NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3230 8.2644 123.5847 52.3008 18.7232 175.9200 3 R 4.0228 8.2877 121.9050 58.1194 32.3941 175.8629 4 R 4.2363 8.9331 115.5937 56.6165 29.3567 179.1095 5 R 4.1594 8.9490 124.2161 56.6127 31.0976 178.0963 6 R 4.0224 8.5159 119.4547 56.1508 29.2985 177.6000 7 A 3.6702 8.5458 121.5089 52.1641 18.3152 176.8412 8 E 4.5267 8.1498 114.2746 55.1010 33.3365 175.5592 9 V 3.6495 8.3797 123.5574 62.3890 31.1083 175.3077 10 R 3.8868 8.4391 127.4499 56.8024 30.3949 175.5106 11 Q 4.4233 8.3650 123.7306 55.0622 30.3386 174.6311 12 L 4.6657 8.1925 122.2829 52.8499 43.8994 175.8590 13 Q 4.3171 8.6760 124.4740 54.6465 29.5652 173.0197 14 P 4.3023 0.0000 0.0000 60.8157 33.2001 175.0090 15 D 4.6439 8.4881 119.7013 54.6276 41.7088 176.5504 16 L 4.6582 8.4034 119.4565 54.5570 43.4846 177.5115 17 V 4.0151 8.0913 116.4907 64.4947 32.4511 176.1810 18 Y 4.2321 8.6865 114.3053 57.0946 38.5932 175.6660 19 G 4.3433 8.0583 107.6464 46.4996 0.0000 172.9852 20 D 5.0002 7.7569 116.9004 51.8528 44.1573 176.6452 21 V 3.6657 8.5520 120.0108 64.5943 31.7609 178.4452 22 L 4.1164 8.3558 120.0290 58.0640 41.9421 179.2797 23 V 3.6034 7.8568 118.2822 66.0964 31.5791 177.9761 24 T 3.9676 7.9787 108.9772 64.6701 68.5986 176.1779 25 A 4.0601 7.9654 123.3484 55.0763 18.1781 179.3536 26 F 4.4673 8.1083 117.6609 61.0687 39.6962 177.4735 27 I 3.6179 7.6341 119.3915 64.3042 36.8068 177.7662 28 N 4.2412 8.6673 117.6306 56.4222 38.1972 176.7907 29 K 4.3223 7.4025 114.8346 57.4301 32.1576 178.0106 30 I 4.3039 7.7448 120.7696 61.4807 38.5425 174.0485 31 M 3.8137 7.1058 118.1364 56.1923 31.7729 176.0206 32 R 4.3381 7.8654 128.4829 52.5910 27.5059 175.1442 33 D 4.8843 8.7461 122.9333 54.3403 39.4606 177.1549 34 G 3.7665 8.3409 104.3801 46.4045 0.0000 176.0419 35 K 4.3285 7.1004 119.2413 54.4194 30.8690 177.4224 36 K 3.8384 7.7843 123.5147 59.5102 32.7878 177.5660 37 N 4.5014 8.1084 113.9822 54.6340 38.6703 174.9199 38 L 4.4691 7.8975 118.3234 56.8938 43.3178 177.8699 39 A 3.9662 7.7091 120.2433 54.6720 18.6368 178.9899 40 A 3.6517 8.2823 119.7927 56.1675 17.6357 179.1579 41 R 3.9553 8.2901 115.9220 58.1739 29.7255 179.1640 42 I 4.0158 7.5199 122.0944 64.8806 37.7643 177.5203 43 F 4.3517 8.1704 121.5149 61.6702 39.1274 176.8144 44 Y 4.3811 7.7700 115.4023 61.3972 37.7135 177.8519 45 D 4.5169 9.4154 117.5694 57.2864 41.4014 177.8670 46 A 4.4491 7.9159 120.2446 54.1888 19.4562 178.9107 47 C 4.4620 8.6820 115.5475 62.9582 28.4241 175.7547 48 K 4.4439 8.1922 115.7917 56.9513 31.5499 177.2380 49 I 4.5750 8.3265 120.4422 61.1184 39.2988 177.7325 50 I 4.0926 8.2030 121.1328 63.7787 37.5826 177.5453 51 Q 4.2879 8.1954 118.1666 58.7084 28.9769 176.6554 52 E 3.9405 8.1041 118.0162 58.4367 29.2208 178.5722 53 K 4.2296 6.2637 113.9067 55.2305 32.4681 176.8102 54 T 4.5125 8.5196 121.1254 61.7568 70.6644 172.9956 55 G 3.7724 8.6492 117.5839 47.6581 0.0000 173.5770 56 Q 3.9840 7.4046 118.7408 56.1808 29.5320 176.7914 57 E 4.4552 8.4715 117.8886 55.3949 29.7292 176.5680 58 P 3.7009 0.0000 0.0000 62.7799 33.4104 177.6846 59 L 4.0396 8.5133 118.7414 58.8705 42.2348 179.4844 60 K 3.9642 8.0558 118.6779 59.6998 31.8241 178.7623 61 V 3.6431 7.6314 117.2751 66.1535 31.6310 177.4010 62 F 4.0625 8.1882 120.1398 60.9387 38.9187 176.6531 63 K 3.7732 8.6949 119.4181 59.6515 31.8863 178.5547 64 Q 4.1894 8.1940 119.4582 58.5512 28.7866 177.4881 65 A 4.1420 7.7921 121.0472 54.3348 18.6354 179.3587 66 V 3.5105 7.3136 116.8919 65.8293 31.3373 177.6509 67 E 3.9902 7.6345 119.5627 59.0451 29.2819 177.9470 68 N 4.3744 7.6499 113.1586 54.5792 38.7116 175.6463 69 V 4.2654 6.9575 118.4305 63.0596 33.7661 175.0517 70 K 3.7590 8.3021 119.5840 55.8687 31.8144 174.6808 71 P 4.5260 0.0000 0.0000 62.2125 32.0242 176.0695 72 R 4.0779 8.9613 124.5503 59.5778 30.1737 175.7806 73 M 5.0429 7.7871 114.0897 