NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3380 8.3044 120.3385 55.6800 32.3199 173.9816 2 M 4.3005 8.2442 125.7144 53.2938 33.8432 173.9436 3 K 4.5729 8.8463 124.5352 54.2986 36.9212 175.8639 4 K 4.1382 8.5740 123.2123 56.3315 32.6686 176.3886 5 I 4.5783 7.9291 123.3726 59.2856 40.4052 174.9956 6 D 4.6947 8.8031 127.4227 54.2960 41.9576 175.6699 7 V 4.9177 8.3390 121.6068 59.7509 34.6080 174.6060 8 K 4.6278 9.2002 124.4960 54.7155 35.3363 174.5230 9 I 4.5271 8.4086 127.7178 60.4021 37.6672 175.4238 10 L 4.5060 9.1316 127.2611 54.9518 43.3539 176.4911 11 D 4.9056 7.8397 118.4711 51.3102 43.5388 174.4448 12 P 4.4212 0.0000 0.0000 64.8246 31.7400 177.5195 13 R 3.9206 8.0659 118.1878 58.1621 30.4431 176.6941 14 V 2.9904 7.1421 118.5889 63.7686 31.7834 175.7954 15 G 3.7710 8.5562 115.2582 46.3935 0.0000 174.7585 16 K 4.1622 7.5558 118.2968 58.0157 32.7964 177.9406 17 E 4.3997 7.9817 116.1453 56.8350 30.2480 176.0450 18 F 4.8648 6.8136 112.3223 55.2589 40.3220 171.7371 19 P 4.8583 0.0000 0.0000 61.3646 32.2651 176.3717 20 L 4.2248 8.1489 119.8165 54.0961 42.1388 175.8381 21 P 4.4400 0.0000 0.0000 62.9346 31.9196 176.1128 22 T 4.6447 7.8913 110.8341 59.7479 71.8300 173.2499 23 Y 4.1535 8.4196 121.2081 57.7552 38.7378 175.9377 24 A 4.2026 8.9434 127.9017 54.9904 18.9263 177.4195 25 T 4.8216 7.8316 103.9037 59.6568 72.0304 174.9637 26 S 4.1572 8.7566 116.1835 60.4959 63.0519 175.1263 27 G 3.9481 7.4485 107.4410 45.2871 0.0000 174.0703 28 S 4.3392 7.7708 116.5795 58.2569 63.4342 174.3087 29 A 4.3198 8.7216 126.7940 53.3587 19.2441 177.3753 30 G 4.4417 8.0449 100.8897 44.4648 0.0000 172.5969 31 L 4.7038 8.5064 120.1573 52.5656 44.2817 176.0760 32 D 4.9428 8.7200 123.8397 54.1728 41.9271 175.5856 33 L 4.7836 8.9130 122.5333 53.1056 44.4278 175.7068 34 R 4.9588 8.3505 121.2874 54.0761 32.5629 175.9343 35 A 3.9249 8.5493 125.0363 52.3306 19.5433 176.2408 36 C 4.9276 8.9628 124.6527 57.7416 31.8333 172.6152 37 L 4.9080 8.1342 124.0016 52.8933 44.7145 176.7341 38 N 4.6044 9.0199 119.4075 55.3071 39.1515 175.3815 39 D 4.8052 7.6781 115.5474 51.7709 44.8639 174.9368 40 A 4.3303 8.5751 124.1224 52.4437 19.4941 176.9503 41 V 4.2712 8.5912 120.1750 61.0140 34.2927 174.1064 42 E 4.7765 8.8948 129.7013 55.3270 30.5766 175.2773 43 L 4.6501 9.1776 128.6835 53.1414 43.1750 176.5653 44 A 4.5989 8.7328 125.8632 50.0238 20.1177 174.7362 45 P 4.3132 0.0000 0.0000 64.5312 31.6768 177.4666 46 G 4.2323 9.1100 112.0075 45.3663 0.0000 173.5142 47 D 4.7390 8.1769 120.1977 54.6455 42.0497 175.5581 48 T 5.2901 8.5106 117.7281 62.2209 71.8302 173.2690 49 T 4.6837 8.9953 118.7583 60.3387 71.6228 172.2468 50 L 4.8694 8.5620 129.0219 53.8334 43.2964 175.4652 51 V 4.3338 8.7748 127.9203 60.6766 33.2146 173.7311 52 P 4.9097 0.0000 0.0000 62.9892 32.2636 176.7477 53 T 4.3552 8.3811 110.2928 60.6871 70.5982 175.8147 54 G 4.0385 9.2410 110.8118 45.6755 0.0000 172.5729 55 L 5.3897 7.8093 118.3594 52.7373 46.3529 175.3837 56 A 5.2062 9.1360 122.7359 50.1728 22.3599 175.1151 57 I 4.9861 8.4071 112.7381 59.4686 41.6542 174.2150 58 H 4.9227 9.0405 122.4351 54.6116 30.8102 173.0441 59 I 3.7271 8.6316 126.4323 63.4348 37.4078 176.9202 60 A 4.0168 8.2946 124.5589 52.2669 18.1672 177.6123 61 D 4.4821 7.6781 116.2752 53.1844 40.9742 174.7283 62 P 4.5822 0.0000 0.0000 63.9072 31.7541 176.8580 63 S 4.7705 8.7200 115.9081 58.4573 62.9782 172.8858 64 L 5.4281 7.8879 121.8584 53.3787 45.0726 175.1461 65 A 5.0371 9.1320 124.7151 50.4936 23.5407 174.4349 66 A 4.9343 8.7128 120.0068 50.3689 22.3549 175.5491 67 M 5.0422 8.7450 119.7688 53.7556 35.6629 174.6786 68 M 4.8190 8.9785 123.8992 54.2820 33.9372 175.3974 69 L 5.1628 8.8856 122.6968 51.9149 46.2892 174.4602 70 P 4.6433 0.0000 0.0000 62.6147 32.2913 176.7691 71 R 4.1620 8.4167 120.9418 56.0137 31.0804 178.2836 72 S 4.2125 8.7734 117.0835 61.5458 63.2019 177.0869 73 G 3.5642 7.9798 109.0722 47.3625 0.0000 175.2375 74 L 4.0836 8.0678 121.5593 57.5055 41.7398 179.8682 