NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 15 Y 4.7241 8.1293 118.4163 57.8425 39.2058 174.8876 16 S 4.3282 8.2359 119.9280 56.3361 64.2131 172.0739 17 N 4.8674 8.9142 117.3725 53.0147 38.7739 176.2260 18 A 4.8412 8.0626 122.6242 52.3570 20.0173 176.7410 19 I 4.8247 8.9345 112.5089 59.3532 42.0809 174.2404 20 V 4.8758 8.7197 122.8529 61.3379 34.3266 174.2975 21 V 4.7970 9.1897 129.2956 61.5206 33.0694 174.7795 22 L 4.9743 9.0818 129.2845 54.8502 43.0127 175.6265 23 C 5.7215 9.1153 121.3833 59.2344 35.4757 172.5110 24 T 5.3557 8.6545 112.8184 59.9862 71.6318 172.7121 25 A 4.5776 8.7639 123.4646 49.3871 22.4374 175.6990 26 P 4.4845 0.0000 0.0000 65.3992 31.9610 176.2733 27 D 4.6015 7.3832 116.9299 51.3372 43.5677 176.0886 28 E 3.9406 8.6323 118.8172 59.2058 29.3817 179.4024 29 A 3.9641 7.9312 120.6661 55.3011 18.6018 179.7232 30 S 4.0467 8.7401 112.9312 61.4195 63.0025 176.5078 31 A 3.9621 7.9718 124.4045 55.0462 18.0486 179.6780 32 Q 3.9318 8.4763 117.0101 59.0872 28.7867 178.6884 33 N 4.3213 8.2046 117.5426 56.1274 38.5150 177.1747 34 L 4.0212 8.0554 121.4121 58.1822 42.1806 178.7820 35 A 4.0896 8.2046 120.4479 55.2510 18.2426 179.3914 36 A 3.9401 8.2860 119.4026 55.4389 18.4591 179.9420 37 Q 3.9113 8.2117 116.5094 59.0904 28.8556 179.1172 38 V 3.1969 8.0658 119.4251 65.8596 31.5574 178.1120 39 L 4.0650 8.2582 119.0590 57.7406 41.2496 179.7238 40 G 3.5881 8.0320 104.7986 47.7029 0.0000 174.9926 41 E 4.0324 7.9296 118.1850 55.9497 29.8831 176.8939 42 K 3.7568 7.8751 118.2126 57.5685 30.0376 176.7618 43 L 4.3765 7.8096 117.4939 54.9745 42.3700 176.6145 44 A 4.6467 7.3720 119.6259 50.6595 22.2335 175.3857 45 A 4.2016 8.7138 121.7745 53.6439 20.2598 177.7460 46 C 4.8480 7.8550 114.0230 58.0969 35.5138 173.1156 47 V 4.6224 8.4178 124.7004 61.4222 33.6671 174.3365 48 T 4.5768 8.7986 125.1873 61.7953 70.8002 173.3230 49 L 4.8646 8.4487 125.9574 53.1519 44.0110 176.6124 50 L 4.7059 8.8475 124.8694 52.1563 42.3673 174.4149 51 P 4.4899 0.0000 0.0000 62.4867 32.8637 176.4450 52 G 3.7767 8.6980 105.4729 46.2563 0.0000 173.7054 53 A 4.4639 7.8655 121.6945 51.7426 20.0818 177.3179 54 T 5.0154 8.4222 115.0562 61.9437 71.5701 173.9039 55 S 4.9307 9.4036 122.5559 56.7100 65.7188 173.0224 56 L 5.5984 8.4510 123.7772 52.4836 44.0529 175.2234 57 Y 4.7285 7.3132 118.1122 56.6520 40.8572 172.2290 58 Y 4.8181 8.9514 118.6197 56.9610 39.6202 175.1674 59 W 5.0697 9.1183 133.3407 56.7710 33.5536 174.7777 60 E 3.3356 9.3195 126.3443 57.5186 26.3716 175.7801 61 G 4.0218 8.5407 104.8685 45.3133 0.0000 173.7702 62 K 4.7558 7.8799 119.3659 54.1066 35.4481 175.2942 63 L 3.5615 8.3601 126.4089 54.8044 42.4606 175.5997 64 E 4.4200 8.6837 126.7218 54.5218 32.2680 175.2945 65 Q 4.3950 8.2361 123.2051 54.4806 31.5062 173.9610 66 E 4.6916 8.9234 125.6019 54.4684 34.0954 175.0290 67 Y 4.9715 8.3996 119.9229 58.4075 39.0901 174.5829 68 E 4.9423 9.4115 121.4812 55.3976 35.4394 173.7879 69 V 4.7064 8.8716 121.1796 61.3824 33.8120 174.1351 70 Q 4.7097 8.8220 129.7798 55.3563 30.4548 174.3020 71 L 5.1578 9.4382 127.3583 53.0574 44.9433 175.5327 72 L 5.1091 8.6371 121.7296 53.1857 45.0730 175.4556 73 F 4.9019 9.4847 124.1618 55.9021 41.0273 175.1575 74 K 4.9692 9.1595 124.8003 55.4423 33.5924 175.2667 75 S 4.3152 8.7462 121.8739 57.5724 66.0764 172.1425 76 N 5.5704 8.6609 114.1298 50.3881 40.7521 175.0564 77 T 3.9041 8.9783 109.9564 65.2288 68.2718 176.2518 78 D 4.4288 7.7441 120.0999 56.3924 41.0404 177.2509 79 H 4.7491 8.1160 114.6488 55.0807 29.4465 175.5932 80 Q 3.9462 7.6987 123.1295 59.4924 28.8209 178.3365 81 Q 3.9230 8.0222 119.6073 59.1145 29.1736 177.7302 82 A 3.9899 7.9438 121.3806 54.9097 18.3639 179.1669 83 L 3.8290 8.0746 118.8108 58.3152 42.2460 179.0721 84 L 3.9045 7.9398 118.8372 58.2624 41.6095 179.7992 85 T 3.8706 8.1489 115.6655 66.6164 68.1426 176.0826 86 Y 3.8715 