NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.2209 8.2549 120.8598 55.6586 31.5746 175.3592 3 L 3.9452 7.7193 117.0518 54.6736 41.9785 172.4549 4 N 4.3646 7.5632 116.5675 53.5680 38.1105 176.8602 5 T 3.7549 7.6470 112.9670 64.5121 69.9259 174.2837 6 L 4.2251 7.6366 122.8223 54.9906 40.7166 176.3164 7 S 4.7781 8.2171 119.2423 55.5098 65.5190 171.9473 8 P 4.3714 0.0000 0.0000 62.0158 31.6576 175.8402 9 A 4.2257 8.1896 122.8504 52.5242 18.9592 178.1346 10 E 4.3139 9.5164 120.2530 52.6265 27.8126 174.1370 11 G 3.4181 8.4255 112.5144 44.5904 0.0000 172.3288 12 S 4.2099 8.0944 117.5721 61.0288 62.9570 174.6217 13 K 4.5396 7.8816 118.2417 54.7781 33.3602 177.0712 14 K 4.5618 8.5413 125.5431 56.7729 34.2316 179.5430 15 A 3.5745 8.8899 125.3529 52.3724 18.0534 179.7930 16 G 4.1779 9.3289 104.5248 43.9742 0.0000 173.0767 17 K 4.0746 8.1211 122.5551 57.3117 32.7736 175.6484 18 R 4.3301 7.7019 115.5893 56.7048 32.8074 173.3465 19 L 3.8176 8.2038 122.6461 54.9072 41.8116 174.5061 20 G 4.0847 8.5599 107.8821 46.8493 0.0000 173.8612 21 R 4.5585 7.4870 110.6112 55.0965 31.4315 177.0476 22 G 4.1240 8.1852 101.4967 45.4737 0.0000 174.8145 23 I 3.5306 8.3204 119.8783 64.1567 37.5053 178.7955 24 G 3.8477 8.4135 108.5493 48.8045 0.0000 174.6463 25 S 4.0890 7.5151 112.2059 58.4242 62.7751 174.9868 26 G 3.9457 8.5004 108.9441 46.3829 0.0000 173.8581 27 L 4.9290 7.6156 117.9857 53.6100 43.1797 176.6348 28 G 4.1380 7.7001 116.0174 44.1490 0.0000 173.5966 29 K 3.8170 8.7874 124.5059 58.2144 33.0615 176.1528 30 T 3.3770 8.2251 107.2245 67.4153 67.4401 173.4104 31 G 4.0279 7.8081 110.2931 48.1957 0.0000 174.5973 32 G 4.0578 8.1749 119.9343 47.0129 0.0000 171.3563 33 R 4.4605 8.2521 109.7016 55.0188 30.7523 176.9015 34 G 3.8579 8.1582 108.5062 45.6375 0.0000 172.2651 35 H 4.5577 8.6570 115.5962 54.6444 29.8795 175.7050 36 K 3.5243 9.8545 124.8049 56.1613 31.4754 174.5674 37 G 4.1201 8.5657 105.0970 44.8163 0.0000 174.6647 38 Q 3.9427 8.9717 121.8759 58.9651 29.1322 178.9746 39 K 3.8715 8.1716 115.7704 58.7155 32.2227 176.5883 40 S 4.5452 8.0204 113.7633 57.2205 65.2384 171.7857 41 R 4.1198 8.2369 120.6836 55.3229 29.9511 176.6594 42 S 4.2998 8.5600 114.7724 59.6616 63.1756 175.2492 43 G 3.8942 8.8879 107.9181 45.9657 0.0000 174.2897 44 G 3.9532 7.2105 108.0490 45.4501 0.0000 173.6969 45 G 4.0454 8.1201 107.5034 45.0148 0.0000 174.6087 46 V 4.0920 8.0375 115.4592 59.8754 32.8086 176.7160 47 R 4.1792 8.1389 117.4686 55.9603 30.1250 175.4600 48 R 4.1856 8.4974 117.8641 57.1335 31.0579 176.7451 49 G 4.1583 8.5842 113.0505 47.0396 0.0000 174.7657 50 F 5.0636 7.8673 119.8262 55.7084 38.4796 172.9412 51 E 3.9703 8.3365 122.8480 56.6557 29.5390 180.1107 52 G 3.7676 8.7097 113.8331 45.7035 0.0000 171.8590 53 G 3.9676 8.5224 107.9896 45.3007 0.0000 174.0212 54 Q 4.1471 7.0992 116.3063 56.0107 28.6104 174.8258 55 M 4.1356 8.4020 118.6856 54.5963 32.6092 175.2369 56 P 4.6221 0.0000 0.0000 61.5912 32.4831 177.2803 57 L 3.9422 8.5491 121.6182 58.5844 42.0718 179.0042 58 Y 4.6271 7.8842 113.3814 57.3930 37.3513 175.7226 59 R 4.3188 7.9733 118.0946 58.5851 32.6558 178.2309 60 R 4.1892 8.0606 109.9921 56.5416 28.8601 176.1508 61 L 4.6982 8.1326 118.6002 52.5644 44.1755 175.0205 62 P 4.4024 0.0000 0.0000 62.4890 31.9406 175.5383 63 K 4.1564 8.3700 119.2430 55.0441 34.2561 176.9887 64 F 4.7438 6.9919 120.2543 54.7895 36.9112 177.1145 65 G 3.8052 7.7734 117.3545 46.3628 0.0000 167.5245 66 F 4.3794 9.3346 125.1396 58.5857 40.0560 175.0627 67 T 4.3589 7.4658 116.4811 59.9475 71.3740 174.2410 68 S 3.6751 8.0444 120.5425 61.2999 63.5742 175.8363 69 R 3.9306 8.0625 118.0921 55.8511 28.7333 175.4175 70 K 4.5701 7.8838 114.3807 57.7581 37.8000 178.0369 71 A 4.0138 7.6709 120.9924 54.7460 18.4219 179.3530 72 A 3.9890 7.9991 118.0984 54.6006 18.7525 178.0968 73 I 4.1693 8.3815 108.3581 61.0187 38.0529 174.6850 74 T 5.1230 7.7075 118.2305 62.6026 69.7153 174.2937 75 A 4.6533 9.0831 128.3585 50.4895 22.6049 175.2224 76 E 4.4071 8.4172 117.9779 54.7111 30.9350 175.2277 77 I 4.1184 8.6541 127.1069 61.0907 38.3867 175.7553 78 R 4.6702 9.5499 123.3606 54.1738 33.0785 176.6454 79 