54.2132 36.7329 173.9133 74 E 4.8511 8.7426 119.3625 54.7029 34.0242 174.7814 75 V 5.2577 8.2607 112.2719 59.2302 33.1588 175.9627 76 R 4.3463 8.5759 125.6213 54.9944 30.8783 176.9450 77 S 4.3450 8.5568 119.3477 59.5011 62.9901 172.7117 78 R 4.0095 7.3811 116.4931 55.8458 34.1269 173.0825 79 R 4.8519 8.3533 123.7414 53.9014 31.1316 175.4769 80 V 3.8620 8.1421 125.5763 61.9627 33.4366 175.7624 81 G 3.8452 7.8307 106.8775 49.7426 0.0000 172.7227 82 G 3.9378 8.6416 113.1442 44.7692 0.0000 172.0390 83 A 4.1658 6.9170 120.3480 52.1334 21.4417 175.4390 84 N 5.5043 7.3833 116.7572 50.8638 38.1988 173.8397 85 Y 4.2133 6.6591 116.5951 58.5111 39.3668 177.4428 86 Q 4.5184 8.0479 124.2116 54.1287 27.6852 175.5384 87 V 3.7760 7.5704 120.6847 62.2642 32.7186 173.2947 88 P 5.2514 0.0000 0.0000 61.1947 33.3072 173.6615 89 M 4.2299 8.0955 115.4403 54.5406 33.8778 174.1879 90 E 4.0832 8.8093 118.8622 56.9023 30.4153 176.7334 91 V 4.2907 7.6394 121.7415 61.0556 32.3982 175.6836 92 S 4.2882 8.6892 123.1733 57.8101 63.2990 172.7910 93 P 4.3863 0.0000 0.0000 66.3379 30.8512 178.5812 94 R 3.8511 8.0169 117.6971 59.0293 30.0042 178.4871 95 R 3.7471 7.9901 117.4573 59.3791 30.0666 177.8290 96 Q 3.7420 9.2872 119.6231 59.4831 29.0618 179.2327 97 Q 3.8510 8.4327 120.5629 59.1352 29.0355 178.2394 98 S 4.0092 7.8464 116.0862 61.5983 62.9381 176.5311 99 L 3.3214 8.0867 121.4353 58.3130 41.2330 178.6551 100 A 3.6952 7.7371 118.8084 55.4997 17.9001 179.2152 101 L 3.9089 8.5596 115.2294 57.8040 42.2537 179.8154 102 R 3.8807 8.0376 118.0441 59.3829 29.9851 178.0342 103 W 4.6556 8.4266 118.7939 60.4160 29.1296 178.0081 104 L 3.9548 8.0841 118.0876 58.3357 41.0744 179.5818 105 V 3.6728 7.9247 117.3398 66.5128 31.4989 177.9290 106 Q 3.9845 8.1399 116.9366 59.1247 28.4438 178.7685 107 A 3.9909 8.3831 120.2365 55.4473 18.4309 179.1729 108 A 4.0988 7.9673 117.2919 55.6261 18.6787 179.4394 109 N 4.3483 8.3691 113.5835 55.3298 39.9105 176.4983 110 Q 4.5883 7.6852 121.1510 53.5004 26.0748 174.5135 111 R 4.7564 6.6880 117.9233 53.9740 34.9124 174.3518 112 P 4.4129 0.0000 0.0000 64.2972 31.9329 176.6625 113 E 3.9605 8.2076 118.8756 57.0930 29.6453 177.4004 114 R 3.9659 8.7319 122.9694 58.2617 30.6672 176.5892 115 R 4.3810 7.5688 117.0109 54.8036 30.3284 177.1616 116 A 3.8418 7.9780 125.8821 54.3520 19.1178 178.8074 117 A 3.9604 7.9736 119.3077 55.5395 18.5647 180.1088 118 V 3.5621 7.8998 110.9242 64.3943 31.4107 179.0410 119 R 3.8814 7.8755 117.3308 59.4648 30.0188 178.7307 120 I 3.7519 7.6821 118.8373 65.0962 37.0219 177.6666 121 A 4.1188 8.1466 121.6670 54.8966 18.1426 178.8933 122 H 4.0701 8.9229 113.3825 58.9483 29.0651 177.7445 123 E 3.9145 8.5782 120.9396 59.4633 29.6469 178.7247 124 L 4.0831 8.3091 119.3696 58.7195 41.5033 178.8137 125 M 4.1851 8.6125 119.3996 57.1810 31.7463 178.0639 126 D 4.4060 8.6168 118.4426 57.9685 41.1151 179.2034 127 A 4.1771 8.2616 119.7186 55.2110 18.4559 178.8782 128 A 4.0270 7.9557 118.2049 55.2815 18.5309 179.1637 129 E 4.0419 8.8018 117.6744 60.4959 29.9301 176.8015 130 G 3.4269 7.7198 111.4466 44.9580 0.0000 173.7703 131 K 4.4847 7.6543 121.4828 56.0343 32.5739 176.4672 132 G 4.2211 7.4848 105.6518 44.0409 0.0000 173.5407 133 G 3.6649 8.5657 107.6579 47.3677 0.0000 175.9569 134 A 4.0989 7.8588 121.9340 54.2231 18.5385 179.4159 135 V 3.7507 7.5064 116.7668 65.4718 31.8715 177.3737 136 K 3.7961 8.2458 119.6388 59.7903 31.8627 178.1218 137 K 3.4781 7.4609 117.4333 59.5325 31.5961 178.8808 138 K 3.6864 7.1678 119.4228 60.0228 31.9538 178.2568 139 E 4.0122 8.0762 118.4025 59.1191 29.2436 179.0815 140 D 4.2514 7.6846 118.6393 57.3722 40.8774 178.7581 141 V 3.6419 7.7839 117.3846 65.2944 31.5905 177.4335 142 E 4.1107 7.7795 118.9993 59.4285 29.1666 178.4636 143 R 3.9062 7.9962 118.1612 59.7309 30.2428 178.9163 144 M 4.0862 7.9519 117.8279 57.7363 32.2479 176.6119 