NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3912 8.3044 120.3494 54.8731 33.4099 174.9739 2 I 3.6727 8.3412 126.2535 60.9679 38.8783 173.2593 3 Q 4.8563 8.3630 124.6403 54.1319 33.5392 173.8581 4 S 5.1920 8.6289 116.2100 56.7996 66.4070 173.0790 5 Q 4.8035 8.9899 120.5089 54.6253 30.1864 175.8579 6 I 4.3659 8.4424 112.6268 60.2210 38.8122 174.7371 7 N 4.8599 7.8216 120.1594 51.0450 40.6732 174.6779 8 R 3.9916 8.6228 123.8695 59.2897 29.2733 178.2966 9 N 4.3393 8.7359 117.4687 55.8160 38.4948 177.3972 10 I 3.6896 7.4097 121.1013 64.6383 37.2400 178.7081 11 R 4.0141 7.8936 118.2182 59.0135 29.9654 178.9954 12 L 4.0100 8.2502 119.3507 57.7011 41.6832 179.1581 13 D 4.3558 8.4624 119.3869 57.1204 40.6971 178.4515 14 L 3.9296 7.9044 120.4375 58.0899 42.0325 178.7323 15 A 4.1376 8.1918 120.7805 55.4628 18.2760 179.3253 16 D 4.2870 8.1314 116.9404 57.4563 40.9249 178.8945 17 A 3.9964 7.9256 120.9267 55.1822 18.3630 179.6398 18 I 3.6623 8.1627 118.6991 64.7244 37.2302 178.7484 19 L 4.0852 8.1899 119.8194 57.3919 41.2898 179.3945 20 L 3.9081 7.9591 120.4717 58.2059 42.0608 178.8605 21 S 4.0381 8.0593 113.0657 61.3376 62.3177 175.9871 22 K 3.8025 8.4759 122.4300 59.4253 31.8688 178.6605 23 A 3.9522 8.0241 121.0208 55.0644 18.0965 179.7313 24 K 3.9149 8.0655 116.2055 59.3606 32.2669 178.9783 25 K 4.1673 8.0942 115.7032 55.6419 32.6680 176.0666 26 D 4.3023 7.6587 117.9565 55.0583 40.1488 173.1609 27 L 4.6829 7.6868 116.1952 53.5459 43.6082 177.2688 28 S 4.6284 8.5448 116.1749 56.8985 66.4835 175.5216 29 F 4.2467 8.4177 120.6798 60.3909 38.4515 177.7611 30 A 4.0558 8.1115 119.4095 55.3383 18.3957 179.0257 31 E 4.7085 8.1264 118.2732 59.2902 29.3244 179.7408 32 I 3.7327 7.5891 118.4540 64.2567 37.4933 178.0248 33 A 4.2893 8.2209 121.0442 53.0495 18.5650 177.1814 34 D 4.5050 7.3121 118.8984 56.2275 41.1425 177.6559 35 G 4.0405 9.0485 112.3571 45.5964 0.0000 174.0228 36 T 3.9884 7.8985 110.1393 62.3021 69.2082 176.2920 37 G 3.9378 8.3688 108.4070 45.2645 0.0000 172.7262 38 L 4.7097 7.5698 118.3933 51.9569 44.6359 176.9651 39 A 4.1466 8.3386 123.1091 52.1288 20.2251 178.3768 40 E 3.9003 8.9046 122.9701 59.5571 29.7357 179.3831 41 A 3.9147 8.0017 120.0798 55.1000 18.4579 179.2757 42 F 3.8784 8.1379 118.5911 61.4493 39.6806 177.4526 43 V 3.6518 8.1180 117.9715 66.1146 31.3114 178.1041 44 T 3.7208 8.1257 115.4023 66.5775 68.3332 176.0880 45 A 3.8175 7.7665 122.3473 55.2968 18.2658 179.4848 46 A 4.1109 7.4611 120.0479 54.8764 18.2651 179.8228 47 L 4.0092 7.6870 115.9375 57.6564 41.7413 178.8497 48 L 4.4768 7.5779 116.2082 54.4741 41.6914 177.5093 49 G 3.9084 8.0726 107.1934 45.6322 0.0000 174.3405 50 Q 4.4938 8.2783 116.3059 55.4909 29.7876 175.0437 51 Q 4.4158 7.4058 115.9811 54.4385 32.9801 172.6443 52 A 4.9535 8.3008 120.7105 50.5422 21.0455 176.3779 53 L 4.7387 8.6202 121.5951 52.7393 43.8541 175.0024 54 P 4.5023 0.0000 0.0000 62.5485 32.4624 177.2200 55 A 3.9928 8.8443 123.3728 55.6529 18.1974 179.9796 56 D 4.2820 8.0844 116.4729 57.5276 40.9280 178.7235 57 A 3.9952 8.0290 120.5457 54.9967 18.4376 179.2594 58 A 3.9557 8.1994 119.3314 55.4971 18.4205 180.1592 59 R 3.8790 8.1663 116.5384 59.1046 30.2460 178.9435 60 L 3.9387 8.0819 120.2008 58.4863 42.1578 179.5964 61 V 3.7895 8.1970 112.6690 64.2370 31.4065 178.7972 62 G 3.6335 8.2219 105.4336 47.6760 0.0000 175.6276 63 A 4.0068 8.2355 123.1800 55.0140 18.2407 179.9496 64 K 3.9869 7.8708 115.3912 58.5965 32.1339 178.5443 65 L 4.5216 7.5895 116.1072 53.0902 42.9053 175.8481 66 D 4.3832 7.6295 117.3714 55.2310 38.8646 173.9338 67 L 4.3493 8.1123 117.9318 53.8951 43.1573 177.9093 68 D 4.6905 8.2738 122.0620 53.0043 41.8878 177.2332 69 E 4.0498 8.5611 118.1970 59.4536 29.3468 179.2430 70 D 4.4092 8.1162 118.7301 57.2471 40.9255 178.8360 71 S 