75 G 3.4341 8.1156 105.2446 48.0301 0.0000 175.3229 76 H 4.1004 8.2188 120.4330 58.7632 30.0820 177.1236 77 K 4.0297 8.2203 118.9100 58.0927 32.2031 177.3637 78 H 4.6957 7.7337 112.2565 54.3095 30.4570 173.7094 79 G 3.6275 7.8971 107.5463 46.4328 0.0000 173.1451 80 I 4.3825 7.5142 121.1818 59.6103 38.2513 175.0939 81 V 4.4834 8.2310 123.0898 60.0807 36.0472 174.0771 82 L 5.1384 8.5264 120.2704 53.8813 43.3227 178.5733 83 G 3.7061 9.3634 112.3496 47.4049 0.0000 174.0975 84 N 4.5876 8.0782 114.9092 52.0947 37.6353 174.8349 85 L 4.1514 8.0557 123.1279 55.1033 40.7146 174.5007 86 V 4.4929 7.4799 115.6311 61.0354 34.6301 174.1366 87 G 3.9799 8.8816 115.6249 44.3736 0.0000 171.9127 88 L 4.7829 8.4061 129.2073 54.1352 43.3962 175.7895 89 I 4.3369 8.6687 127.7337 59.5276 39.3469 175.2354 90 D 4.9851 8.6479 127.3431 53.6832 41.7856 178.0014 91 S 4.2233 8.8885 115.0017 61.3074 63.1188 175.4734 92 D 4.7810 7.9988 117.9697 54.3529 41.2182 175.7382 93 Y 4.2937 8.0168 123.0520 57.6099 39.2024 175.5695 94 Q 4.6221 7.1339 121.7931 54.2943 29.7933 175.2090 95 G 3.6612 5.4476 107.2771 43.6153 0.0000 173.3453 96 Q 4.2143 8.3035 120.0979 55.9265 29.2075 175.5088 97 L 4.4262 9.0958 125.5718 55.0701 42.5835 175.7939 98 M 4.9591 8.7480 123.3968 53.4946 35.2210 175.1936 99 I 4.3556 8.6924 123.7985 59.5076 39.9716 174.9115 100 S 4.8048 8.7215 122.8298 57.8597 63.1086 172.4162 101 V 4.5726 8.8274 128.9407 61.0321 33.3328 174.2480 102 W 5.3362 9.1451 135.0000 55.6629 33.9496 173.7320 103 N 4.8717 9.1900 126.8897 52.5573 38.4294 174.8839 104 R 3.2646 8.0711 122.4270 55.9397 29.9999 177.1312 105 G 4.2364 7.6983 110.2534 45.0049 0.0000 173.6232 106 Q 4.5457 8.6250 119.0450 55.5394 30.1741 174.6786 107 D 5.0801 7.6874 117.8654 52.0478 43.4552 176.3048 108 S 4.5883 8.7188 118.7449 59.1050 64.5537 173.0261 109 F 4.8047 9.0930 124.2339 56.9836 42.9872 173.1007 110 T 4.9993 7.7616 122.2104 61.8390 70.3932 174.0155 111 I 4.3564 8.8710 128.8244 61.0695 38.3863 175.4907 112 Q 4.6040 9.2883 127.0824 54.0986 30.4163 174.1065 113 P 4.3361 0.0000 0.0000 64.5338 31.7231 177.1070 114 G 3.4402 8.5965 111.5213 44.9822 0.0000 173.4395 115 E 4.0102 7.8549 121.5815 55.5731 30.2338 176.0577 116 R 4.3590 8.4362 125.1005 56.4626 30.4025 176.2001 117 I 4.3733 8.5342 121.4810 60.3881 39.7607 173.8830 118 A 4.6324 7.3399 119.7494 51.8214 22.8701 174.4776 119 Q 5.0758 9.0928 117.0949 54.5624 33.6423 174.6082 120 M 5.2675 9.0412 120.1496 53.8282 35.8483 173.9989 121 I 4.9106 8.5874 118.6531 59.1168 41.2814 174.0573 122 F 5.2469 8.8862 122.0158 56.0146 40.8653 175.4585 123 V 4.6483 8.8379 116.6759 58.6358 35.6176 173.6277 124 P 4.9159 0.0000 0.0000 63.0219 31.8876 176.0880 125 V 4.6211 8.4211 115.3482 59.6082 35.6404 175.2184 126 V 4.3631 8.3120 121.4855 61.1041 33.9080 174.8540 127 Q 4.3202 8.4279 125.0354 54.1733 29.7627 175.6385 128 A 3.7987 8.2982 126.2826 51.9377 18.9229 176.3107 129 E 4.3077 8.2258 123.1066 54.0100 30.1260 175.6181 130 F 4.5408 8.3195 125.5567 57.3572 39.6397 174.8760 131 N 4.8435 8.7163 122.9935 51.4133 39.7222 173.7096 132 L 4.1842 8.5096 128.5977 54.8410 42.7255 176.3418 133 V 4.5687 8.0560 118.1971 59.7050 35.1611 175.2434 134 E 4.2742 8.5452 120.1697 57.6486 30.2733 176.6596 135 D 4.5192 7.4190 116.7295 52.6482 45.0125 175.0939 136 F 4.6606 8.4521 120.6045 57.9222 39.0693 175.6390 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 4.34 0.00 1.97 2.07 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.46 0.00 2 M 8.24 4.30 0.00 2.03 1.88 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.65 0.00 3 K 8.85 4.57 0.00 1.59 1.54 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.98 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.28 1.33 7.81 4 K 8.57 4.14 0.00 1.71 1.71 0.00 1.67 0.00 0.00 1.69 0.00 0.00 2.80 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.43 7.81 5 I 7.93 4.58 1.71 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 1.19 0.17 0.92 0.00 0.00 6 D 8.80 4.69 