L 4.1772 8.1610 123.5189 58.1016 41.6514 179.0438 80 S 4.3795 8.1727 111.7682 60.5611 63.5309 175.4142 81 D 4.6235 8.0545 124.3045 54.8951 41.2806 175.5266 82 L 4.0257 8.9983 124.2642 56.9111 40.0161 176.4947 83 A 4.1307 7.9312 118.1554 53.7717 18.7526 177.8208 84 K 4.6043 7.8671 114.3912 56.4745 33.0690 177.0304 85 V 3.9064 8.0550 117.6902 61.8869 31.0938 175.0705 86 E 3.6233 8.6835 123.4981 57.2339 28.2878 175.6747 87 G 4.0978 8.1493 116.4075 45.6804 0.0000 172.9864 88 G 4.1056 8.4270 115.6244 44.7855 0.0000 173.9000 89 V 3.8997 7.4294 113.8801 62.1521 30.1698 173.7091 90 V 4.0055 7.5099 128.4093 61.4500 30.0229 174.3771 91 D 4.8762 8.4515 123.7466 52.9608 41.8027 175.4125 92 L 4.5474 8.9987 123.0605 57.4789 40.6796 177.8939 93 N 4.6474 8.3348 111.4953 51.7779 35.6530 174.8276 94 T 3.5486 8.7436 114.9246 64.4423 67.7985 173.3783 95 L 3.9460 7.7019 120.0985 58.0899 42.6371 180.2612 96 K 3.8301 8.2388 117.3164 59.5766 32.0221 178.3727 97 A 4.2582 8.0346 117.8745 52.9576 18.3975 177.4592 98 A 4.4995 7.8006 118.0008 50.8129 19.3479 176.5744 99 N 4.0167 7.5724 113.6462 53.8341 35.5982 173.2315 100 I 4.5127 7.0973 123.5377 60.7121 39.6160 173.6614 101 I 4.3323 8.0993 116.8091 59.4339 40.3334 173.0908 102 G 3.5213 8.2959 106.0903 44.3175 0.0000 173.5318 103 I 3.6716 8.2789 128.0302 64.6707 37.2794 177.2189 104 Q 4.1187 7.8939 117.3691 57.7825 29.0767 176.4483 105 I 4.0097 7.4933 118.4334 62.2351 37.7907 174.9378 106 E 4.5455 8.9766 118.6926 57.2265 34.8609 175.9318 107 F 5.3897 7.4487 116.4818 55.9870 42.1738 174.5238 108 A 5.0653 8.2367 120.9577 52.1781 22.5867 175.1185 109 K 4.8018 8.3564 117.8025 54.7345 35.5448 177.8840 110 V 3.4818 8.1990 121.8615 66.0083 31.5613 173.8932 111 I 3.1740 7.7712 126.8098 60.2775 36.9402 172.3078 112 L 4.5228 8.3740 124.4645 54.1372 42.8951 175.7930 113 A 4.4767 9.1778 128.0122 53.8585 20.9423 175.7269 114 G 3.5598 7.5596 102.6703 45.1441 0.0000 172.8831 115 E 4.7523 7.6739 119.3637 54.6591 33.0780 173.6070 116 V 4.0272 7.8502 124.8046 58.2352 36.2388 172.4179 117 T 3.4178 7.6272 119.3814 63.9294 67.8439 171.9523 118 T 4.0335 7.6720 116.8450 61.1864 68.5435 172.8348 119 P 5.1339 0.0000 0.0000 62.6691 31.9285 175.7898 120 V 4.5709 8.1671 125.4764 61.3460 35.8626 174.2840 121 T 4.9364 8.1448 114.2861 58.0398 69.1656 172.5338 122 V 4.1286 8.1917 122.3583 62.5574 32.8690 174.6978 123 R 4.4738 9.4611 125.6875 54.7683 33.2542 175.3445 124 G 4.1076 8.4813 113.0859 45.9492 0.0000 170.6333 125 L 4.8086 7.7563 114.7533 54.2324 46.4679 175.9358 126 R 4.8933 7.8401 117.8886 55.1131 34.0527 175.2142 127 V 4.5004 7.7995 116.8395 61.2793 33.8839 173.3203 128 T 4.2194 8.3082 112.7940 61.1637 69.5694 175.1496 129 K 4.3955 8.5467 120.5534 58.0946 32.9546 178.0408 130 G 3.8817 7.9325 106.6300 46.0165 0.0000 174.8621 131 A 4.4769 7.6548 121.2839 52.6933 19.1551 179.3783 132 R 3.7846 7.8155 117.5627 59.4152 30.2616 178.2596 133 A 4.1402 7.9553 119.2422 54.1433 18.3060 179.3675 134 A 3.8897 7.2613 117.8643 55.3441 18.8536 179.3779 135 I 3.7775 7.8545 117.1220 64.3783 37.9656 177.8761 136 E 4.2108 8.2568 119.2358 59.3486 28.9888 178.9134 137 A 3.9822 7.8879 120.2545 54.0555 19.8548 178.1198 138 A 4.4806 8.0306 120.2290 52.1515 18.7646 176.8716 139 G 4.0122 7.6647 112.0258 45.8396 0.0000 171.4204 140 G 4.2299 7.4920 103.7133 45.0054 0.0000 173.7901 141 K 4.7760 8.6500 121.6581 54.4369 35.9009 174.8124 142 I 4.2527 8.2976 127.5078 60.0379 38.4826 174.3190 143 E 3.8968 8.7662 126.7656 53.4828 29.0503 176.7336 144 E 4.0482 8.2417 125.8245 55.7978 30.5860 174.2381 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 R 8.25 4.22 0.00 1.79 1.99 0.00 3.21 0.00 0.00 3.22 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.66 0.00 3 L 7.72 3.95 0.00 1.75 1.64 nan 0.78 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 4 N 7.56 4.36 0.00 2.95 2.78 0.00 0.00 6.57 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 T 7.65 3.75 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 1.30 0.00 0.00 6 L 7.64 4.23 0.00 1.80 1.74 0.92 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 7 S 8.22 4.78 0.00 3.85 3.80 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 8 P 0.00 4.37 0.00 2.04 2.00 0.00 3.68 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 2.02 2.08 0.00 9 A 8.19 4.23 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 10 E 9.52 4.31 0.00 1.91 1.