A0A5K4F5R7_SCHMA Loading...

1-phosphatidylinositol-3-phosphate 5-kinase

AlphaFold DB , UniProt , Accession A0A5K4F5R7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 2,681 aa.

						>A0A5K4F5R7_SCHMA|A0A5K4F5R7
MKSISESGGYVSFGLPEFENSQRNSGFLKRFVNKLTSRASFHTEDDKNKFQSTKVTQISSDSKNENKLSHNSLSTLDENISDGVSSSSHNQLPGSIRPPERRYWMQDENCKFCFECGTRFTAIRRKHHCRVCGRIFCNQCSNQIVEGTQIGLDGLQRACSYCAETLISTNTNKPEHSLDKNSVRSLNTDNIHGLKKKISLLEKTQRNNTRPKSVPSHVSHLSNLNIRMSTGLLNISNSKASLTSPSYLNRIAVDLASPNNSTSTSSADECRDLFPTFFSATFPNGNNASPSLDSIRQTMHTVESSTFGVIRRTPRISQGLVLNESLNIDIFSAPFKKISSSHSFECLPSSASQSLFNPSSGQDILYLWSRLWANSPKDLEFSTISISQLTASSTGPLSRVHSHSNENLTQDNSSCKSLQLFRLKNENEEYYCTYGLVLVHWLVNNVPELERCRMKGRLLCQKFMDLGLLTDLQNPNCKQFHDNFTFYKLKQIDSNSRLYDQTNSRRKTVDFTSFYNNFNVNSTSTIDTTYSSILGIHEPNWLLEINSSENESSRSSTPYLIEGFNDFKSKPPGVRPSFEVGKDVSRMRDCSLESLGSTQKWKYTTQPTLTNHQQPIDFSVQLNTSLEMNTDEYMCNMKNIFDKHIYRLVLQDVRDNVLDSSWASILIRLAWNVCQTVHFDLRSTGLRYFQFNRQQKQQSQSNNETVKNNDVQKSVMNSNTVHKQQVYSPMDIRYYVHIKKLLDEDNKKSDLFPGLIFSKRPTHKLMPTVLNNPRILLLDSSISYQRTTSKMTWLESQIMQEEEYITNCVCKILCLHPNIIFVSGTVCYLAQNFIFKSGIILFSNVKQSVLYRIARMTGADILDSIDRLMSNPSRKSDNNTQKSATRLGVCNHFEVRQLHLPDDSTKFLTFIKNNSTETGLALDSNPIRYITREATVILRDNDLASLIRAKRCFLFTLRLCYNAQLELAYSNNDHIFQLPHLLLNTDTHSRSRVKSLNKMCLQNDAEYPPFPSPVSRKKALSDLNGSVISISSTIEKTSISNDEYDKNPCSDLAMYLQGRLLSVSPSVEFRLPYLASREGQLSYLYPYYTYVIDWPLGRRLNDLMKRKEKILNSELTALKYDMINAKLYNYPSKHISSNESSHPFTKCNLEMFSSPTLYNSKLSRLLPYFLSDNNDNNDSFRKNNFAIDGLIISETLTSSDEALYTDYKARGFMNNNNKQRIIESRRSFPRLWAGMNSILSGHWNSLFNTRHLRSFKSGPTTTSTTTTGFTPTSNMQLISETESVKRLRRSILDPRSYQSLSFLAILFTTKCIMRPEPCVPPLIATVEFYGSSDLPLGLFLEKFCFMQQHCRNPLCNVVMADHIQRFIQTSGSVQLMIRQLIQDPPRSEVLSDIPNQGSNDAKYRRPCRIQMWLFCPICRINSPIKHMSADTWHLSFVKFLDLIINSSDNLAYCGLFNKTSDDTVSEVNTTDASNEPSLNSVRYGIENQTMSPILQFQCPHSVYKCLEHCFAFNRKLAIFKYQPVNVYEIVMPPSEIRVFPVKADNLKSESTRMLTTKKLTTEGHMNTTNLEDGYCADTTDHTTANATKSHSQSNHKWGSKVTNLEKSSHLPSYLYTEASDVLTKYYTINTVIKCHIANQQNEKLSCELSAMLEAYLKVLECDSTRILMDERSEILDFILHPSDSCQRERLSNKQYIEDIPAGISHSLGSLTKPVEDDSEPNTVENEKMFTPDKQILTTDEKISCATTIQSRARTHSNSISSVHNGSSETTEQRYDVSQNETKCHNWFKLISSLNNVEQALIVQRLINELKRWMYRFVSDWNFRFNEYELLMKRLEKNIRDKRKKPTLSHISTTVANSSLHPSPNLLSPSVPSQVTVTTSVSPPPPTTTSLPVSSIITSSKSANNLLDSTKSSEHNNDMITNLSSSNIPIEVSTSQTVYFNSVDQNMNKFLTIIDLSNNISVNSKTSLNNVLTVSQPELLVQSIKRDSEMHKSIENTSRLDSFKSGFNSFHDSINHDSSQHTEDNYASDLSKNLPILDPLNLKAVYQRRGPEIFNIESSQNQSNKTESSAHPIQSEISMANNSSSSGVRRFIHNFLPSAMDLKVFGEPVPPYEHPQLTICDESCINILKRIETTVNKSNQIKLNSCDYSRLSESICQLLLAHPDVYVNDREFTSIIAFALTTREYERKLVDLHFTLQGSLQQSSDVQLGQPALANVKDNESVVITENMSSAKCIDEKERINILDDETSLPNPTDDGSSKKSETSQEESNRISSSSSVSTLRDQKPPTHTHNISASSHTTSLSTPTTDKSNGSRSRHIKIQFSDSSTTFFCCVYYASEFFRLRQLIMPNGDLSFIQSLSRCYQWDARGGKSGSLFMKTRDERFVIKELSSIEMKTFHEISQDYFDYLITAALEQRLCVLSRILGIFHVGFKNSTSGEAHRFDVLVMENLYYGRTQLAYIYDLKGSLRKRLVDESSNNGMNANSTTTNAIMPADLAQTTDETTTNSGVASYHSFTCNQSTTVSDSGLTSETTTVKHNVPVLLDQNLLNASIDNPLYLRVHSKNALSHCLNMDTAFLANLFIMDYSLLVGVDTTTNQLIIGLIDYLRKFTLDKRLEMIIKQTITSAQGPMPTILTPDLYRERFLYQLHSYFPLLPDQWYDSLAEHTENWRVSSIQRKSLSVNKTK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.4	Very low	19.7	Very low	214 Å²	214	136.8 Å²	136.8	100%	1.054	78%	0.776	S	S	*	*				0	153.3	0	-80.4	143.3	159	0	0	108.1	S3	M1-S3 VanDerWaalsContact CB-OG 3.3Å; M1-S3 WeakPolarHBondContact CB-OG 3.17Å; M1-S3 WeakPolarHBondContact CG-OG 3.5Å
2	K	18.6	Very low	19.5	Very low	216 Å²	216	133.9 Å²	133.9	94%	0.939	77%	0.771	S	S	*	*			cis	53.5	62.6	-1.4	-152.4	-169.8	-176.6	-171.1	0	117.5
3	S	20.3	Very low	19.5	Very low	63 Å²	63	139 Å²	139	44%	0.441	78%	0.779	S	S	.	*			trans	171.8	144.1	158.7	53.5	0	0	0	0	107.7	M1	M1-S3 VanDerWaalsContact CB-OG 3.3Å; M1-S3 WeakPolarHBondContact CB-OG 3.17Å; M1-S3 WeakPolarHBondContact CG-OG 3.5Å
4	I	20	Very low	19.4	Very low	150 Å²	150	133.2 Å²	133.2	77%	0.769	77%	0.766	S	S	*	*			trans	65.2	100.5	166.1	-60.1	157.2	0	0	0	112.3
5	S	19.2	Very low	20.3	Very low	91 Å²	91	135.3 Å²	135.3	64%	0.636	77%	0.773	S	S	*	*				69.2	139	63.4	80.6	0	0	0	0	114.2
6	E	19.1	Very low	20.6	Very low	169 Å²	169	133.3 Å²	133.3	79%	0.79	77%	0.766	S	S	*	*			trans	30	101.3	151.8	-73.8	142	-157.5	0	0	117.6
7	S	19.8	Very low	20.5	Very low	113 Å²	113	134.8 Å²	134.8	79%	0.79	77%	0.765	S	S	*	*				65.1	102.8	83.1	73.9	0	0	0	0	114.2
8	G	19	Very low	20.5	Very low	82 Å²	82	138.8 Å²	138.8	85%	0.845	77%	0.773	S	S	*	*			trans	129.4	117.2	163.7	0	0	0	0	0	115.1
9	G	18.8	Very low	20.4	Very low	67 Å²	67	139.5 Å²	139.5	69%	0.691	77%	0.77	S	S	*	*			trans	103.3	159.7	151.9	0	0	0	0	0	118.2
10	Y	18.2	Very low	20.4	Very low	222 Å²	222	141.1 Å²	141.1	87%	0.871	78%	0.777	S	S	*	*			trans	62.9	84.5	171	-58.8	-75.7	0	0	0	116.4
11	V	18.7	Very low	20.4	Very low	118 Å²	118	139 Å²	139	72%	0.715	77%	0.772	S	S	*	*				85.3	135.4	65.5	173	0	0	0	0	112.5
12	S	17.9	Very low	20.2	Very low	102 Å²	102	136.5 Å²	136.5	71%	0.713	76%	0.758	S	S	*	*			trans	-89.3	121.5	-170.5	41.8	0	0	0	0	114.2
13	F	18.9	Very low	20.3	Very low	200 Å²	200	137.1 Å²	137.1	88%	0.877	75%	0.754	S	S	*	*			trans	-102.2	152	150	-59.6	-98.1	0	0	0	106.8
14	G	19	Very low	20.2	Very low	58 Å²	58	141.1 Å²	141.1	60%	0.598	77%	0.771	S	S	*	*			cis	143.6	130.3	6.8	0	0	0	0	0	108.6
