NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4628 8.3049 120.3274 55.0920 33.4422 174.4739 2 K 4.5618 8.5014 122.3037 54.5890 34.1380 174.1880 3 R 4.8811 10.5355 123.9933 54.7149 33.5001 174.7913 4 I 5.0814 8.7989 124.5011 59.5837 39.7922 174.3192 5 A 5.2371 9.2292 128.9505 50.1673 21.6936 174.9366 6 F 5.0645 9.5099 121.9398 55.8415 41.6612 175.2218 7 V 5.0305 8.9278 117.5545 59.6869 34.4785 174.7492 8 F 5.1184 9.5497 126.2312 56.3146 39.8756 176.5967 9 S 5.1955 9.5223 117.9818 57.7878 64.1240 173.8576 10 T 4.7423 7.7392 110.9380 59.5803 71.2256 173.4993 11 A 4.7039 8.4497 125.7035 51.3910 19.1823 175.8933 12 P 4.6147 0.0000 0.0000 63.9507 32.4855 175.9316 13 H 4.8036 9.2749 121.3414 56.8174 27.3912 176.8176 14 G 3.8809 8.1937 106.1494 48.2524 0.0000 173.4646 15 T 4.6684 7.5119 113.2706 60.9950 72.5835 173.9260 16 A 4.3146 8.5111 124.1051 52.3875 18.5448 179.2991 17 A 4.1456 8.0603 122.4008 55.6782 18.3438 180.4371 18 G 3.9430 8.0908 104.8563 47.4402 0.0000 175.5987 19 R 2.9095 7.1441 120.8618 58.9178 30.0776 178.3538 20 E 4.0104 8.0697 118.0526 58.6844 29.3206 179.6678 21 G 2.0000 7.7684 106.4521 46.9514 0.0000 175.5877 22 L 4.0995 8.1449 123.4708 57.9133 42.0283 178.7766 23 D 4.2251 7.9430 118.5999 57.3374 40.7406 178.6999 24 A 4.0025 7.7071 121.2419 54.7779 18.3499 179.4312 25 L 2.4400 7.8358 119.2628 57.8851 41.8953 179.3181 26 L 3.9126 7.6281 117.2941 57.6786 41.4245 179.0626 27 A 4.1040 7.9213 120.7726 55.4289 18.2091 179.8869 28 T 3.9836 8.0011 114.6843 66.6337 68.1706 177.1352 29 S 4.3221 8.2679 115.9109 61.1605 62.6056 176.0157 30 A 3.8686 7.6013 122.4355 53.4257 18.3749 177.6319 31 L 4.5688 7.7117 115.6604 54.7364 43.1356 176.2106 32 T 4.4747 7.2753 110.6071 61.5651 70.4026 172.5907 33 D 4.7531 8.6611 125.1078 55.1685 42.5860 177.1279 34 D 5.0346 8.0491 122.4576 52.7216 38.7092 175.3081 35 L 6.1510 7.9716 118.0236 53.6249 44.4526 176.8043 36 A 5.0808 8.6912 120.6467 50.3114 23.4459 174.9994 37 V 5.0024 8.7592 118.7198 59.9261 34.5976 174.5627 38 F 5.3499 9.5699 123.3764 55.6369 42.2686 174.3065 39 F 5.3927 9.5440 122.7604 55.8999 40.9928 174.5122 40 I 4.9483 8.6982 116.8436 58.3239 41.3219 176.5851 41 A 3.4743 8.1675 123.4321 53.3197 17.8311 180.2562 42 D 4.8280 8.8330 114.1171 58.4209 40.8204 178.1744 43 G 4.2332 8.4424 106.6165 46.6094 0.0000 175.9855 44 V 3.5851 7.7086 114.4029 64.1690 31.2271 178.2699 45 F 4.4104 8.3368 117.3741 60.0844 38.4240 177.4585 46 Q 4.1229 8.0262 117.4468 58.7055 28.7670 178.0818 47 L 3.6736 7.4968 118.9010 55.0907 41.7230 177.0933 48 L 4.3797 7.0367 120.0216 54.1250 41.3692 175.3349 49 P 4.4704 0.0000 0.0000 63.1180 32.5516 176.8185 50 G 3.8050 8.7144 105.7177 45.9209 0.0000 173.9290 51 Q 4.1846 7.3695 119.2374 55.8933 29.7324 177.0578 52 K 4.6125 8.1630 120.1698 53.6678 32.6792 175.1755 53 P 4.2633 0.0000 0.0000 64.8938 32.0229 179.1568 54 D 4.3546 8.1369 118.3727 55.7035 39.4209 178.2256 55 A 4.0598 7.8054 122.4605 54.4679 17.3471 178.4014 56 V 4.3386 7.9655 109.1019 60.9782 32.1965 176.1754 57 L 3.8123 7.8435 116.6758 55.6881 39.5519 174.3309 58 A 4.7766 7.0826 120.3541 49.9938 21.0275 177.8316 59 R 4.0831 8.3853 120.8815 56.4630 30.8438 177.2557 60 D 4.6649 8.4694 125.8162 53.6085 39.7666 175.0604 61 Y 4.4765 7.9812 119.3334 57.0708 39.5727 178.6015 62 I 3.6254 7.3502 122.0197 64.3981 37.7184 177.6963 63 A 4.0297 7.9526 121.6976 55.7698 18.0771 179.7723 64 T 3.9046 7.8092 113.4936 66.3018 68.4424 176.5603 65 F 4.2803 8.3839 120.1860 59.7718 38.9021 177.1913 66 K 4.0078 8.2738 119.7467 59.2741 31.8403 178.3985 67 L 4.1371 8.0119 118.7812 56.8255 41.4508 179.2876 68 L 4.1294 8.0014 120.0782 57.7063 41.3526 179.5518 69 G 3.5484 7.9081 104.1996 47.5513 0.0000 175.3246 70 L 3.8883 7.5356 120.2367 56.7718 41.8587 178.8080 71 Y 4.8795 7.7860 115.6142 57.8507 39.3329 175.2002 72 D 4.3931 8.1348 114.3857 55.5165 38.7847 175.2721 73 I 4.2062 7.6617 121.2169 60.3679 35.7423 175.2851 74 E 4.2587 8.2002 123.7764 57.4100 30.7900 177.6416 75 Q 4.0243 7.6774 118.7620 55.0874 27.4340 173.2879 76 C 4.9867 7.1421 118.7611 57.2518 31.9244 172.8451 77 W 5.7333 9.0320 122.8509 54.8595 33.5320 174.6013 78 V 4.9795 8.4722 120.9762 59.9389 34.7010 174.3446 79 C 4.5833 9.2615 124.7030 59.1857 31.8114 173.8745 80 A 4.0409 9.0690 