4.1185 8.5253 115.8463 61.6825 62.6721 176.6348 72 I 3.7282 7.5589 121.2324 64.3213 37.0914 177.9776 73 L 4.2615 8.0460 121.1344 58.1029 41.9669 178.8311 74 L 3.9942 8.3345 119.4148 57.9823 41.5240 179.5684 75 L 4.0795 8.1247 118.3972 57.3064 41.2836 178.8410 76 Q 4.6058 7.6421 117.6557 55.7920 29.3928 176.0657 77 M 4.4879 7.3279 120.1474 54.9680 33.0971 176.4392 78 I 4.0115 8.8161 124.7543 60.7803 38.0969 174.3349 79 P 4.6813 0.0000 0.0000 62.2771 32.8494 176.1467 80 L 4.3471 8.2847 123.0465 54.0401 41.6341 176.4311 81 R 4.1883 8.3558 125.2170 55.8401 30.9398 175.2721 82 G 3.1000 8.2759 107.4326 45.1331 0.0000 173.3828 83 C 4.3233 8.1328 121.9906 58.5627 30.7701 174.4546 84 I 4.0723 7.4984 122.0251 60.3579 37.6405 174.9371 85 D 4.4596 8.8650 125.5419 57.1200 41.5837 176.5694 86 D 4.6391 7.3547 115.2776 53.2613 41.5965 173.9084 87 R 4.2294 8.1756 127.1449 56.5936 29.2737 177.0437 88 I 3.9899 7.1699 116.2499 58.3011 38.9462 173.9478 89 P 4.4258 0.0000 0.0000 62.8850 31.8260 176.4865 90 T 4.1807 8.3352 111.4706 63.4672 69.9193 175.5529 91 D 4.4604 7.9809 122.2903 53.3302 42.4244 174.6087 92 P 4.3312 0.0000 0.0000 66.1431 31.1696 178.8506 93 T 3.8675 7.9399 112.9045 67.0553 68.5067 176.2058 94 M 4.4839 8.2391 120.1656 58.6519 31.9258 178.1810 95 Y 3.9845 8.7977 120.0625 60.7611 38.8840 178.2493 96 R 3.8641 8.1068 119.0042 59.4157 29.8616 179.0289 97 F 4.2218 7.6690 117.1384 60.5313 38.8724 177.1162 98 Y 3.9771 7.8239 118.8192 60.6301 38.6617 177.3775 99 E 3.7145 8.3503 120.5667 59.5023 29.5907 178.5664 100 M 4.1554 8.2102 118.8455 58.5384 31.9638 178.7659 101 L 4.0115 7.4934 118.9172 57.7604 41.5607 179.4869 102 Q 3.7941 7.5137 117.2422 58.5263 28.6037 178.6119 103 V 3.6406 7.6485 118.4795 65.0854 32.0729 176.8224 104 Y 4.7307 8.1187 113.9323 57.3108 38.6050 177.6938 105 G 3.6673 8.2393 109.2869 48.2532 0.0000 176.2247 106 T 4.0136 7.8352 111.9183 64.4390 68.8668 176.8073 107 T 3.9241 7.8602 118.3948 66.4249 68.5301 176.3996 108 L 3.9983 8.4571 121.3545 57.6455 41.6197 179.4165 109 K 3.7756 8.1298 119.1604 59.5128 32.1280 178.5393 110 A 4.0246 8.1012 120.8942 55.3445 18.3086 179.6351 111 L 4.0120 8.1568 117.4491 57.5131 41.7343 179.6361 112 V 3.7809 8.0749 118.6082 66.6006 31.2120 177.8747 113 H 5.1081 8.2269 117.1772 58.4364 28.3075 177.5131 114 E 3.9528 8.2089 120.2013 59.2636 29.6029 178.6273 115 K 3.9789 8.3948 117.5915 58.0076 32.2734 178.0753 116 F 4.2436 9.0407 116.1121 61.0032 41.2515 174.9044 117 G 3.8858 8.1964 103.0811 43.4985 0.0000 171.5567 118 D 4.7355 8.7227 119.9398 53.7028 42.3284 176.7555 119 G 3.7941 7.8335 113.2935 45.6754 0.0000 171.7523 120 I 4.7929 8.2058 115.0484 59.2885 41.8027 174.6079 121 I 4.7076 8.0937 123.5505 59.6773 38.1652 175.8606 122 S 4.2471 8.9847 123.1351 58.4175 62.7398 173.8089 123 A 3.8747 8.5515 127.6658 52.0810 19.3991 176.9487 124 I 4.2561 7.8060 115.6358 63.0980 39.0657 176.9306 125 N 4.7790 7.8006 123.8035 52.3644 37.9246 172.1309 126 F 5.5215 8.1245 123.5292 56.5724 42.8300 172.4405 127 K 4.5145 8.2865 123.7378 55.2610 36.3855 174.6492 128 L 5.6260 8.1758 119.5040 53.9334 43.7269 174.7184 129 D 4.8086 8.3689 117.9259 52.1016 43.2082 173.8207 130 V 4.8113 8.3133 119.1489 61.0418 34.1735 174.4657 131 K 4.6497 8.9329 128.5530 54.4435 35.5236 174.2993 132 K 5.0092 8.7016 128.0613 55.2002 33.5160 175.6527 133 V 4.7038 8.6360 119.4739 58.9943 36.1547 174.9092 134 A 4.4993 8.5660 124.2311 52.1730 19.2326 176.6552 135 D 4.6136 8.9159 121.7712 52.4247 42.1841 175.7067 136 P 4.2232 0.0000 0.0000 65.6370 31.4093 176.8044 137 E 4.2563 8.7211 115.6116 55.8596 29.7530 176.7143 138 G 3.9728 8.3969 108.0346 46.1172 0.0000 175.7300 139 G 3.8209 8.9971 108.6356 44.1632 0.0000 171.7771 140 E 5.2533 8.3623 116.5385 54.7148 33.7646 175.4794 141 R 4.8096 