15	L	32.6	Very low	20.2	Very low	164 Å²	164	138.7 Å²	138.7	86%	0.859	77%	0.767	S	S	*	*			trans	-60.4	148.1	155.9	-82.6	136.4	0	0	0	107.6
16	P	25.5	Very low	20.2	Very low	103 Å²	103	138.2 Å²	138.2	67%	0.669	78%	0.777	S	S	*	*				-147.5	165.6	50.2	42.1	-22.9	0	0	0	118.6
17	E	17.8	Very low	20.3	Very low	159 Å²	159	139.1 Å²	139.1	74%	0.743	78%	0.778	S	S	*	*			trans	17.7	124.4	131.7	-53.3	161.9	139	0	0	119.3
18	F	21.5	Very low	20.4	Very low	208 Å²	208	139.9 Å²	139.9	91%	0.912	77%	0.773	S	S	*	*			trans	-134.5	96.3	134.5	-117.1	-78.3	0	0	0	110.4
19	E	18.9	Very low	20.6	Very low	152 Å²	152	146.2 Å²	146.2	71%	0.71	78%	0.777	S	S	*	*			trans	15.7	129.5	164.6	-57.8	-167.2	112.9	0	0	122.9	S21	E19-S21 PolarHBondContact O-N 3.31Å; E19-S21 VanDerWaalsContact O-N 3.13Å
20	N	20.8	Very low	20.7	Very low	171 Å²	171	154 Å²	154	91%	0.914	79%	0.785	S	S	*	*			trans	-65	91.6	140	-85.5	-68.9	0	0	0	110.6	Q22	N20-Q22 PolarHBondContact O-N 3.06Å
21	S	20.4	Very low	20.9	Very low	96 Å²	96	150.9 Å²	150.9	67%	0.671	78%	0.777	S	S	*	*			trans	-93.6	77.1	169.1	76.8	0	0	0	0	112.6	E19	E19-S21 PolarHBondContact O-N 3.31Å; E19-S21 VanDerWaalsContact O-N 3.13Å
22	Q	19.4	Very low	21.4	Very low	163 Å²	163	148.9 Å²	148.9	76%	0.762	77%	0.765	S	S	*	*			trans	51.2	121	146.7	-55.5	-162.6	27	0	0	121.4	N20 N24	N20-Q22 PolarHBondContact O-N 3.06Å; Q22-N24 PolarHBondContact O-N 3.18Å
23	R	20.1	Very low	21.6	Very low	228 Å²	228	152.1 Å²	152.1	86%	0.86	77%	0.774	S	S	*	*				24.9	90.1	111.9	-57.7	173.5	176.9	171.3	-1.6	116.5
24	N	19.7	Very low	22.3	Very low	148 Å²	148	150.6 Å²	150.6	79%	0.791	77%	0.767	S	S	*	*			trans	-123.7	106.3	136	-93.8	-50.2	0	0	0	106.9	Q22	Q22-N24 PolarHBondContact O-N 3.18Å
25	S	19.8	Very low	22.4	Very low	99 Å²	99	154.8 Å²	154.8	69%	0.692	78%	0.775	S	S	*	*				74.2	139.3	75.1	82.8	0	0	0	0	110.9
26	G	19.2	Very low	21.9	Very low	81 Å²	81	150.9 Å²	150.9	84%	0.835	76%	0.758	S	S	*	*			trans	-72.7	135.2	-153.7	0	0	0	0	0	114.4
27	F	20.7	Very low	21.8	Very low	188 Å²	188	151.2 Å²	151.2	83%	0.825	76%	0.763	S	S	*	*	S	Bend	trans	-123.7	-39.3	167.2	-141.5	-105	0	0	0	114.1
28	L	22.5	Very low	22	Very low	128 Å²	128	154.4 Å²	154.4	67%	0.67	77%	0.768	S	S	*	*	S	Bend	trans	-125	8.7	-162.2	-102.7	159.5	0	0	0	118	R30 F31	L28-R30 VanDerWaalsContact C-N 3.28Å; L28-R30 PolarHBondContact O-N 3.19Å; L28-F31 HydrophobicContact CD2-CB 4.3Å; L28-F31 WeakPolarHBondContact CD2-O 3.3Å
29	K	21.7	Very low	22.2	Very low	215 Å²	215	146.9 Å²	146.9	94%	0.935	74%	0.744	S	S	*	*	S	Bend	trans	-82.3	3.8	172.8	-148.2	174.5	-177.6	177.9	0	114.6