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.22 2.35 0.00 11 G 8.43 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 0.00 0.00 0.00 12 S 8.09 4.21 0.00 3.87 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 13 K 7.88 4.54 0.00 1.72 1.73 0.00 1.73 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.35 1.37 7.81 14 K 8.54 4.56 0.00 1.72 1.79 0.00 1.91 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.35 7.81 15 A 8.89 3.57 1.11 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 16 G 9.33 4.18 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 0.00 17 K 8.12 4.07 0.00 1.87 1.86 0.00 1.52 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.48 7.81 18 R 7.70 4.33 0.00 1.76 1.90 0.00 3.34 0.00 0.00 3.22 7.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.62 0.00 19 L 8.20 3.82 0.00 1.78 1.68 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 20 G 8.56 4.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 R 7.49 4.56 0.00 1.74 1.85 0.00 3.38 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.55 0.00 22 G 8.19 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 0.00 0.00 0.00 0.00 23 I 8.32 3.53 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 1.35 0.50 0.91 0.00 0.00 24 G 8.41 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 25 S 7.52 4.09 0.00 3.99 4.01 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 26 G 8.50 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 27 L 7.62 4.93 0.00 1.70 1.57 0.92 0.62 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 28 G 7.70 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 29 K 8.79 3.82 0.00 1.85 1.86 0.00 1.72 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.42 1.46 7.81 30 T 8.23 3.38 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 1.09 0.00 0.00 31 G 7.81 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.17 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 0.00 0.00 0.00 0.00 33 R 8.25 4.46 0.00 1.82 1.94 0.00 3.16 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.53 0.00 34 G 8.16 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 H 8.66 4.56 0.00 3.10 3.26 0.00 6.05 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 9.85 3.52 0.00 1.89 1.81 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.37 1.44 7.81 37 G 8.57 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 0.00 0.00 0.00 0.00 38 Q 8.97 3.94 0.00 2.12 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.77 0.00 0.00 0.00 0.00 0.00 2.46 2.42 0.00 39 K 8.17 3.87 0.00 1.79 1.90 0.00 1.82 0.00 0.00 1.78 0.00 0.00 3.05 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.47 1.41 7.81 40 S 8.02 4.55 0.00 3.98 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 R 8.24 4.12 0.00 2.08 2.02 0.00 3.15 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.55 0.00 42 S 8.56 4.30 0.00 3.97 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 43 G 8.89 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 44 G 7.21 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 45 G 8.12 4.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 V 8.04 4.09 2.41 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 0.91 0.00 0.00 1.03 0.00 0.00 47 R 8.14 4.18 0.00 1.86 1.87 0.00 3.04 0.00 0.00 3.09 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.68 0.00 48 R 8.50 4.19 0.00 1.78 1.83 0.00 3.37 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 49 G 8.58 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 50 F 7.87 5.06 0.00 2.92 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 51 E 8.34 3.97 0.00 2.04 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.32 0.00 52 G 8.71 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 53 G 8.52 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 54 Q 7.10 4.15 0.00 2.24 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.85 0.00 0.00 0.00 0.00 0.00 2.29 