NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 43 N 4.5531 8.4201 119.2137 53.5284 39.0680 173.1411 44 A 4.3381 8.3178 128.4717 49.6739 20.3384 174.8277 45 R 4.2262 9.2879 123.8100 56.7412 31.8401 174.2518 46 M 5.9664 8.6063 122.1797 52.8242 36.0117 174.4086 47 D 5.1246 8.7538 121.2330 52.5057 44.5001 175.4619 48 W 5.1807 8.6755 130.1772 55.9317 32.7927 174.1477 49 K 4.5225 8.9961 126.9131 54.2955 35.2411 174.9548 50 E 4.9550 8.3768 122.5640 54.6768 31.8708 175.3006 51 T 4.5941 9.1319 117.0350 58.9583 71.3185 173.6934 52 P 4.3513 0.0000 0.0000 65.3960 31.6199 177.6043 53 E 4.4356 7.7907 117.2724 58.3434 31.0296 176.1667 54 A 4.8535 8.6525 119.2456 51.5313 23.6871 174.8876 55 H 5.0203 8.9806 116.9399 54.8879 30.5074 174.8823 56 V 4.8069 8.9468 123.9160 61.0791 34.0007 174.1324 57 F 5.2927 9.3539 126.5662 55.6328 41.8900 174.6542 58 K 5.2865 8.9842 121.3056 54.7041 36.0718 175.1656 59 A 5.1278 8.8338 124.4376 50.5171 22.7630 174.9883 60 D 4.8453 8.9502 123.9105 53.2337 41.0588 177.4759 61 L 4.6545 9.0692 127.0715 52.4640 42.5315 175.0244 62 P 4.1787 0.0000 0.0000 64.2807 32.0066 176.7386 63 G 3.8880 8.8435 107.8415 46.2651 0.0000 172.9475 64 V 4.5220 7.3522 118.4201 60.4861 33.4645 175.6269 65 K 4.3839 9.0594 127.2720 55.3058 32.7976 178.2292 66 K 4.1785 8.6347 120.9585 59.4264 32.3667 177.5095 67 E 4.2339 8.0990 117.4888 57.5260 30.1242 176.5852 68 E 4.5021 8.7356 118.2232 55.8976 30.5024 175.1509 69 V 4.9157 7.5441 118.7306 60.8685 34.2891 174.5152 70 K 4.6291 9.4633 127.5948 54.5370 35.4620 174.7456 71 V 4.8407 8.5177 126.5745 61.3665 33.7618 173.9847 72 E 4.7775 9.2099 126.5708 54.8408 34.8845 174.4804 73 V 4.6960 8.2073 119.1254 61.6561 33.6266 174.6969 74 E 4.3847 9.3946 128.3269 54.6803 32.1431 175.8476 75 D 4.5578 9.7086 116.8665 55.1219 38.7757 175.6417 76 G 4.2215 9.1905 110.3726 45.6773 0.0000 174.9216 77 N 5.0167 7.9750 115.6198 52.5244 39.3695 174.2113 78 V 4.7204 8.1435 120.6714 61.5220 34.0149 174.3200 79 L 4.4519 8.8241 132.1810 54.9827 43.2334 175.6619 80 V 4.7784 9.0774 126.5495 61.2060 34.4129 174.1173 81 V 4.8991 9.0982 129.4788 61.3125 33.4202 174.6250 82 S 4.9666 8.9166 121.7349 56.8798 67.2608 174.0819 83 G 3.7819 5.8035 104.8470 45.5950 0.0000 170.7901 84 E 4.8689 8.1096 118.8835 54.5809 33.0217 176.9141 85 R 4.5735 9.4496 128.2846 54.3197 29.8447 173.8709 86 T 4.1089 8.3143 118.9166 63.5582 69.2969 173.1900 87 K 4.1120 8.6010 127.4038 55.9737 33.4370 177.2600 88 E 4.3850 8.5309 129.6630 54.2689 28.3309 175.4131 89 K 3.9889 8.0442 122.2837 58.8878 33.3384 178.2804 90 E 3.6831 8.1089 116.7259 56.7170 27.7062 172.8027 91 D 5.0543 8.2290 119.9088 52.2908 42.0821 177.1222 92 K 4.2837 8.4341 117.8671 58.0805 32.3528 178.4272 93 N 4.4428 8.0309 116.0899 55.8999 38.7166 175.2458 94 D 4.4939 7.4523 117.4179 53.8094 41.5374 175.5526 95 K 4.4040 7.7087 120.6641 54.6419 34.9489 175.1953 96 W 4.5601 8.7795 126.1411 55.6543 30.1512 175.6690 97 H 4.7781 8.7178 120.3745 56.8234 29.3460 175.4086 98 R 4.5935 7.7555 116.9295 55.2282 32.6623 174.2945 99 V 4.3735 8.2923 123.9312 61.8583 33.3288 173.9374 100 E 4.6431 8.6970 125.4656 56.0802 31.9062 176.8781 101 R 4.1502 7.9283 117.9207 55.6888 30.8136 176.3784 102 S 4.6063 8.3483 116.9360 57.5928 64.6343 172.8125 103 S 4.6111 8.3303 114.3590 57.3222 66.0018 171.8295 104 G 3.8001 8.3859 105.1234 44.0003 0.0000 173.1859 105 K 4.7768 8.3992 118.6041 55.8217 33.4857 176.6485 106 F 5.1088 8.2089 117.1133 55.3279 41.6826 173.7953 107 V 4.9417 8.4794 119.8307 61.6500 34.6294 174.3231 108 R 4.7801 9.6926 126.3060 54.5391 34.1936 174.3665 109 R 5.7412 8.4340 121.3551 53.3978 33.4983 174.7845 110 F 4.5605 8.5893 120.9370 55.4689 43.3193 173.9028 111 R 4.6742 8.4393 123.0515 55.2208 30.5397 176.0644 112 L 4.5227 8.7193 127.6770 53.7128 43.2200 176.9112 113 L 4.2828 