8.1852 120.6956 60.7757 39.1967 177.8349 87 I 3.8849 8.0255 120.8476 64.4064 37.0115 178.1227 88 K 3.8371 7.8409 118.9427 59.6151 32.0466 177.9630 89 Q 4.2344 7.6410 115.2287 56.5650 29.3245 175.4291 90 H 4.8709 7.9539 117.4851 55.8466 29.9029 172.6688 91 H 4.9208 7.9965 117.2525 53.2847 32.7552 171.4485 92 P 4.3422 0.0000 0.0000 65.6350 31.4237 176.6203 93 Y 4.6966 7.7166 115.1168 57.1097 38.8633 175.2900 94 Q 4.1847 8.7868 123.9432 58.7805 29.5431 176.4112 95 T 4.5873 7.4830 114.0781 60.7836 68.6767 171.4168 96 P 4.5354 0.0000 0.0000 61.5330 33.0985 176.6720 97 E 4.0190 8.6170 121.2215 56.7291 30.6499 175.6777 98 L 4.7168 8.5197 126.5505 53.3788 44.8201 175.0805 99 L 4.7331 8.8322 124.1825 52.6826 45.0507 175.9450 100 V 4.4462 8.5165 124.4667 61.6976 32.5840 174.8927 101 L 4.7387 9.0516 129.4633 53.0475 43.2083 174.8730 102 P 4.9251 0.0000 0.0000 62.5490 32.9301 175.4552 103 V 4.2597 7.7889 120.1603 61.2348 32.7464 175.6690 104 R 3.0409 8.5230 128.6768 58.9476 30.2085 175.0456 105 D 4.6580 7.2549 113.9492 53.9504 43.8714 173.1210 106 G 4.0499 7.8694 109.1588 43.4709 0.0000 173.0128 107 D 4.5074 8.3449 118.9650 53.6066 42.5217 176.7068 108 K 3.9997 8.7565 126.7246 60.4259 32.6022 179.0285 109 D 4.3829 8.2222 119.5919 57.1733 40.7203 177.9978 110 Y 4.1801 8.4749 120.0974 60.7619 38.7955 177.8645 111 L 3.9356 8.4696 120.3657 57.6919 41.6940 179.4613 112 S 4.0600 8.4279 113.4751 61.1531 62.2379 176.0806 113 W 4.0592 8.1679 131.0895 60.1442 30.1890 177.6442 114 L 3.1068 7.7339 119.5164 58.0624 41.6951 178.4002 115 N 4.3182 8.2875 116.4846 56.2747 38.2697 177.3080 116 A 3.9922 7.7126 120.9636 54.3520 18.5134 178.9901 117 S 4.0555 7.0594 111.1256 58.6333 63.6591 174.4814 118 L 4.3359 6.4520 122.4685 53.0780 42.7253 176.4353 119 L 4.0565 7.9415 121.5465 55.7530 41.8959 176.9338 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 15 Y 8.13 4.72 0.00 2.88 3.03 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 16 S 8.24 4.33 0.00 4.01 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.91 4.87 0.00 2.81 3.11 0.00 0.00 5.83 7.33 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 18 A 8.06 4.84 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 19 I 8.93 4.82 1.93 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.89 1.02 0.00 0.00 20 V 8.72 4.88 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 1.01 0.00 0.00 21 V 9.19 4.80 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 1.03 0.00 0.00 0.97 0.00 0.00 22 L 9.08 4.97 0.00 1.67 1.80 0.97 0.53 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 23 C 9.12 5.72 0.00 3.19 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 24 T 8.65 5.36 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 1.37 0.00 0.00 25 A 8.76 4.58 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 P 0.00 4.48 0.00 2.22 2.34 0.00 3.43 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.75 0.00 27 D 7.38 4.60 0.00 3.05 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 28 E 8.63 3.94 0.00 2.01 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 2.37 2.35 0.00 29 A 7.93 3.96 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 30 S 8.74 4.05 0.00 3.91 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 31 A 7.97 3.96 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 32 Q 8.48 3.93 0.00 2.19 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.75 0.00 0.00 0.00 0.00 0.00 2.36 2.52 0.00 33 N 8.20 4.32 0.00 2.88 2.88 0.00 0.00 6.67 6.34 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 34 L 8.06 4.02 0.00 1.81 1.95 1.13 1.04 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 35 A 8.20 4.09 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 36 A 8.29 3.94 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 37 Q 8.21 3.91 0.00 2.46 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.75 0.00 