30	R	21.7	Very low	22.6	Very low	230 Å²	230	141.6 Å²	141.6	87%	0.868	72%	0.724	S	S	*	*	S	Bend	trans	-139.3	-6.1	174.7	-77.6	-174.1	168.7	155.3	-4	115.4	L28 N33	L28-R30 VanDerWaalsContact C-N 3.28Å; L28-R30 PolarHBondContact O-N 3.19Å; R30-N33 PolarHBondContact O-N 3.12Å
31	F	22.3	Very low	22.9	Very low	157 Å²	157	138.6 Å²	138.6	69%	0.689	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	69.9	-177.4	-155.2	-77.8	0	0	0	109.9	L28	L28-F31 HydrophobicContact CD2-CB 4.3Å; L28-F31 WeakPolarHBondContact CD2-O 3.3Å
32	V	29.3	Very low	23	Very low	76 Å²	76	139.8 Å²	139.8	46%	0.461	70%	0.698	S	S	.	*	T	Hydrogen-bonded Turn		-156.8	110.9	51.2	134.3	0	0	0	0	110.5	K34 L35	V32-K34 WeakPolarHBondContact CG1-O 3.14Å; V32-K34 VanDerWaalsContact CG2-O 3.29Å; V32-K34 WeakPolarHBondContact CG2-O 3.34Å; V32-L35 HydrophobicContact CG1-CB 4.31Å; V32-L35 WeakPolarHBondContact CG1-O 3.44Å
33	N	22.8	Very low	23.1	Very low	170 Å²	170	135.9 Å²	135.9	91%	0.909	69%	0.685	S	S	*	*	S	Bend	trans	-96.5	30.6	155.2	-140	12.5	0	0	0	109.3	R30	R30-N33 PolarHBondContact O-N 3.12Å
34	K	32	Very low	23.2	Very low	168 Å²	168	132.1 Å²	132.1	73%	0.73	68%	0.678	S	S	*	*	S	Bend	trans	-162	83.3	-158.2	-166.3	171.1	-172.7	177.5	0	110	V32	V32-K34 WeakPolarHBondContact CG1-O 3.14Å; V32-K34 VanDerWaalsContact CG2-O 3.29Å; V32-K34 WeakPolarHBondContact CG2-O 3.34Å
35	L	22.3	Very low	23.3	Very low	147 Å²	147	131.9 Å²	131.9	77%	0.77	68%	0.676	S	S	*	*	S	Bend	trans	100.8	71.9	-165.7	-61.6	176.4	0	0	0	115.2	V32	V32-L35 HydrophobicContact CG1-CB 4.31Å; V32-L35 WeakPolarHBondContact CG1-O 3.44Å
36	T	21.5	Very low	23.5	Very low	81 Å²	81	132 Å²	132	50%	0.497	67%	0.669	S	S	.	*			cis	-156.2	162.5	1.8	41.2	0	0	0	0	105.9	R38	T36-R38 VanDerWaalsContact CB-N 3.33Å; T36-R38 PolarHBondContact O-N 3.22Å; T36-R38 WeakPolarHBondContact OG1-CB 3.06Å; T36-R38 PolarHBondContact OG1-N 3Å
37	S	24	Very low	23.6	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	66%	0.661	S	S	*	*				42.1	15.3	56.8	52.5	0	0	0	0	116.3
38	R	21.4	Very low	23.6	Very low	225 Å²	225	133.6 Å²	133.6	85%	0.849	66%	0.66	S	S	*	*	S	Bend	trans	-144.8	94.6	169.7	-158.2	170.6	-170.1	132	0.2	110.3	T36	T36-R38 VanDerWaalsContact CB-N 3.33Å; T36-R38 PolarHBondContact O-N 3.22Å; T36-R38 WeakPolarHBondContact OG1-CB 3.06Å; T36-R38 PolarHBondContact OG1-N 3Å
39	A	25.5	Very low	23.6	Very low	50 Å²	50	135.9 Å²	135.9	41%	0.413	66%	0.664	S	S	.	*	S	Bend	cis	-150.9	156.7	-2.5	0	0	0	0	0	107.8	K196	A39-K196 WeakPolarHBondContact O-CB 3.31Å; A39-K196 WeakPolarHBondContact O-CD 2.9Å; A39-K196 VanDerWaalsContact O-CG 3.27Å; A39-K196 WeakPolarHBondContact O-CG 3.26Å