8.3616 119.4680 54.5990 42.0961 178.5030 114 E 4.1206 8.8566 121.6766 58.5189 29.9800 177.0803 115 D 4.8607 7.6950 117.2589 51.2904 38.9574 174.6323 116 A 4.7790 7.4962 124.0006 50.6633 23.0475 177.6596 117 K 4.3848 8.3250 120.7906 56.0242 29.7375 178.3139 118 V 3.4579 7.6567 119.7641 65.8660 31.9151 176.3996 119 E 4.3090 8.0913 116.1866 57.0980 29.7712 176.4393 120 E 4.6000 8.4985 118.2371 55.8165 30.0102 175.7334 121 V 4.1108 7.7348 119.8462 62.9046 32.0893 175.5107 122 K 4.8097 8.8286 126.6913 54.8353 35.4902 175.3152 123 A 4.9694 8.4395 123.2165 50.7341 21.7563 175.7614 124 G 4.2515 9.5684 110.1895 44.4025 0.0000 171.6448 125 L 5.2581 8.3474 123.0856 53.1004 44.9092 175.3670 126 E 4.5956 9.2116 126.3057 56.2148 33.1088 174.4142 127 N 4.3240 9.7346 122.1811 54.5662 36.2993 175.0998 128 G 3.8879 8.2410 102.4819 45.7770 0.0000 172.8996 129 V 4.8657 7.7006 120.0278 60.7169 34.3283 174.0812 130 L 5.0668 9.1074 130.5159 54.2630 44.1411 175.1623 131 T 5.1026 9.3225 122.1821 61.7862 72.1653 172.8335 132 V 4.8254 9.1309 126.8236 61.3718 34.5153 174.2176 133 T 4.7711 8.9766 125.0771 62.1300 70.7356 173.8602 134 V 4.2342 8.8435 129.0904 60.3555 32.6064 173.1191 135 P 4.7823 0.0000 0.0000 63.0218 32.3821 175.7763 136 K 4.5857 8.7948 123.1321 55.2437 33.0038 176.6580 137 A 3.8979 8.9954 127.3396 55.2212 18.3143 177.8594 *146 A 4.1788 7.5511 115.4692 52.0992 19.7005 175.7531 147 I 4.6717 7.8528 119.0536 59.3374 40.7571 175.6563 148 Q 4.2903 8.5025 121.9937 55.5304 29.5108 175.5845 149 I 4.5285 7.7108 122.5804 59.6928 39.2908 173.1676 150 S 4.1494 8.6085 123.4709 56.3900 69.5035 175.9787 151 G 4.1502 7.9052 114.5425 44.6911 0.0000 174.6179 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 43 N 8.42 4.55 0.00 2.72 2.86 0.00 0.00 6.87 7.08 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 44 A 8.32 4.34 0.98 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 45 R 9.29 4.23 0.00 1.79 1.89 0.00 3.09 0.00 0.00 3.34 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 46 M 8.61 5.97 0.00 2.03 2.22 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.54 0.00 47 D 8.75 5.12 0.00 2.61 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 48 W 8.68 5.18 0.00 3.11 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 49 K 9.00 4.52 0.00 1.61 1.55 0.00 1.61 0.00 0.00 1.52 0.00 0.00 2.77 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.26 1.29 7.81 50 E 8.38 4.96 0.00 1.56 1.58 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 2.13 2.17 0.00 51 T 9.13 4.59 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 1.19 0.00 0.00 52 P 0.00 4.35 0.00 2.06 2.16 0.00 3.66 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.10 0.00 53 E 7.79 4.44 0.00 1.98 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 2.29 2.31 0.00 54 A 8.65 4.85 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 55 H 8.98 5.02 0.00 3.24 3.22 0.00 5.59 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 56 V 8.95 4.81 2.02 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 1.12 0.00 0.00 0.93 0.00 0.00 57 F 9.35 5.29 0.00 2.82 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 58 K 8.98 5.29 0.00 1.66 1.67 0.00 1.65 0.00 0.00 1.67 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.50 7.81 59 A 8.83 5.13 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 0.00 0.00 0.00 0.00 0.00 60 D 8.95 4.85 0.00 2.52 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 L 9.07 4.65 0.00 1.49 1.44 0.84 -0.