0.00 2.62 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 8.34 4.92 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.02 0.00 0.00 8 K 9.20 4.63 0.00 1.78 1.65 0.00 1.60 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.37 7.81 9 I 8.41 4.53 1.86 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 0.71 0.90 0.00 0.00 10 L 9.13 4.51 0.00 1.52 1.73 0.94 0.98 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 11 D 7.84 4.91 0.00 2.66 2.50 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 12 P 0.00 4.42 0.00 2.18 2.14 0.00 3.81 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 1.97 1.97 0.00 13 R 8.07 3.92 0.00 1.80 1.85 0.00 3.27 0.00 0.00 3.37 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.59 0.00 14 V 7.14 2.99 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 0.78 0.00 0.00 1.01 0.00 0.00 15 G 8.56 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 0.00 0.00 0.00 16 K 7.56 4.16 0.00 1.75 1.75 0.00 1.71 0.00 0.00 1.67 0.00 0.00 2.77 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.32 1.45 7.81 17 E 7.98 4.40 0.00 1.96 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 2.29 2.19 0.00 18 F 6.81 4.86 0.00 3.21 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 19 P 0.00 4.86 0.00 2.13 2.05 0.00 3.87 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.15 0.00 20 L 8.15 4.22 0.00 1.65 1.62 0.95 1.01 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 21 P 0.00 4.44 0.00 1.98 2.15 0.00 3.65 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 22 T 7.89 4.64 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 1.29 0.00 0.00 23 Y 8.42 4.15 0.00 3.04 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 24 A 8.94 4.20 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 25 T 7.83 4.82 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 26 S 8.76 4.16 0.00 3.97 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 27 G 7.45 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 0.00 0.00 0.00 28 S 7.77 4.34 0.00 4.20 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 29 A 8.72 4.32 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 30 G 8.04 4.44 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 0.00 31 L 8.51 4.70 0.00 1.49 1.40 0.90 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.00 0.00 0.00 0.00 0.00 0.00 32 D 8.72 4.94 0.00 2.54 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 L 8.91 4.78 0.00 1.52 1.52 0.90 0.73 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 34 R 8.35 4.96 0.00 1.26 1.26 0.00 3.33 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 35 A 8.55 3.92 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 36 C 8.96 4.93 0.00 3.23 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 37 L 8.13 4.91 0.00 1.51 1.68 0.92 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 38 N 9.02 4.60 0.00 2.73 2.89 0.00 0.00 6.76 8.08 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 39 D 7.68 4.81 0.00 2.59 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.58 4.33 1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.59 4.27 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 1.12 0.00 0.00 1.00 0.00 0.00 42 E 8.89 4.78 0.00 2.01 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 2.27 2.34 0.00 43 L 9.18 4.65 0.00 1.77 1.65 0.96 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 44 A 8.73 4.60 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 45 P 0.00 4.31 0.00 2.07 2.23 0.00 3.72 0.00 0.00 3.68 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 46 G 9.11 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 0.00 0.00 0.00 0.00 47 D 8.18 4.74 0.00 2.85 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 48 T 8.51 5.29 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 1.26 0.00 0.00 49 T 9.00 4.68 4.