130.1182 55.1260 17.9879 178.9099 81 A 3.9415 7.9655 118.8026 55.3271 18.6134 179.5676 82 S 4.0160 8.0337 111.0857 61.6244 62.4619 176.1068 83 L 3.9123 7.8075 121.4148 57.8730 41.3245 179.8920 84 R 3.9067 7.9374 117.6279 59.3993 29.8500 178.8930 85 E 4.0391 8.0116 117.0127 59.0415 29.4898 178.6932 86 R 4.5054 7.7412 115.2745 55.0619 30.4062 176.5060 87 G 3.9471 7.8651 106.6039 46.4875 0.0000 173.5789 88 L 4.4947 7.8584 119.5688 52.2535 43.1760 176.2639 89 D 4.3375 8.6923 123.0993 53.9046 41.2538 175.2303 90 P 4.3908 0.0000 0.0000 65.0362 31.4887 176.6167 91 Q 4.2273 8.4785 119.3253 55.8582 29.0722 175.4936 92 T 3.6647 7.1946 114.4425 63.5548 68.7038 173.4184 93 P 4.2482 0.0000 0.0000 61.4346 29.6944 175.9906 94 F 4.6094 7.3553 125.6405 58.4433 39.5937 176.6302 95 V 3.7774 8.1683 114.9167 62.2952 31.7006 176.8501 96 V 4.3435 6.7898 119.3931 60.8628 34.5443 176.1093 97 E 4.2130 8.5203 126.3211 55.5543 27.5157 175.3018 98 A 4.7206 7.4935 121.1329 50.5339 21.1145 177.4564 99 T 4.5861 8.1382 113.4864 59.5922 70.7750 172.8427 100 P 4.9724 0.0000 0.0000 63.1071 32.4523 175.5671 101 L 4.9474 8.8194 121.0246 53.0877 46.1244 176.4203 102 E 4.4340 8.8728 121.4803 55.5149 30.6454 177.4300 103 A 3.9598 8.6294 122.0029 55.7600 18.2290 179.5044 104 D 4.2770 8.1676 116.0236 56.7075 39.2463 178.6479 105 A 3.8762 8.1942 122.8008 54.4738 18.4316 179.1883 106 L 3.8024 8.0054 118.9880 58.2679 42.0668 179.0768 107 R 3.7905 8.0987 118.5691 59.6379 29.8083 178.7174 108 R 3.9021 7.7125 116.3319 59.1054 30.3069 178.3828 109 E 4.0888 8.2834 119.2312 59.3077 29.7532 178.6978 110 L 3.7262 8.0262 120.0954 57.7629 41.8322 178.2310 111 A 4.2334 7.6248 118.5108 53.6983 18.4061 178.2351 112 N 4.4512 8.0507 113.9680 53.4338 39.3082 174.6007 113 Y 4.4470 7.3202 118.2249 56.6275 39.5963 175.4918 114 D 4.6247 8.6411 123.3303 56.3890 41.9857 177.2066 115 V 4.4922 7.8399 117.2596 60.9309 35.1754 174.3706 116 I 4.9091 8.3546 127.1512 59.4457 40.0652 174.5913 117 L 4.3960 8.6018 127.4542 52.8344 43.9887 175.3389 118 R 4.8027 8.1061 124.6195 54.6049 31.9476 175.9146 119 F 4.3636 8.9656 124.0719 57.5936 39.8706 174.8413 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 4.46 0.00 2.04 2.08 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 2.51 2.58 0.00 2 K 8.50 4.56 0.00 1.85 1.75 0.00 1.74 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.38 1.49 7.81 3 R 10.54 4.88 0.00 1.52 1.73 0.00 2.94 0.00 0.00 2.97 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 4 I 8.80 5.08 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 1.22 1.09 0.75 0.00 0.00 5 A 9.23 5.24 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 F 9.51 5.06 0.00 3.10 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 7 V 8.93 5.03 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 0.68 0.00 0.00 0.90 0.00 0.00 8 F 9.55 5.12 0.00 2.64 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 9 S 9.52 5.20 0.00 3.94 3.96 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 10 T 7.74 4.74 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 1.31 0.00 0.00 11 A 8.45 4.70 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 12 P 0.00 4.61 0.00 1.75 2.18 0.00 3.96 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.26 0.00 13 H 9.27 4.80 0.00 3.43 3.60 0.00 5.71 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 14 G 8.19 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 15 T 7.51 4.67 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 16 A 8.51 4.31 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 17 A 8.06 4.15 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 18 G 8.09 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 19 R 7.14 2.91 0.00 0.67 1.65 0.00 3.18 0.00 0.00 3.13 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.42 0.00 20 E 8.07 4.01 0.00 2.01 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 0.00 2.23 2.41 0.00 21 G 7.77 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 L 8.14 4.10 0.00 1.76 1.72 0.71 0.46 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 23 D 7.94 4.23 0.00 2.78 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 24 A 7.71 4.00 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 25 L 7.84 2.44 0.00 1.00 1.67 0.51 