145 A 4.4054 7.8592 121.0887 52.3205 19.8740 176.7355 146 E 4.0700 9.0315 123.2830 57.7510 28.1418 177.0469 147 A 3.8973 7.4160 118.3071 54.8773 18.6318 178.1020 148 N 5.0596 7.8084 109.8755 53.1305 39.0354 176.4544 149 R 3.9864 8.6140 120.5151 58.2950 30.4058 178.4521 150 A 3.7827 8.0228 119.6324 56.2524 18.5106 178.0777 151 Y 3.8453 8.2243 112.0029 57.8540 38.2220 177.6347 152 A 4.0343 7.7355 127.1144 55.7460 18.4185 180.0797 153 H 4.5813 8.2214 107.4042 57.2844 28.6671 175.1071 154 Y 4.9978 8.1494 118.2642 58.3452 37.8469 177.4649 155 R 3.9529 8.2000 118.6880 57.7292 30.7290 176.7688 156 W 4.2439 8.6264 121.2412 56.8683 30.2344 174.4273 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 A 8.26 4.32 1.35 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 3 R 8.29 4.02 0.00 1.88 1.97 0.00 3.23 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 4 R 8.93 4.24 0.00 1.84 1.39 0.00 3.26 0.00 0.00 3.22 7.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 5 R 8.95 4.16 0.00 1.91 1.84 0.00 3.18 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 6 R 8.52 4.02 0.00 1.75 1.91 0.00 3.37 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 1.60 1.61 0.00 7 A 8.55 3.67 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.15 4.53 0.00 1.92 1.81 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 2.21 2.29 0.00 9 V 8.38 3.65 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 0.75 0.00 0.00 0.93 0.00 0.00 10 R 8.44 3.89 0.00 1.80 1.86 0.00 3.28 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 11 Q 8.36 4.42 0.00 2.03 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.47 0.00 0.00 0.00 0.00 0.00 2.31 2.44 0.00 12 L 8.19 4.67 0.00 1.67 1.57 0.95 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 13 Q 8.68 4.32 0.00 2.02 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.78 0.00 0.00 0.00 0.00 0.00 2.31 2.38 0.00 14 P 0.00 4.30 0.00 2.11 2.00 0.00 3.75 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 2.05 2.15 0.00 15 D 8.49 4.64 0.00 2.97 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 16 L 8.40 4.66 0.00 1.70 1.68 0.95 0.85 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 17 V 8.09 4.02 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 0.41 0.00 0.00 0.73 0.00 0.00 18 Y 8.69 4.23 0.00 2.93 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 19 G 8.06 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 0.00 0.00 0.00 0.00 20 D 7.76 5.00 0.00 2.73 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 21 V 8.55 3.67 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 0.98 0.00 0.00 0.98 0.00 0.00 22 L 8.36 4.12 0.00 1.88 2.02 1.05 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 23 V 7.86 3.60 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 0.96 0.00 0.00 0.61 0.00 0.00 24 T 7.98 3.97 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 1.32 0.00 0.00 25 A 7.97 4.06 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.11 4.47 0.00 3.30 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 I 7.63 3.62 2.04 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.20 0.84 0.00 0.00 28 N 8.67 4.24 0.00 2.83 2.86 0.00 0.00 7.09 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 29 K 7.40 4.32 0.00 1.79 1.79 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.63 7.81 30 I 7.74 4.30 1.73 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.25 0.74 0.00 0.00 31 M 7.11 3.81 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 32 R 7.87 4.34 0.00 1.89 1.80 0.00 3.24 0.00 0.00 3.21 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.60 0.00 33 D 8.75 4.88 0.00 2.79 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 34 G 8.34 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 35 K 7.10 4.33 0.00 1.78 1.75 0.00 1.67 0.00 0.00 1.56 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.39 1.39 