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 50 L 8.56 4.87 0.00 1.68 1.58 0.98 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 51 V 8.77 4.33 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 0.93 0.00 0.00 0.95 0.00 0.00 52 P 0.00 4.91 0.00 2.27 2.09 0.00 3.73 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.11 0.00 53 T 8.38 4.36 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 1.27 0.00 0.00 54 G 9.24 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 55 L 7.81 5.39 0.00 1.57 1.57 1.00 0.89 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 56 A 9.14 5.21 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 57 I 8.41 4.99 2.01 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.12 1.04 0.00 0.00 58 H 9.04 4.92 0.00 3.09 3.22 0.00 5.78 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 I 8.63 3.73 1.98 0.00 0.00 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 1.65 0.87 1.04 0.00 0.00 60 A 8.29 4.02 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 61 D 7.68 4.48 0.00 2.68 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 62 P 0.00 4.58 0.00 2.22 2.17 0.00 3.41 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 63 S 8.72 4.77 0.00 4.03 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 64 L 7.89 5.43 0.00 1.64 1.54 1.08 1.03 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 65 A 9.13 5.04 1.26 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 66 A 8.71 4.93 0.75 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 67 M 8.75 5.04 0.00 1.86 1.88 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.45 2.44 0.00 68 M 8.98 4.82 0.00 1.87 1.92 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 69 L 8.89 5.16 0.00 1.49 1.49 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 70 P 0.00 4.64 0.00 1.91 1.94 0.00 3.67 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 71 R 8.42 4.16 0.00 1.84 1.83 0.00 3.05 0.00 0.00 3.45 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.64 0.00 72 S 8.77 4.21 0.00 4.04 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 73 G 7.98 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 0.00 0.00 0.00 74 L 8.07 4.08 0.00 1.60 1.64 0.87 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 75 G 8.12 3.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 H 8.22 4.10 0.00 3.09 3.42 0.00 5.95 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 K 8.22 4.03 0.00 1.76 1.62 0.00 1.72 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.44 1.51 7.81 78 H 7.73 4.70 0.00 3.11 3.23 0.00 5.84 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 79 G 7.90 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 80 I 7.51 4.38 1.33 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 -0.36 0.54 0.00 0.00 81 V 8.23 4.48 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 0.63 0.00 0.00 0.80 0.00 0.00 82 L 8.53 5.14 0.00 1.69 1.75 0.98 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 83 G 9.36 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 N 8.08 4.59 0.00 2.79 2.86 0.00 0.00 6.06 7.74 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 85 L 8.06 4.15 0.00 1.87 1.93 0.94 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.48 4.49 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 0.85 0.00 0.00 0.93 0.00 0.00 87 G 8.88 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.41 4.78 0.00 1.61 1.53 0.96 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.67 4.34 1.85 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.77 1.03 0.00 0.00 90 D 8.65 4.99 0.00 2.69 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 91 S 8.89 4.22 0.00 4.08 4.42 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 92 D 8.00 4.78 0.00 2.77 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 93 Y 8.02 4.29 0.00 2.99 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 94 Q 7.13 4.62 0.00 1.95 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.59 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 95 G 5.45 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 0.00 0.00 0.00 96 Q 8.30 4.21 0.00 2.06 