40	S	28.1	Very low	23.5	Very low	42 Å²	42	133.3 Å²	133.3	29%	0.294	65%	0.653	S	S	.	*			cis	-146.8	175.2	-33.6	-78	0	0	0	0	109	K196 I198	S40-K196 WeakPolarHBondContact O-CD 3.32Å; S40-I198 VanDerWaalsContact O-O 3.11Å
41	F	25.9	Very low	23.4	Very low	108 Å²	108	130 Å²	130	47%	0.474	65%	0.648	S	S	.	*			trans	60.4	165.6	171.3	-56.7	-97	0	0	0	118.5	K196 I198 S199	F41-K196 PolarHBondContact O-NZ 3.3Å; F41-I198 HydrophobicContact CB-CG2 4.48Å; F41-S199 WeakPolarHBondContact CD2-OG 3.37Å; F41-S199 WeakPolarHBondContact CE2-OG 3.45Å; F41-S199 WeakPolarHBondContact CG-OG 3.23Å; F41-S199 WeakPolarHBondContact CZ-OG 3.34Å
42	H	22.8	Very low	23.3	Very low	121 Å²	121	127.1 Å²	127.1	56%	0.56	65%	0.647	S	S	*	*				-143.5	138.9	-65.8	-115.5	-87.9	0	0	0	105
43	T	21.6	Very low	22.9	Very low	81 Å²	81	128.7 Å²	128.7	50%	0.497	66%	0.657	S	S	.	*				35.9	151.8	101.5	92.3	0	0	0	0	115.7
44	E	21.9	Very low	22.7	Very low	149 Å²	149	129.3 Å²	129.3	70%	0.696	65%	0.652	S	S	*	*			cis	-153.6	163.5	7.7	-147.2	133.2	-129.9	0	0	110.3
45	D	23.1	Very low	22	Very low	142 Å²	142	126.8 Å²	126.8	76%	0.759	65%	0.65	S	S	*	*			trans	54.4	158.9	148.8	-78.5	6.6	0	0	0	122.4
46	D	22.5	Very low	21.8	Very low	102 Å²	102	125 Å²	125	55%	0.545	65%	0.646	S	S	.	*			cis	-149.3	179.4	-36.5	-163.2	19.4	0	0	0	109.7	N48	D46-N48 PolarHBondContact O-N 3.21Å
47	K	21.7	Very low	21.7	Very low	153 Å²	153	129.2 Å²	129.2	67%	0.665	66%	0.659	S	S	*	*			trans	-32.9	123.4	159.2	-52.8	158.2	-147.6	72	0	112
48	N	21.6	Very low	21.3	Very low	150 Å²	150	129.9 Å²	129.9	80%	0.802	65%	0.653	S	S	*	*				-167.4	151.4	104.5	-103.8	-58	0	0	0	116.8	D46	D46-N48 PolarHBondContact O-N 3.21Å
49	K	22.1	Very low	21.2	Very low	175 Å²	175	124.3 Å²	124.3	76%	0.761	65%	0.648	S	S	*	*			trans	-22.9	157.4	165.9	-87.2	175.1	173.8	176.5	0	120.9
50	F	19.9	Very low	21	Very low	161 Å²	161	125.9 Å²	125.9	71%	0.706	66%	0.657	S	S	*	*			trans	98.9	119.1	141.1	-106.7	-120.7	0	0	0	119.6
51	Q	20	Very low	20.6	Very low	162 Å²	162	130.6 Å²	130.6	76%	0.757	68%	0.678	S	S	*	*			trans	51.9	133.9	135	-79.1	-170.8	-19.6	0	0	122.6
52	S	20.6	Very low	20.4	Very low	96 Å²	96	130.8 Å²	130.8	67%	0.671	69%	0.693	S	S	*	*			trans	96.6	146.3	131.1	-165.3	0	0	0	0	119.9
53	T	20.3	Very low	20.2	Very low	108 Å²	108	133.8 Å²	133.8	66%	0.663	71%	0.705	S	S	*	*			trans	65.2	108.6	148.2	30.7	0	0	0	0	121
54	K	18.2	Very low	20.1	Very low	184 Å²	184	135.1 Å²	135.1	80%	0.8	71%	0.709	S	S	*	*				68.2	145.3	111.6	-86.7	-170.1	177.7	-177	0	120.9