0.00 0.00 0.00 0.00 2.45 2.62 0.00 38 V 8.07 3.20 2.39 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 1.11 0.00 0.00 1.06 0.00 0.00 39 L 8.26 4.07 0.00 1.92 1.69 0.95 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 40 G 8.03 3.59 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 0.00 0.00 0.00 0.00 41 E 7.93 4.03 0.00 1.69 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 0.00 2.17 1.60 0.00 42 K 7.88 3.76 0.00 1.89 1.85 0.00 1.58 0.00 0.00 1.56 0.00 0.00 2.82 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.25 1.31 7.81 43 L 7.81 4.38 0.00 1.47 1.62 0.71 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 44 A 7.37 4.65 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 45 A 8.71 4.20 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 46 C 7.86 4.85 0.00 3.40 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 47 V 8.42 4.62 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 -0.02 0.00 0.00 0.91 0.00 0.00 48 T 8.80 4.58 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 49 L 8.45 4.86 0.00 1.44 1.53 0.78 0.92 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 50 L 8.85 4.71 0.00 1.54 1.58 0.93 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 51 P 0.00 4.49 0.00 2.05 2.04 0.00 3.85 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 52 G 8.70 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 0.00 0.00 0.00 53 A 7.87 4.46 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 54 T 8.42 5.02 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 1.11 0.00 0.00 55 S 9.40 4.93 0.00 3.88 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 L 8.45 5.60 0.00 1.46 1.45 0.89 0.87 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 57 Y 7.31 4.73 0.00 3.15 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 58 Y 8.95 4.82 0.00 2.97 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 59 W 9.12 5.07 0.00 3.63 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 60 E 9.32 3.34 0.00 2.11 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 1.87 1.50 0.00 61 G 8.54 4.02 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 0.00 0.00 0.00 62 K 7.88 4.76 0.00 1.84 1.67 0.00 1.71 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 1.39 1.52 7.81 63 L 8.36 3.56 0.00 0.68 1.26 0.34 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.68 4.42 0.00 1.16 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 2.22 2.28 0.00 65 Q 8.24 4.40 0.00 1.82 1.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.76 0.00 0.00 0.00 0.00 0.00 1.99 2.20 0.00 66 E 8.92 4.69 0.00 2.00 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 2.12 2.45 0.00 67 Y 8.40 4.97 0.00 2.94 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 68 E 9.41 4.94 0.00 1.96 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 2.40 2.38 0.00 69 V 8.87 4.71 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 0.96 0.00 0.00 0.93 0.00 0.00 70 Q 8.82 4.71 0.00 2.27 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.53 0.00 0.00 0.00 0.00 0.00 2.35 2.41 0.00 71 L 9.44 5.16 0.00 1.79 1.20 1.01 -0.77 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 72 L 8.64 5.11 0.00 1.51 1.57 0.93 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 73 F 9.48 4.90 0.00 2.94 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 74 K 9.16 4.97 0.00 1.94 1.93 0.00 1.78 0.00 0.00 1.74 0.00 0.00 2.82 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.50 1.46 7.81 75 S 8.75 4.32 0.00 3.91 3.72 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 76 N 8.66 5.57 0.00 3.10 2.85 0.00 0.00 5.73 7.22 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 77 T 8.98 3.90 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 1.27 0.00 0.00 78 D 7.74 4.43 0.00 2.97 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 79 H 8.12 4.75 0.00 3.19 3.26 0.00 5.83 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 7.70 3.95 0.00 2.14 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.81 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 81 Q 8.02 3.92 0.00 2.19 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 82 A 7.94 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 83 L 8.07 3.83 0.00 1.81 1.86 0.71 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.94 3.90 0.00 1.87 1.69 0.92 0.59 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 85 T 8.15 3.87 4.