 0.00 105 K 7.86 4.12 0.00 1.89 1.85 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.10 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.31 1.34 7.81 106 G 8.03 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 0.00 0.00 0.00 107 R 7.58 4.24 0.00 1.80 1.49 0.00 3.04 0.00 0.00 3.82 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.63 0.00 108 T 8.09 4.93 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 1.18 0.00 0.00 109 F 9.60 4.29 0.00 3.30 3.37 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 0.00 110 G 7.47 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 0.00 0.00 0.00 111 P 0.00 3.88 0.00 2.05 2.16 0.00 2.82 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.99 0.00 112 Y 8.63 4.06 0.00 2.88 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 0.00 0.00 0.00 113 G 8.85 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 D 8.00 4.47 0.00 2.89 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 0.00 115 E 8.26 3.94 0.00 1.67 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 1.68 1.60 0.00 116 E 7.51 4.47 0.00 1.80 1.70 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 2.20 2.25 0.00 117 G 8.81 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 T 9.12 4.60 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 1.30 0.00 0.00 119 Y 8.59 4.21 0.00 2.36 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 0.00 120 F 7.43 4.61 0.00 2.12 2.68 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 0.00 121 N 8.02 4.53 0.00 1.82 2.35 0.00 0.00 6.75 7.78 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 0.00 122 L 8.98 4.57 0.00 1.49 1.52 1.09 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 123 P 0.00 4.90 0.00 1.99 1.97 0.00 3.71 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.24 0.00 124 I 8.66 4.35 2.09 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.65 1.01 0.00 0.00 125 E 9.03 4.23 0.00 1.96 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 2.29 2.32 0.00 126 N 8.14 4.80 0.00 2.67 2.64 0.00 0.00 7.06 7.98 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 0.00 127 G 8.12 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 L 8.73 4.86 0.00 1.68 1.49 0.16 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 129 I 8.55 4.54 1.95 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.56 0.60 0.00 0.00 130 V 9.32 4.51 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 0.90 0.00 0.00 1.03 0.00 0.00 131 G 7.05 4.92 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 0.00 132 F 9.01 5.66 0.00 3.66 3.42 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 0.00 133 K 9.03 4.56 0.00 1.61 1.35 0.00 1.55 0.00 0.00 1.43 0.00 0.00 2.71 0.00 0.00 2.82 0.00 0.00 0.00 0.00 0.98 1.22 7.81 134 G 6.12 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 0.00 0.00 0.00 135 R 7.63 5.04 0.00 1.67 1.89 0.00 2.97 0.00 0.00 3.28 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.37 0.00 136 T 9.40 5.04 4.50 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 1.35 0.00 0.00 137 G 9.60 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 D 9.71 4.72 0.00 2.72 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 0.00 139 L 7.41 4.76 0.00 1.82 1.81 1.22 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 140 L 8.51 4.69 0.00 2.13 1.85 1.20 1.23 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 0.00 141 D 9.38 4.58 0.00 2.86 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 0.00 142 A 7.70 5.09 1.07 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 0.00 143 I 8.65 4.78 1.79 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.76 0.94 0.00 0.00 144 G 9.65 4.57 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 0.00 145 I 8.57 5.16 2.02 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.41 nan 0.00 0.00 146 H 8.91 5.38 0.00 3.14 3.12 0.00 5.56 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 0.00 147 M 9.21 5.39 0.00 1.88 1.90 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.52 0.00 148 S 8.77 4.55 0.00 3.73 3.69 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 0.00 149 L 8.29 4.20 0.00 1.61 1.54 0.91 0.79 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