55	V	18.1	Very low	19.9	Very low	115 Å²	115	135 Å²	135	70%	0.697	71%	0.708	S	S	*	*			trans	71.5	93.4	136.3	170.8	0	0	0	0	117
56	T	17.9	Very low	19.9	Very low	110 Å²	110	134.3 Å²	134.3	68%	0.675	70%	0.704	S	S	*	*				44.8	146.6	121.9	29.5	0	0	0	0	122.7
57	Q	18.3	Very low	19.8	Very low	168 Å²	168	138.2 Å²	138.2	79%	0.785	72%	0.717	S	S	*	*			trans	72.2	156.2	150.9	-71.7	176.9	-10.6	0	0	115.5
58	I	17	Very low	19.8	Very low	126 Å²	126	138.1 Å²	138.1	65%	0.646	72%	0.723	S	S	*	*			cis	-153.5	149.2	-14.7	-121.5	162.8	0	0	0	109.3
59	S	18.9	Very low	19.7	Very low	107 Å²	107	134.6 Å²	134.6	75%	0.748	71%	0.71	S	S	*	*			trans	52.2	-165.5	164.6	70.3	0	0	0	0	115.5
60	S	20.6	Very low	19.7	Very low	84 Å²	84	133.6 Å²	133.6	59%	0.587	71%	0.708	S	S	*	*			cis	-147.4	-177.9	-4.4	41.1	0	0	0	0	110.8
61	D	20.6	Very low	19.8	Very low	140 Å²	140	132 Å²	132	75%	0.749	71%	0.707	S	S	*	*			trans	74.2	100.2	154.1	-52.4	-50.4	0	0	0	119.7
62	S	20.6	Very low	19.8	Very low	113 Å²	113	129.5 Å²	129.5	79%	0.79	71%	0.707	S	S	*	*				-159.8	117.2	104.8	15.7	0	0	0	0	114.7
63	K	19.6	Very low	19.8	Very low	183 Å²	183	132.6 Å²	132.6	80%	0.796	72%	0.715	S	S	*	*			trans	74.5	120.3	132.9	-71.8	-160.1	172.5	-167.3	0	122.1
64	N	18.4	Very low	19.9	Very low	110 Å²	110	131.4 Å²	131.4	59%	0.588	71%	0.711	S	S	*	*			trans	75.1	136.9	136.8	-66.3	60.3	0	0	0	117.7
65	E	18.2	Very low	20	Very low	147 Å²	147	128.7 Å²	128.7	69%	0.687	71%	0.71	S	S	*	*			cis	160.7	117.1	-13.9	-111.3	163.7	-152	0	0	103.7
66	N	22.9	Very low	20.2	Very low	126 Å²	126	131 Å²	131	67%	0.674	72%	0.717	S	S	*	*			trans	161.2	107.7	130.4	-94	-77.8	0	0	0	112.8
67	K	20.1	Very low	20.4	Very low	184 Å²	184	132.2 Å²	132.2	80%	0.8	72%	0.72	S	S	*	*			trans	67.6	161	148.1	-57.3	175.5	-176.4	179.9	0	116.1
68	L	22	Very low	20.7	Very low	151 Å²	151	132.5 Å²	132.5	79%	0.791	72%	0.721	S	S	*	*			cis	-139.9	172.1	-3.6	-156.4	66.2	0	0	0	110.3
69	S	19.2	Very low	20.9	Very low	77 Å²	77	134 Å²	134	54%	0.538	73%	0.73	S	S	.	*			trans	-78.5	152.4	177.7	45.5	0	0	0	0	114.7
70	H	23.2	Very low	21.2	Very low	154 Å²	154	135.7 Å²	135.7	71%	0.713	73%	0.73	S	S	*	*				179.9	148.6	102.2	-96.5	-67.7	0	0	0	116.1
71	N	22.3	Very low	21.3	Very low	128 Å²	128	136.7 Å²	136.7	68%	0.684	74%	0.737	S	S	*	*			trans	39.6	114.7	144.6	-60.1	14.5	0	0	0	123.1
72	S	19.7	Very low	21.5	Very low	109 Å²	109	138 Å²	138	76%	0.762	74%	0.744	S	S	*	*				49.1	128.3	106.4	-42.8	0	0	0	0	123.8
73	L	20.5	Very low	21.4	Very low	160 Å²	160	136.5 Å²	136.5	84%	0.838	75%	0.746	S	S	*	*			trans	89.7	126.5	132.1	-126.8	74.4	0	0	0	122.9