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 26 L 7.63 3.91 0.00 1.57 1.65 0.87 0.71 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 27 A 7.92 4.10 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 28 T 8.00 3.98 4.51 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 1.46 0.00 0.00 29 S 8.27 4.32 0.00 4.07 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 30 A 7.60 3.87 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 31 L 7.71 4.57 0.00 1.75 1.72 0.95 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 32 T 7.28 4.47 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 1.32 0.00 0.00 33 D 8.66 4.75 0.00 2.75 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 34 D 8.05 5.03 0.00 2.73 2.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 7.97 6.15 0.00 1.95 1.82 0.99 0.60 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 36 A 8.69 5.08 1.14 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 37 V 8.76 5.00 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 0.94 0.00 0.00 0.60 0.00 0.00 38 F 9.57 5.35 0.00 2.90 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 39 F 9.54 5.39 0.00 2.83 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 40 I 8.70 4.95 1.93 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 1.24 0.96 1.03 0.00 0.00 41 A 8.17 3.47 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 42 D 8.83 4.83 0.00 3.05 3.08 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 43 G 8.44 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 44 V 7.71 3.59 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 0.90 0.00 0.00 0.54 0.00 0.00 45 F 8.34 4.41 0.00 3.31 3.05 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 46 Q 8.03 4.12 0.00 2.04 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.98 0.00 0.00 0.00 0.00 0.00 2.81 3.08 0.00 47 L 7.50 3.67 0.00 1.26 1.18 -0.32 -1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 48 L 7.04 4.38 0.00 1.82 1.68 1.05 1.21 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 49 P 0.00 4.47 0.00 2.19 2.26 0.00 3.79 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 50 G 8.71 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 0.00 0.00 0.00 51 Q 7.37 4.18 0.00 2.26 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.53 7.15 0.00 0.00 0.00 0.00 0.00 2.44 2.54 0.00 52 K 8.16 4.61 0.00 1.74 1.67 0.00 1.67 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.56 7.81 53 P 0.00 4.26 0.00 2.30 1.85 0.00 3.74 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 2.05 1.93 0.00 54 D 8.14 4.35 0.00 2.88 2.98 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 55 A 7.81 4.06 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 56 V 7.97 4.34 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 0.83 0.00 0.00 0.97 0.00 0.00 57 L 7.84 3.81 0.00 1.82 1.76 0.93 0.52 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 58 A 7.08 4.78 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 59 R 8.39 4.08 0.00 1.84 1.96 0.00 3.26 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 60 D 8.47 4.66 0.00 2.66 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 61 Y 7.98 4.48 0.00 3.19 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 I 7.35 3.63 1.90 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.91 0.96 0.00 0.00 63 A 7.95 4.03 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 64 T 7.81 3.90 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 1.16 0.00 0.00 65 F 8.38 4.28 0.00 3.28 2.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 K 8.27 4.01 0.00 1.84 1.97 0.00 1.62 0.00 0.00 1.63 0.00 0.00 2.89 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.39 1.45 7.81 67 L 8.01 4.14 0.00 1.87 1.93 1.01 0.44 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 68 L 8.00 4.13 0.00 1.98 1.73 1.09 0.83 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 69 G 7.91 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 L 7.54 3.89 0.00 1.29 0.61 0.72 0.54 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 71 Y 7.79 4.88 0.00 3.05 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.13 4.39 0.00 2.85 2.75 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 73 I 7.66 4.21 1.99 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 1.33 0.71 0.91 0.00 0.00 74 E 8.20 4.26 