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.95 0.00 0.00 0.00 0.00 0.00 2.41 2.63 0.00 97 L 9.10 4.43 0.00 1.69 1.64 0.99 0.82 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 98 M 8.75 4.96 0.00 1.88 1.95 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 2.54 2.75 0.00 99 I 8.69 4.36 1.87 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 1.11 0.62 0.90 0.00 0.00 100 S 8.72 4.80 0.00 3.90 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 0.00 101 V 8.83 4.57 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 1.01 0.00 0.00 0.99 0.00 0.00 102 W 9.15 5.34 0.00 3.30 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 0.00 103 N 9.19 4.87 0.00 2.76 2.82 0.00 0.00 6.89 7.85 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 0.00 104 R 8.07 3.26 0.00 0.88 0.66 0.00 2.79 0.00 0.00 2.92 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.14 0.00 105 G 7.70 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 0.00 0.00 0.00 0.00 106 Q 8.63 4.55 0.00 1.97 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.87 6.58 0.00 0.00 0.00 0.00 0.00 2.23 2.37 0.00 107 D 7.69 5.08 0.00 2.55 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 0.00 108 S 8.72 4.59 0.00 3.79 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 0.00 109 F 9.09 4.80 0.00 3.08 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 0.00 110 T 7.76 5.00 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 1.14 0.00 0.00 111 I 8.87 4.36 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.90 0.95 0.00 0.00 112 Q 9.29 4.60 0.00 1.92 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.40 0.00 113 P 0.00 4.34 0.00 2.06 2.24 0.00 3.69 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 2.04 2.11 0.00 114 G 8.60 3.44 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 0.00 115 E 7.85 4.01 0.00 2.08 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 2.34 2.29 0.00 116 R 8.44 4.36 0.00 1.83 1.84 0.00 3.44 0.00 0.00 3.15 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 117 I 8.53 4.37 1.97 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 1.23 0.72 0.93 0.00 0.00 118 A 7.34 4.63 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 0.00 119 Q 9.09 5.08 0.00 1.93 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.72 0.00 0.00 0.00 0.00 0.00 2.43 2.25 0.00 120 M 9.04 5.27 0.00 1.92 1.73 0.00 0.00 0.00 0.00 0.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.87 0.00 121 I 8.59 4.91 1.91 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 1.11 0.98 0.00 0.00 122 F 8.89 5.25 0.00 2.98 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 0.00 123 V 8.84 4.65 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 0.83 0.00 0.00 0.94 0.00 0.00 124 P 0.00 4.92 0.00 1.95 2.00 0.00 3.64 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.14 0.00 125 V 8.42 4.62 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 0.74 0.00 0.00 0.95 0.00 0.00 126 V 8.31 4.36 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 0.90 0.00 0.00 0.92 0.00 0.00 127 Q 8.43 4.32 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.69 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 128 A 8.30 3.80 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 E 8.23 4.31 0.00 1.85 1.83 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 2.19 2.27 0.00 130 F 8.32 4.54 0.00 3.12 2.86 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 0.00 131 N 8.72 4.84 0.00 2.69 2.80 0.00 0.00 7.09 7.83 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 0.00 132 L 8.51 4.18 0.00 1.64 1.58 0.86 0.93 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 0.00 133 V 8.06 4.57 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 1.01 0.00 0.00 0.87 0.00 0.00 134 E 8.55 4.27 0.00 1.87 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 0.00 2.21 2.31 0.00 135 D 7.42 4.52 0.00 2.53 2.46 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 0.00 136 F 8.45 4.66 0.00 3.05 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