74	S	20.8	Very low	21.5	Very low	84 Å²	84	134.8 Å²	134.8	59%	0.587	75%	0.75	S	S	*	*			trans	54.5	118	137.1	61.8	0	0	0	0	123.8
75	T	22	Very low	21.6	Very low	126 Å²	126	134.6 Å²	134.6	77%	0.773	76%	0.758	S	S	*	*			trans	53	116.7	131.4	61.2	0	0	0	0	121.5
76	L	21.6	Very low	21.7	Very low	163 Å²	163	132.6 Å²	132.6	85%	0.853	76%	0.76	S	S	*	*				-173.6	179.1	123.5	-100.6	163.3	0	0	0	110.8
77	D	23	Very low	21.6	Very low	137 Å²	137	132 Å²	132	73%	0.733	77%	0.766	S	S	*	*			trans	-94.2	167.7	-153.4	-60.3	-66.5	0	0	0	118.5
78	E	23.2	Very low	21.7	Very low	173 Å²	173	127.5 Å²	127.5	81%	0.808	76%	0.757	S	S	*	*			trans	20.8	128.2	156	-61.2	-173.9	148.5	0	0	121.7
79	N	22.1	Very low	21.8	Very low	157 Å²	157	127.9 Å²	127.9	84%	0.84	76%	0.755	S	S	*	*				-170.8	158.7	114.4	-105.7	-73.7	0	0	0	116
80	I	24.1	Very low	22	Very low	144 Å²	144	130.6 Å²	130.6	74%	0.738	76%	0.763	S	S	*	*			trans	-78.3	149.8	-155.2	-70.1	161.5	0	0	0	118.2
81	S	23.8	Very low	22.1	Very low	104 Å²	104	132.2 Å²	132.2	73%	0.727	77%	0.771	S	S	*	*			trans	77.5	119.9	152.2	66.4	0	0	0	0	124.2
82	D	23.4	Very low	22.1	Very low	168 Å²	168	133.2 Å²	133.2	90%	0.898	78%	0.776	S	S	*	*			trans	33.3	116.4	138.1	-66.4	-4.7	0	0	0	123.1
83	G	19.8	Very low	22.5	Very low	81 Å²	81	133.2 Å²	133.2	84%	0.835	77%	0.773	S	S	*	*			trans	-160.4	100.2	157.6	0	0	0	0	0	112.4
84	V	21.9	Very low	22.8	Very low	147 Å²	147	128.5 Å²	128.5	89%	0.891	76%	0.763	S	S	*	*			trans	-116.3	123.1	-176.9	175.2	0	0	0	0	111.5
85	S	19.8	Very low	23	Very low	106 Å²	106	129.8 Å²	129.8	74%	0.741	77%	0.772	S	S	*	*			trans	-159.7	150.5	161.6	68.2	0	0	0	0	115.9
86	S	20.3	Very low	23.4	Very low	106 Å²	106	129.2 Å²	129.2	74%	0.741	76%	0.763	S	S	*	*			trans	87.2	147	148.1	83.7	0	0	0	0	122.4
87	S	21.8	Very low	23.7	Very low	112 Å²	112	130.9 Å²	130.9	78%	0.783	76%	0.758	S	S	*	*			trans	74.8	143.1	165.2	81.2	0	0	0	0	119.5
88	S	21.7	Very low	24.2	Very low	90 Å²	90	128 Å²	128	63%	0.629	75%	0.747	S	S	*	*			cis	-165.3	158.2	-23	58	0	0	0	0	113.5
89	H	23.7	Very low	24.8	Very low	160 Å²	160	124.1 Å²	124.1	74%	0.741	74%	0.737	S	S	*	*			trans	63.7	152.6	151.9	-62.3	-40.3	0	0	0	120.9
90	N	24.1	Very low	25.5	Very low	133 Å²	133	123 Å²	123	71%	0.711	73%	0.726	S	S	*	*			cis	-163	116.3	-16.7	-104.9	-12.2	0	0	0	111.4
91	Q	25.3	Very low	26.4	Very low	189 Å²	189	124.2 Å²	124.2	88%	0.883	72%	0.722	S	S	*	*			trans	-151.6	140.4	155.4	-71.5	-166.1	-0	0	0	109	P93	Q91-P93 VanDerWaalsContact O-CD 3.3Å; Q91-P93 WeakPolarHBondContact O-CD 3.47Å