2.33 0.00 55 M 8.40 4.14 0.00 1.93 1.99 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 56 P 0.00 4.62 0.00 1.20 2.01 0.00 3.71 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.12 0.00 57 L 8.55 3.94 0.00 1.75 1.74 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 58 Y 7.88 4.63 0.00 3.09 3.04 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 59 R 7.97 4.32 0.00 1.73 1.71 0.00 3.17 0.00 0.00 3.07 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.52 1.26 0.00 60 R 8.06 4.19 0.00 1.93 1.98 0.00 3.13 0.00 0.00 3.38 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.73 0.00 61 L 8.13 4.70 0.00 1.66 1.61 0.97 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.40 0.00 2.10 2.03 0.00 3.67 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 2.07 2.10 0.00 63 K 8.37 4.16 0.00 1.66 1.64 0.00 1.52 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.25 1.35 7.81 64 F 6.99 4.74 0.00 3.17 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 65 G 7.77 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 0.00 0.00 0.00 66 F 9.33 4.38 0.00 3.10 3.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 7.47 4.36 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 1.17 0.00 0.00 68 S 8.04 3.68 0.00 4.05 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 69 R 8.06 3.93 0.00 2.09 2.01 0.00 3.39 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 70 K 7.88 4.57 0.00 1.86 1.73 0.00 1.85 0.00 0.00 1.75 0.00 0.00 3.14 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.51 1.53 7.81 71 A 7.67 4.01 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 A 8.00 3.99 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 73 I 8.38 4.17 1.67 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.85 0.82 0.00 0.00 74 T 7.71 5.12 4.39 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 1.31 0.00 0.00 75 A 9.08 4.65 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 76 E 8.42 4.41 0.00 1.93 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 2.18 2.33 0.00 77 I 8.65 4.12 2.15 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 1.23 0.66 1.02 0.00 0.00 78 R 9.55 4.67 0.00 1.78 1.77 0.00 3.15 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.68 0.00 79 L 8.16 4.18 0.00 1.86 2.05 1.00 0.85 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 80 S 8.17 4.38 0.00 3.97 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 81 D 8.05 4.62 0.00 2.69 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 82 L 9.00 4.03 0.00 1.88 1.82 0.98 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.93 4.13 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 84 K 7.87 4.60 0.00 1.90 1.97 0.00 1.50 0.00 0.00 1.87 0.00 0.00 3.14 0.00 0.00 3.23 0.00 0.00 0.00 0.00 1.37 1.38 7.81 85 V 8.05 3.91 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.93 0.00 0.00 86 E 8.68 3.62 0.00 2.12 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 2.22 2.28 0.00 87 G 8.15 4.10 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 88 G 8.43 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 89 V 7.43 3.90 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 0.78 0.00 0.00 0.93 0.00 0.00 90 V 7.51 4.01 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 0.94 0.00 0.00 0.93 0.00 0.00 91 D 8.45 4.88 0.00 2.73 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 92 L 9.00 4.55 0.00 1.72 2.10 0.94 0.90 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 93 N 8.33 4.65 0.00 2.84 2.12 0.00 0.00 6.05 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 94 T 8.74 3.55 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 1.21 0.00 0.00 95 L 7.70 3.95 0.00 1.75 1.75 1.02 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 96 K 8.24 3.83 0.00 1.81 1.84 0.00 1.64 0.00 0.00 1.81 0.00 0.00 2.91 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.52 1.43 7.81 97 A 8.03 4.26 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 98 A 7.80 4.50 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 99 N 7.57 4.02 0.00 2.86 2.84 0.00 0.00 6.70 6.75 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 0.00 100 I 7.10 4.51 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 1.41 0.51 0.96 0.00 0.00 101 I 8.10 4.33 1.86 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 1.35 1.06 0.90 0.00 0.00 102 G 8.30 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.28 3.67 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 1.40 0.43 0.89 0.00 0.00 104 Q 7.89 4.12 0.00 2.