7.81 36 K 7.78 3.84 0.00 1.76 1.79 0.00 1.71 0.00 0.00 1.73 0.00 0.00 2.83 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.41 7.81 37 N 8.11 4.50 0.00 2.70 2.81 0.00 0.00 6.76 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 38 L 7.90 4.47 0.00 1.77 1.81 0.91 0.87 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 39 A 7.71 3.97 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 40 A 8.28 3.65 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 41 R 8.29 3.96 0.00 2.07 1.88 0.00 3.17 0.00 0.00 3.35 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.90 0.00 42 I 7.52 4.02 1.84 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 1.40 0.69 0.93 0.00 0.00 43 F 8.17 4.35 0.00 2.95 2.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 Y 7.77 4.38 0.00 3.12 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 45 D 9.42 4.52 0.00 2.74 2.87 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 46 A 7.92 4.45 1.56 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 47 C 8.68 4.46 0.00 3.29 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 48 K 8.19 4.44 0.00 1.98 1.88 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.48 1.52 7.81 49 I 8.33 4.57 2.12 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.31 0.99 0.00 0.00 50 I 8.20 4.09 2.08 0.00 0.00 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 1.57 0.91 1.05 0.00 0.00 51 Q 8.20 4.29 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.11 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 52 E 8.10 3.94 0.00 2.16 1.76 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 2.40 2.32 0.00 53 K 6.26 4.23 0.00 2.11 1.86 0.00 1.99 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.52 1.43 7.81 54 T 8.52 4.51 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 1.32 0.00 0.00 55 G 8.65 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 56 Q 7.40 3.98 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.73 0.00 0.00 0.00 0.00 0.00 2.44 2.52 0.00 57 E 8.47 4.46 0.00 2.16 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 0.00 2.30 2.35 0.00 58 P 0.00 3.70 0.00 2.51 2.26 0.00 3.71 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.25 0.00 59 L 8.51 4.04 0.00 2.17 1.91 1.15 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 60 K 8.06 3.96 0.00 2.09 1.87 0.00 1.63 0.00 0.00 1.61 0.00 0.00 3.07 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.48 1.55 7.81 61 V 7.63 3.64 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 1.06 0.00 0.00 62 F 8.19 4.06 0.00 3.16 3.22 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 63 K 8.69 3.77 0.00 2.07 1.89 0.00 1.60 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.54 7.81 64 Q 8.19 4.19 0.00 2.30 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.59 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 65 A 7.79 4.14 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 66 V 7.31 3.51 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 0.98 0.00 0.00 0.43 0.00 0.00 67 E 7.63 3.99 0.00 2.25 1.90 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 2.30 2.38 0.00 68 N 7.65 4.37 0.00 2.90 2.85 0.00 0.00 6.74 7.56 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 69 V 6.96 4.27 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 1.14 0.00 0.00 1.06 0.00 0.00 70 K 8.30 3.76 0.00 1.76 2.09 0.00 1.74 0.00 0.00 1.88 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.43 1.55 7.81 71 P 0.00 4.53 0.00 2.43 2.67 0.00 3.86 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.91 0.00 72 R 8.96 4.08 0.00 1.94 2.29 0.00 3.28 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.76 0.00 73 M 7.79 5.04 0.00 1.91 1.94 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 2.58 2.66 0.00 74 E 8.74 4.85 0.00 2.11 2.17 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 2.24 2.33 0.00 75 V 8.26 5.26 2.30 