9.1403 119.6447 54.4352 34.4478 174.2587 142 A 5.0010 8.5757 123.2992 50.6184 20.9707 176.7505 143 V 4.1840 9.0602 123.4641 61.4106 33.3599 174.2737 144 I 4.8939 8.3349 129.2275 60.0325 38.8990 175.3657 145 T 4.5024 8.7006 124.7486 61.9864 70.2578 173.6478 146 L 4.8071 8.5094 126.7148 53.2279 43.7489 175.9347 147 D 4.5940 8.7102 123.1077 52.3801 43.3367 173.9983 148 G 4.6871 8.4622 111.5448 43.6347 0.0000 170.3725 149 K 4.2972 8.7563 124.3384 56.0871 33.4864 175.4344 150 Y 4.5456 8.7859 129.2469 57.6383 39.6060 174.8323 151 G 3.8946 8.9696 115.2927 43.4552 0.0000 170.6500 152 P 4.5064 0.0000 0.0000 62.4754 32.3267 176.2106 153 T 4.4564 9.0769 119.8609 62.4067 69.6058 174.0912 154 K 4.6379 8.4753 125.7308 53.3947 35.0549 174.6740 155 P 4.3838 0.0000 0.0000 63.0253 31.9497 176.4827 156 F 4.5450 7.8790 114.2616 57.1278 37.9772 174.7126 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 M 8.30 4.39 0.00 1.98 2.04 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.60 0.00 2 I 8.34 3.67 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.05 0.91 0.00 0.00 3 Q 8.36 4.86 0.00 1.96 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.50 2.27 0.00 4 S 8.63 5.19 0.00 3.81 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 5 Q 8.99 4.80 0.00 2.03 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.73 0.00 0.00 0.00 0.00 0.00 2.31 2.43 0.00 6 I 8.44 4.37 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 1.30 0.67 0.91 0.00 0.00 7 N 7.82 4.86 0.00 2.76 2.67 0.00 0.00 6.93 7.65 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 8 R 8.62 3.99 0.00 2.06 2.28 0.00 3.12 0.00 0.00 3.32 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.72 0.00 9 N 8.74 4.34 0.00 2.86 2.91 0.00 0.00 6.84 7.42 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 10 I 7.41 3.69 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 1.52 1.40 0.91 0.00 0.00 11 R 7.89 4.01 0.00 1.80 1.96 0.00 3.28 0.00 0.00 3.51 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.65 0.00 12 L 8.25 4.01 0.00 1.67 1.71 0.91 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 13 D 8.46 4.36 0.00 2.91 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 14 L 7.90 3.93 0.00 1.79 1.83 0.93 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 15 A 8.19 4.14 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 16 D 8.13 4.29 0.00 2.93 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 17 A 7.93 4.00 1.39 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 0.00 0.00 0.00 18 I 8.16 3.66 2.07 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 1.54 0.69 0.96 0.00 0.00 19 L 8.19 4.09 0.00 1.85 1.74 0.99 0.65 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 20 L 7.96 3.91 0.00 1.77 1.80 0.92 0.88 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 21 S 8.06 4.04 0.00 3.93 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 K 8.48 3.80 0.00 1.76 1.90 0.00 1.13 0.00 0.00 1.17 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.21 1.22 7.81 23 A 8.02 3.95 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 24 K 8.07 3.91 0.00 1.88 1.87 0.00 1.69 0.00 0.00 1.69 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.47 1.60 7.81 25 K 8.09 4.17 0.00 1.73 1.82 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.44 1.57 7.81 26 D 7.66 4.30 0.00 2.77 2.67 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 27 L 7.69 4.68 0.00 1.56 1.45 1.01 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 28 S 8.54 4.63 0.00 4.04 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 F 8.42 4.25 0.00 3.22 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 30 A 8.11 4.06 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 31 E 8.13 4.71 0.00 2.20 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 2.33 2.21 0.00 32 