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.96 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 105 I 7.49 4.01 1.87 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 1.43 0.73 0.96 0.00 0.00 106 E 8.98 4.55 0.00 1.16 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 0.00 0.00 0.00 2.05 2.20 0.00 107 F 7.45 5.39 0.00 2.96 2.79 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 0.00 108 A 8.24 5.07 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 0.00 109 K 8.36 4.80 0.00 1.67 1.69 0.00 1.69 0.00 0.00 1.75 0.00 0.00 2.83 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.35 7.81 110 V 8.20 3.48 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 0.74 0.00 0.00 1.03 0.00 0.00 111 I 7.77 3.17 2.13 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 1.46 0.85 0.91 0.00 0.00 112 L 8.37 4.52 0.00 1.60 1.56 0.92 0.96 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 0.00 113 A 9.18 4.48 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 0.00 114 G 7.56 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 0.00 115 E 7.67 4.75 0.00 2.20 1.78 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 2.28 2.33 0.00 116 V 7.85 4.03 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 0.64 0.00 0.00 0.93 0.00 0.00 117 T 7.63 3.42 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 1.21 0.00 0.00 118 T 7.67 4.03 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 1.28 0.00 0.00 119 P 0.00 5.13 0.00 1.97 2.13 0.00 3.72 0.00 0.00 4.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.96 0.00 120 V 8.17 4.57 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 1.00 0.00 0.00 0.97 0.00 0.00 121 T 8.14 4.94 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 1.21 0.00 0.00 122 V 8.19 4.13 2.33 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 0.84 0.00 0.00 1.12 0.00 0.00 123 R 9.46 4.47 0.00 1.74 1.72 0.00 3.41 0.00 0.00 3.18 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 124 G 8.48 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 0.00 125 L 7.76 4.81 0.00 1.85 1.59 1.04 0.67 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 0.00 126 R 7.84 4.89 0.00 1.94 1.81 0.00 3.10 0.00 0.00 3.19 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.51 0.00 127 V 7.80 4.50 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 0.93 0.00 0.00 128 T 8.31 4.22 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 1.21 0.00 0.00 129 K 8.55 4.40 0.00 1.93 1.96 0.00 1.55 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.40 1.50 7.81 130 G 7.93 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 A 7.65 4.48 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 0.00 132 R 7.82 3.78 0.00 2.07 1.93 0.00 3.09 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.64 0.00 133 A 7.96 4.14 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 0.00 134 A 7.26 3.89 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 0.00 135 I 7.85 3.78 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 1.33 0.99 0.00 0.00 136 E 8.26 4.21 0.00 2.12 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 2.51 2.55 0.00 137 A 7.89 3.98 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 0.00 138 A 8.03 4.48 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 0.00 139 G 7.66 4.01 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 0.00 0.00 0.00 140 G 7.49 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 0.00 141 K 8.65 4.78 0.00 1.79 1.60 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.54 7.81 142 I 8.30 4.25 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 1.40 0.62 0.93 0.00 0.00 143 E 8.77 3.90 0.00 2.01 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 2.31 2.57 0.00 144 E 8.24 4.05 0.00 2.10 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 2.17 2.34 0.00