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 0.68 0.00 0.00 0.96 0.00 0.00 76 R 8.58 4.35 0.00 1.93 2.02 0.00 3.38 0.00 0.00 3.43 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.77 0.00 77 S 8.56 4.35 0.00 3.82 3.73 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 78 R 7.38 4.01 0.00 1.55 1.57 0.00 2.80 0.00 0.00 2.67 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 1.29 0.00 79 R 8.35 4.85 0.00 1.67 1.64 0.00 3.12 0.00 0.00 2.69 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.26 0.00 80 V 8.14 3.86 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 0.77 0.00 0.00 0.81 0.00 0.00 81 G 7.83 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.64 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 83 A 6.92 4.17 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 84 N 7.38 5.50 0.00 2.62 2.68 0.00 0.00 7.58 7.48 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 85 Y 6.66 4.21 0.00 3.04 2.44 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 86 Q 8.05 4.52 0.00 2.14 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.95 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 87 V 7.57 3.78 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 1.25 0.00 0.00 1.19 0.00 0.00 88 P 0.00 5.25 0.00 2.26 2.07 0.00 4.00 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 1.97 2.12 0.00 89 M 8.10 4.23 0.00 2.31 2.24 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 90 E 8.81 4.08 0.00 1.89 1.95 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 2.34 2.34 0.00 91 V 7.64 4.29 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 1.03 0.00 0.00 92 S 8.69 4.29 0.00 3.93 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 93 P 0.00 4.39 0.00 2.29 2.30 0.00 3.76 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.06 0.00 94 R 8.02 3.85 0.00 1.85 2.02 0.00 3.12 0.00 0.00 3.25 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.69 0.00 95 R 7.99 3.75 0.00 1.84 2.05 0.00 3.22 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 1.62 1.62 0.00 96 Q 9.29 3.74 0.00 2.23 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.58 0.00 0.00 0.00 0.00 0.00 2.33 2.38 0.00 97 Q 8.43 3.85 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.38 0.00 98 S 7.85 4.01 0.00 3.98 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 8.09 3.32 0.00 0.76 0.13 0.72 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.74 3.70 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 0.00 101 L 8.56 3.91 0.00 1.82 1.91 0.99 0.94 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 0.00 102 R 8.04 3.88 0.00 1.90 1.91 0.00 3.14 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 103 W 8.43 4.66 0.00 3.56 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 0.00 104 L 8.08 3.95 0.00 2.05 1.85 0.87 0.97 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 0.00 105 V 7.92 3.67 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 1.01 0.00 0.00 106 Q 8.14 3.98 0.00 2.44 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.44 0.00 0.00 0.00 0.00 0.00 2.44 2.57 0.00 107 A 8.38 3.99 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 0.00 108 A 7.97 4.10 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 0.00 109 N 8.37 4.35 0.00 2.83 2.92 0.00 0.00 7.08 7.24 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 0.00 110 Q 7.69 4.59 0.00 2.20 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.69 0.00 0.00 0.00 0.00 0.00 2.32 2.55 0.00 111 R 6.69 4.76 0.00 2.05 1.90 0.00 3.35 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.62 0.00 112 P 0.00 4.41 0.00 2.19 2.18 0.00 3.81 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 2.00 1.99 0.00 113 E 8.21 3.96 0.00 1.97 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 2.34 2.30 0.00 114 R 8.73 3.97 0.00 1.80 1.99 0.00 3.34 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.60 0.00 