I 7.59 3.73 1.94 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 1.43 0.56 0.96 0.00 0.00 33 A 8.22 4.29 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 34 D 7.31 4.51 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 35 G 9.05 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.90 3.99 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 37 G 8.37 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 38 L 7.57 4.71 0.00 1.72 1.64 1.04 0.34 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 39 A 8.34 4.15 1.30 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 40 E 8.90 3.90 0.00 2.08 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 2.43 2.47 0.00 41 A 8.00 3.91 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 F 8.14 3.88 0.00 3.21 3.23 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 43 V 8.12 3.65 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 1.05 0.00 0.00 1.12 0.00 0.00 44 T 8.13 3.72 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 0.36 0.00 0.00 45 A 7.77 3.82 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 46 A 7.46 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 L 7.69 4.01 0.00 1.85 1.84 1.16 0.84 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 48 L 7.58 4.48 0.00 1.66 1.64 0.75 0.88 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 49 G 8.07 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 50 Q 8.28 4.49 0.00 1.94 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 6.63 0.00 0.00 0.00 0.00 0.00 2.35 2.36 0.00 51 Q 7.41 4.42 0.00 1.39 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 6.89 0.00 0.00 0.00 0.00 0.00 2.01 1.40 0.00 52 A 8.30 4.95 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 L 8.62 4.74 0.00 1.65 1.65 0.96 1.25 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 54 P 0.00 4.50 0.00 2.09 1.99 0.00 3.71 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 2.13 2.12 0.00 55 A 8.84 3.99 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 56 D 8.08 4.28 0.00 2.71 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 57 A 8.03 4.00 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 58 A 8.20 3.96 1.46 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 0.00 0.00 0.00 59 R 8.17 3.88 0.00 2.01 2.00 0.00 3.14 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.75 0.00 60 L 8.08 3.94 0.00 1.87 1.85 0.93 0.98 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 61 V 8.20 3.79 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 1.05 0.00 0.00 62 G 8.22 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 A 8.24 4.01 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 64 K 7.87 3.99 0.00 1.95 1.88 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.48 1.68 7.81 65 L 7.59 4.52 0.00 1.69 1.66 0.93 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 66 D 7.63 4.38 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 67 L 8.11 4.35 0.00 1.60 1.59 0.93 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 68 D 8.27 4.69 0.00 2.95 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 E 8.56 4.05 0.00 2.00 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 2.40 2.34 0.00 70 D 8.12 4.41 0.00 2.72 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 71 S 8.53 4.12 0.00 4.05 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 72 I 7.56 3.73 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.61 0.99 0.00 0.00 73 L 8.05 4.26 0.00 1.87 1.86 0.93 0.52 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 74 L 8.33 3.99 0.00 1.87 1.71 0.92 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 75 L 8.12 4.08 0.00 1.88 1.73 0.94 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 7.64 4.61 0.00 2.22 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.86 0.00 