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 62 P 0.00 4.18 0.00 2.17 2.06 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 63 G 8.84 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 64 V 7.35 4.52 2.23 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 0.99 0.00 0.00 1.08 0.00 0.00 65 K 9.06 4.38 0.00 1.88 1.72 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.40 7.81 66 K 8.63 4.18 0.00 1.88 1.98 0.00 1.58 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.49 7.81 67 E 8.10 4.23 0.00 1.97 2.04 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 2.30 2.39 0.00 68 E 8.74 4.50 0.00 2.12 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 0.00 2.25 2.23 0.00 69 V 7.54 4.92 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 1.02 0.00 0.00 1.11 0.00 0.00 70 K 9.46 4.63 0.00 1.75 1.64 0.00 1.59 0.00 0.00 1.95 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.33 7.81 71 V 8.52 4.84 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 0.84 0.00 0.00 0.94 0.00 0.00 72 E 9.21 4.78 0.00 1.86 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 2.20 2.21 0.00 73 V 8.21 4.70 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 0.79 0.00 0.00 0.89 0.00 0.00 74 E 9.39 4.38 0.00 1.88 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 2.24 2.25 0.00 75 D 9.71 4.56 0.00 2.76 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 76 G 9.19 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 77 N 7.98 5.02 0.00 2.67 2.95 0.00 0.00 6.29 8.43 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 78 V 8.14 4.72 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 0.83 0.00 0.00 0.90 0.00 0.00 79 L 8.82 4.45 0.00 1.50 1.36 0.81 -0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 80 V 9.08 4.78 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 0.95 0.00 0.00 1.04 0.00 0.00 81 V 9.10 4.90 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 1.03 0.00 0.00 0.89 0.00 0.00 82 S 8.92 4.97 0.00 3.79 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 83 G 5.80 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 84 E 8.11 4.87 0.00 1.79 1.71 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 2.17 2.31 0.00 85 R 9.45 4.57 0.00 2.03 1.88 0.00 3.37 0.00 0.00 3.21 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.78 0.00 86 T 8.31 4.11 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 1.22 0.00 0.00 87 K 8.60 4.11 0.00 1.66 1.68 0.00 1.55 0.00 0.00 1.53 0.00 0.00 2.80 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.33 1.42 7.81 88 E 8.53 4.38 0.00 2.02 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 2.39 2.53 0.00 89 K 8.04 3.99 0.00 1.81 1.93 0.00 1.94 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.51 7.81 90 E 8.11 3.68 0.00 2.31 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 2.28 2.49 0.00 91 D 8.23 5.05 0.00 2.80 2.78 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 92 K 8.43 4.28 0.00 1.79 1.93 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.49 7.81 93 N 8.03 4.44 0.00 2.70 2.86 0.00 0.00 7.00 8.06 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 94 D 7.45 4.49 0.00 2.70 2.25 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 95 K 7.71 4.40 0.00 1.54 1.43 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.14 1.40 7.81 96 W 8.78 4.56 0.00 3.31 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 97 H 8.72 4.78 0.00 3.18 3.36 0.00 5.74 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 R 7.76 4.59 0.00 1.79 1.84 0.00 3.30 0.00 0.00 3.20 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00 99 V 8.29 4.37 2.02 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 0.66 0.00 0.00 0.89 0.00 0.00 100 E 8.70 4.64 0.00 1.97 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 2.21 2.31 0.00 101 R 7.93 4.15 0.00 1.81 1.87 0.00 3.22 0.00 0.00 3.32 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.65 0.00 102 S 8.35 4.61 0.00 3.98 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 0.00 103 S 8.33 4.61 0.00 4.14 3.82 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 0.00 104 G 8.39 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 0.00 105 K 8.40 4.78 0.00 1.60 1.62 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.37 7.81 106 F 8.21 5.11 0.00 3.07 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 0.00 107 V 8.48 4.94 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 0.81 0.00 0.00 0.89 0.00 0.00 108 R 9.69 4.78 0.00 1.80 1.94 0.00 3.28 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.84 0.00 109 R 8.43 5.74 0.00 1.52 1.71 0.00 3.14 0.00 0.00 3.84 7.