0.00 1.90 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 2.19 2.28 0.00 75 Q 7.68 4.02 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.86 0.00 0.00 0.00 0.00 0.00 2.50 2.52 0.00 76 C 7.14 4.99 0.00 2.72 2.68 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 77 W 9.03 5.73 0.00 3.07 3.01 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 78 V 8.47 4.98 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 0.77 0.00 0.00 0.67 0.00 0.00 79 C 9.26 4.58 0.00 3.10 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 A 9.07 4.04 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 7.97 3.94 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 82 S 8.03 4.02 0.00 3.91 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 83 L 7.81 3.91 0.00 1.94 1.73 1.03 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 84 R 7.94 3.91 0.00 2.07 1.98 0.00 3.14 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.85 0.00 85 E 8.01 4.04 0.00 2.12 2.05 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 2.36 2.37 0.00 86 R 7.74 4.51 0.00 1.63 1.85 0.00 3.20 0.00 0.00 2.55 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.63 0.00 87 G 7.87 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 0.00 0.00 0.00 88 L 7.86 4.49 0.00 1.72 1.64 0.43 1.25 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 89 D 8.69 4.34 0.00 2.64 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 90 P 0.00 4.39 0.00 2.24 2.20 0.00 3.79 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.96 0.00 91 Q 8.48 4.23 0.00 1.97 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.84 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 92 T 7.19 3.66 3.60 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 0.96 0.00 0.00 93 P 0.00 4.25 0.00 2.06 1.96 0.00 3.58 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.87 0.00 94 F 7.36 4.61 0.00 3.12 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 95 V 8.17 3.78 2.05 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 0.64 0.00 0.00 0.72 0.00 0.00 96 V 6.79 4.34 1.54 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 0.69 0.00 0.00 0.50 0.00 0.00 97 E 8.52 4.21 0.00 1.91 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 2.25 2.19 0.00 98 A 7.49 4.72 1.03 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 99 T 8.14 4.59 4.37 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 1.16 0.00 0.00 100 P 0.00 4.97 0.00 2.18 2.20 0.00 3.80 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 2.07 2.08 0.00 101 L 8.82 4.95 0.00 1.64 1.52 0.27 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 102 E 8.87 4.43 0.00 2.00 1.87 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 2.42 2.26 0.00 103 A 8.63 3.96 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 0.00 104 D 8.17 4.28 0.00 2.94 2.94 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 0.00 105 A 8.19 3.88 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 0.00 106 L 8.01 3.80 0.00 1.75 1.82 1.10 0.82 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 0.00 107 R 8.10 3.79 0.00 2.01 2.05 0.00 3.12 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.62 0.00 108 R 7.71 3.90 0.00 1.91 1.95 0.00 3.19 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.94 0.00 109 E 8.28 4.09 0.00 1.91 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 0.00 1.47 2.56 0.00 110 L 8.03 3.73 0.00 1.14 1.53 0.05 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.62 4.23 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 0.00 112 N 8.05 4.45 0.00 2.96 2.66 0.00 0.00 6.90 7.59 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 0.00 113 Y 7.32 4.45 0.00 3.17 3.11 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 0.00 114 D 8.64 4.62 0.00 2.72 2.73 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 0.00 115 V 7.84 4.49 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 0.84 0.00 0.00 0.93 0.00 0.00 116 I 8.35 4.91 1.77 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.78 0.00 0.00 117 L 8.60 4.40 0.00 1.04 1.35 0.58 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 118 R 8.11 4.80 0.00 1.65 1.59 0.00 3.13 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.56 0.00 119 F 8.97 4.36 0.00 2.42 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