0.00 0.00 0.00 0.00 2.54 2.37 0.00 77 M 7.33 4.49 0.00 1.92 2.14 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.83 2.53 0.00 78 I 8.82 4.01 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.71 0.92 0.00 0.00 79 P 0.00 4.68 0.00 2.12 2.04 0.00 3.75 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.93 0.00 80 L 8.28 4.35 0.00 1.67 1.65 0.91 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 81 R 8.36 4.19 0.00 1.82 1.80 0.00 3.23 0.00 0.00 3.20 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.60 0.00 82 G 8.28 3.10 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 0.00 0.00 0.00 83 C 8.13 4.32 0.00 3.06 3.02 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 84 I 7.50 4.07 1.85 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 1.29 0.53 0.93 0.00 0.00 85 D 8.86 4.46 0.00 2.63 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 86 D 7.35 4.64 0.00 2.60 2.48 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 87 R 8.18 4.23 0.00 1.98 2.04 0.00 3.21 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 88 I 7.17 3.99 1.76 0.00 0.00 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 1.32 0.75 0.69 0.00 0.00 89 P 0.00 4.43 0.00 2.16 2.03 0.00 3.29 0.00 0.00 3.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.06 0.00 90 T 8.34 4.18 4.23 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 1.20 0.00 0.00 91 D 7.98 4.46 0.00 2.85 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 92 P 0.00 4.33 0.00 2.22 2.12 0.00 3.68 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.19 0.00 93 T 7.94 3.87 4.48 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 1.33 0.00 0.00 94 M 8.24 4.48 0.00 2.16 2.22 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 2.71 2.63 0.00 95 Y 8.80 3.98 0.00 3.19 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 96 R 8.11 3.86 0.00 1.45 1.72 0.00 3.34 0.00 0.00 3.27 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.73 0.00 97 F 7.67 4.22 0.00 3.34 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 98 Y 7.82 3.98 0.00 2.90 2.60 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 99 E 8.35 3.71 0.00 1.98 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 2.32 2.40 0.00 100 M 8.21 4.16 0.00 2.17 2.35 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.63 0.00 101 L 7.49 4.01 0.00 1.50 1.56 0.91 0.94 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 0.00 102 Q 7.51 3.79 0.00 1.95 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.94 0.00 0.00 0.00 0.00 0.00 1.65 2.31 0.00 103 V 7.65 3.64 1.92 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 0.13 0.00 0.00 0.87 0.00 0.00 104 Y 8.12 4.73 0.00 3.20 2.89 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 0.00 105 G 8.24 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 0.00 0.00 0.00 106 T 7.84 4.01 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 107 T 7.86 3.92 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 1.34 0.00 0.00 108 L 8.46 4.00 0.00 1.84 1.73 0.95 1.05 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 0.00 109 K 8.13 3.78 0.00 1.83 1.99 0.00 1.68 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.47 1.46 7.81 110 A 8.10 4.02 1.42 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 0.00 0.00 111 L 8.16 4.01 0.00 1.75 1.76 0.95 0.70 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 0.00 112 V 8.07 3.78 2.21 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 1.00 0.00 0.00 0.89 0.00 0.00 113 H 8.23 5.11 0.00 3.38 3.36 0.00 5.68 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.21 3.95 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 2.30 2.33 0.00 115 K 8.39 3.98 0.00 1.67 1.26 0.00 1.75 0.00 0.00 1.63 0.00 0.00 3.01 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.50 7.81 116 F 9.04 4.24 