115 R 7.57 4.38 0.00 1.85 1.88 0.00 3.17 0.00 0.00 3.35 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 116 A 7.98 3.84 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 0.00 117 A 7.97 3.96 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 0.00 118 V 7.90 3.56 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.98 0.00 0.00 119 R 7.88 3.88 0.00 1.97 1.99 0.00 3.15 0.00 0.00 3.62 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 120 I 7.68 3.75 2.05 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 1.82 0.93 1.15 0.00 0.00 121 A 8.15 4.12 1.43 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 0.00 122 H 8.92 4.07 0.00 3.18 3.39 0.00 5.64 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.58 3.91 0.00 2.21 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 124 L 8.31 4.08 0.00 2.03 1.73 0.83 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 125 M 8.61 4.19 0.00 2.06 2.25 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.62 0.00 126 D 8.62 4.41 0.00 2.85 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 0.00 127 A 8.26 4.18 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 A 7.96 4.03 1.40 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 0.00 0.00 129 E 8.80 4.04 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.33 0.00 130 G 7.72 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 0.00 131 K 7.65 4.48 0.00 1.84 1.85 0.00 1.55 0.00 0.00 1.70 0.00 0.00 3.04 0.00 0.00 3.44 0.00 0.00 0.00 0.00 1.45 1.39 7.81 132 G 7.48 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 0.00 0.00 0.00 0.00 133 G 8.57 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 0.00 134 A 7.86 4.10 1.40 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 0.00 0.00 135 V 7.51 3.75 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.98 0.00 0.00 136 K 8.25 3.80 0.00 1.85 1.76 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.40 1.61 7.81 137 K 7.46 3.48 0.00 0.99 0.84 0.00 1.52 0.00 0.00 0.93 0.00 0.00 2.41 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.17 1.14 7.81 138 K 7.17 3.69 0.00 2.00 2.06 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.13 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.64 1.78 7.81 139 E 8.08 4.01 0.00 2.19 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 2.30 2.31 0.00 140 D 7.68 4.25 0.00 2.74 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 0.00 141 V 7.78 3.64 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 0.97 0.00 0.00 0.84 0.00 0.00 142 E 7.78 4.11 0.00 2.32 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 2.31 2.41 0.00 143 R 8.00 3.91 0.00 2.03 1.98 0.00 3.17 0.00 0.00 3.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.83 0.00 144 M 7.95 4.09 0.00 2.01 2.14 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.84 0.00 145 A 7.86 4.41 1.28 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 0.00 0.00 146 E 9.03 4.07 0.00 2.19 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 0.00 2.30 2.24 0.00 147 A 7.42 3.90 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 0.00 148 N 7.81 5.06 0.00 2.99 2.90 0.00 0.00 6.60 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 149 R 8.61 3.99 0.00 1.80 1.98 0.00 3.54 0.00 0.00 3.17 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 150 A 8.02 3.78 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.22 3.85 0.00 2.95 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 0.00 152 A 7.74 4.03 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 H 8.22 4.58 0.00 3.36 3.42 0.00 5.50 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 154 Y 8.15 5.00 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 0.00 155 R 8.20 3.95 0.00 1.92 2.09 0.00 3.28 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.97 0.00 156 W 8.63 4.24 0.00 3.61 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