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.42 0.00 110 F 8.59 4.56 0.00 2.44 2.53 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 0.00 0.00 0.00 0.00 111 R 8.44 4.67 0.00 1.79 1.85 0.00 3.24 0.00 0.00 3.24 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.65 0.00 112 L 8.72 4.52 0.00 1.60 1.63 0.87 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 113 L 8.36 4.28 0.00 1.73 1.75 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 114 E 8.86 4.12 0.00 1.97 2.03 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 2.34 2.27 0.00 115 D 7.69 4.86 0.00 2.70 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 0.00 116 A 7.50 4.78 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 0.00 117 K 8.33 4.38 0.00 1.93 1.80 0.00 1.99 0.00 0.00 1.58 0.00 0.00 2.89 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.53 7.81 118 V 7.66 3.46 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 1.06 0.00 0.00 119 E 8.09 4.31 0.00 1.98 1.97 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 2.28 2.38 0.00 120 E 8.50 4.60 0.00 2.01 1.93 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 2.24 2.21 0.00 121 V 7.73 4.11 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 0.80 0.00 0.00 0.99 0.00 0.00 122 K 8.83 4.81 0.00 1.81 1.68 0.00 1.58 0.00 0.00 1.75 0.00 0.00 2.93 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.37 1.42 7.81 123 A 8.44 4.97 1.18 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 0.00 124 G 9.57 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 0.00 0.00 0.00 0.00 125 L 8.35 5.26 0.00 1.60 1.53 0.96 0.92 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 0.00 126 E 9.21 4.60 0.00 2.01 1.71 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 2.21 2.28 0.00 127 N 9.73 4.32 0.00 2.88 2.85 0.00 0.00 7.02 7.65 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 0.00 128 G 8.24 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 0.00 129 V 7.70 4.87 2.19 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 0.94 0.00 0.00 0.98 0.00 0.00 130 L 9.11 5.07 0.00 1.75 1.49 0.98 0.64 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 0.00 131 T 9.32 5.10 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 0.00 132 V 9.13 4.83 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 1.07 0.00 0.00 0.90 0.00 0.00 133 T 8.98 4.77 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 1.24 0.00 0.00 134 V 8.84 4.23 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 1.01 0.00 0.00 1.07 0.00 0.00 135 P 0.00 4.78 0.00 2.13 1.98 0.00 3.66 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 2.28 2.16 0.00 136 K 8.79 4.59 0.00 1.72 1.74 0.00 1.91 0.00 0.00 1.83 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.42 7.81 137 A 9.00 3.90 1.39 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 0.00 0.00 0.00 *146 A 7.55 4.18 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 0.00 147 I 7.85 4.67 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 0.71 0.91 0.00 0.00 148 Q 8.50 4.29 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.35 2.37 0.00 149 I 7.71 4.53 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 1.47 0.58 0.91 0.00 0.00 150 S 8.61 4.15 0.00 3.91 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 0.00 151 G 7.91 4.15 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 0.00 0.00 0.00 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.