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 86 Y 8.19 3.87 0.00 3.03 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 87 I 8.03 3.88 1.76 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.65 0.91 0.00 0.00 88 K 7.84 3.84 0.00 1.82 2.00 0.00 1.66 0.00 0.00 1.69 0.00 0.00 3.12 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.44 1.52 7.81 89 Q 7.64 4.23 0.00 1.81 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.20 0.00 0.00 0.00 0.00 0.00 2.28 2.44 0.00 90 H 7.95 4.87 0.00 2.90 3.14 0.00 5.79 0.00 0.00 0.00 0.00 8.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 H 8.00 4.92 0.00 3.30 3.09 0.00 5.73 0.00 0.00 0.00 0.00 6.73 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 4.34 0.00 2.01 2.05 0.00 3.17 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.70 0.00 93 Y 7.72 4.70 0.00 2.91 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 94 Q 8.79 4.18 0.00 2.06 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.21 0.00 0.00 0.00 0.00 0.00 2.41 2.50 0.00 95 T 7.48 4.59 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 1.28 0.00 0.00 96 P 0.00 4.54 0.00 1.98 1.52 0.00 3.81 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.83 0.00 97 E 8.62 4.02 0.00 2.07 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 2.58 2.37 0.00 98 L 8.52 4.72 0.00 1.50 1.54 0.93 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.83 4.73 0.00 1.61 1.57 0.95 0.80 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 0.00 100 V 8.52 4.45 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 0.95 0.00 0.00 101 L 9.05 4.74 0.00 1.73 1.61 0.97 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.93 0.00 2.39 2.18 0.00 3.79 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 2.16 2.09 0.00 103 V 7.79 4.26 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 0.80 0.00 0.00 1.01 0.00 0.00 104 R 8.52 3.04 0.00 1.11 1.58 0.00 3.10 0.00 0.00 3.13 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.83 0.00 105 D 7.25 4.66 0.00 2.54 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 0.00 106 G 7.87 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 0.00 107 D 8.34 4.51 0.00 2.83 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 0.00 108 K 8.76 4.00 0.00 2.05 2.09 0.00 1.58 0.00 0.00 1.84 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.57 7.81 109 D 8.22 4.38 0.00 2.97 2.82 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 0.00 110 Y 8.47 4.18 0.00 3.12 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 0.00 111 L 8.47 3.94 0.00 1.77 1.73 1.01 0.90 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 0.00 112 S 8.43 4.06 0.00 3.98 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 0.00 113 W 8.17 4.06 0.00 3.40 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 0.00 114 L 7.73 3.11 0.00 1.30 1.61 0.98 1.19 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 0.00 115 N 8.29 4.32 0.00 2.67 2.79 0.00 0.00 6.99 6.74 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 0.00 116 A 7.71 3.99 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 0.00 117 S 7.06 4.06 0.00 3.52 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 0.00 118 L 6.45 4.34 0.00 1.33 0.98 0.79 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 119 L 7.94 4.06 0.00 1.68 1.63 0.89 0.71 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