0.00 2.34 1.45 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 0.00 117 G 8.20 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 0.00 118 D 8.72 4.74 0.00 2.75 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 0.00 119 G 7.83 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 0.00 120 I 8.21 4.79 1.85 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.05 0.92 0.00 0.00 121 I 8.09 4.71 1.82 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.68 0.93 0.00 0.00 122 S 8.98 4.25 0.00 3.92 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 A 8.55 3.87 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 I 7.81 4.26 1.88 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 1.15 0.94 0.93 0.00 0.00 125 N 7.80 4.78 0.00 2.80 2.75 0.00 0.00 6.47 7.71 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 0.00 126 F 8.12 5.52 0.00 3.14 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 0.00 127 K 8.29 4.51 0.00 1.59 1.67 0.00 1.23 0.00 0.00 1.60 0.00 0.00 2.78 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.12 1.13 7.81 128 L 8.18 5.63 0.00 1.71 1.34 1.04 0.80 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 0.00 129 D 8.37 4.81 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 0.00 130 V 8.31 4.81 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 0.84 0.00 0.00 0.92 0.00 0.00 131 K 8.93 4.65 0.00 1.85 1.73 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.35 7.81 132 K 8.70 5.01 0.00 1.82 1.70 0.00 2.14 0.00 0.00 1.73 0.00 0.00 2.85 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.36 1.47 7.81 133 V 8.64 4.70 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 0.65 0.00 0.00 1.00 0.00 0.00 134 A 8.57 4.50 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 0.00 135 D 8.92 4.61 0.00 2.70 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 0.00 136 P 0.00 4.22 0.00 2.08 2.13 0.00 3.72 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 137 E 8.72 4.26 0.00 2.03 1.98 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 2.31 2.39 0.00 138 G 8.40 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 G 9.00 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 0.00 140 E 8.36 5.25 0.00 1.82 1.82 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 2.21 2.31 0.00 141 R 9.14 4.81 0.00 1.68 1.77 0.00 3.25 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.55 0.00 142 A 8.58 5.00 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 0.00 143 V 9.06 4.18 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 0.97 0.00 0.00 0.94 0.00 0.00 144 I 8.33 4.89 1.96 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.82 0.92 0.00 0.00 145 T 8.70 4.50 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 146 L 8.51 4.81 0.00 1.62 1.88 1.00 1.17 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 0.00 147 D 8.71 4.59 0.00 2.58 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 0.00 148 G 8.46 4.69 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 0.00 0.00 0.00 149 K 8.76 4.30 0.00 1.95 1.71 0.00 1.57 0.00 0.00 1.59 0.00 0.00 2.95 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.44 1.46 7.81 150 Y 8.79 4.55 0.00 2.56 2.90 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 0.00 151 G 8.97 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 0.00 152 P 0.00 4.51 0.00 2.01 1.88 0.00 3.47 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.85 0.00 153 T 9.08 4.46 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 1.30 0.00 0.00 154 K 8.48 4.64 0.00 1.75 1.73 0.00 1.79 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.37 1.43 7.81 155 P 0.00 4.38 0.00 2.03 1.94 0.00 3.65 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 2.03 2.08 0.00 156 F 7.88 4.54 0.00 3.08 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