92	L	22.3	Very low	27.6	Very low	148 Å²	148	129.2 Å²	129.2	78%	0.775	73%	0.725	S	S	*	*	P	Polyproline II helix	trans	-72.8	122	-172.7	-82.5	99.9	0	0	0	113.5
93	P	27.5	Very low	29.6	Very low	110 Å²	110	127.6 Å²	127.6	71%	0.714	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-74.7	144.7	167.3	-12.9	30.7	0	0	0	111.6	Q91	Q91-P93 VanDerWaalsContact O-CD 3.3Å; Q91-P93 WeakPolarHBondContact O-CD 3.47Å
94	G	27	Very low	32.7	Very low	61 Å²	61	129.7 Å²	129.7	63%	0.629	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-75.8	167.9	178.4	0	0	0	0	0	114.1	I96	G94-I96 PolarHBondContact O-N 2.73Å
95	S	24.9	Very low	35.8	Very low	110 Å²	110	123.7 Å²	123.7	77%	0.769	65%	0.652	S	S	*	*			trans	-35.7	102	-179.5	-177.7	0	0	0	0	113.9	R97	S95-R97 PolarHBondContact O-N 2.79Å; S95-R97 VanDerWaalsContact O-N 3.1Å
96	I	31.1	Very low	38.8	Very low	115 Å²	115	124.1 Å²	124.1	59%	0.59	64%	0.643	S	S	*	*			trans	-65.7	111.6	171	-63.8	173.8	0	0	0	107.1	G94	G94-I96 PolarHBondContact O-N 2.73Å
97	R	27.1	Very low	41.8	Very low	198 Å²	198	122.4 Å²	122.4	75%	0.747	63%	0.625	S	S	*	*	P	Polyproline II helix	trans	-56.6	127.4	162.4	-70.6	-178.9	173.9	-164.8	-3.9	106.7	S95	S95-R97 PolarHBondContact O-N 2.79Å; S95-R97 VanDerWaalsContact O-N 3.1Å
98	P	32.9	Very low	44.4	Very low	77 Å²	77	121.8 Å²	121.8	50%	0.5	61%	0.61	S	S	.	*	P	Polyproline II helix	trans	-55	132.3	173.3	24	-32.9	0	0	0	107.8	E100	P98-E100 PolarHBondContact O-N 2.67Å
99	P	36.1	Very low	47.3	Very low	90 Å²	90	120.9 Å²	120.9	58%	0.584	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-57.5	132.7	-176.2	23	-33	0	0	0	109.2	R101	P99-R101 PolarHBondContact O-N 3.17Å; P99-R101 VanDerWaalsContact O-N 3.09Å
100	E	37.4	Very low	50.1	Low	134 Å²	134	113.7 Å²	113.7	63%	0.626	57%	0.565	S	S	*	*	P	Polyproline II helix	trans	-53.4	122	179.4	-71.1	-178	-173.6	0	0	109.3	P98 R102	P98-E100 PolarHBondContact O-N 2.67Å; E100-R102 VanDerWaalsContact C-N 3.32Å; E100-R102 HydrophobicContact CB-CG 4.34Å; E100-R102 PolarHBondContact O-N 2.98Å; E100-R102 IonicContact OE2-CZ 2.7Å; E100-R102 VanDerWaalsContact OE2-CZ 3.25Å; E100-R102 IonicContact OE2-NE 2.76Å; E100-R102 PolarHBondContact OE2-NE 3.22Å; E100-R102 IonicContact OE2-NH2 3.09Å; E100-R102 PolarHBondContact OE2-NH2 3.49Å
101	R	43.8	Very low	53.3	Low	170 Å²	170	111.8 Å²	111.8	64%	0.642	55%	0.551	S	S	*	*	S	Bend	trans	-67.1	85.7	-170.3	-62.6	-177.9	-170.9	150.1	6	111.1	P99 I150 G151	P99-R101 PolarHBondContact O-N 3.17Å; P99-R101 VanDerWaalsContact O-N 3.09Å; R101-I150 PolarHBondContact NH2-O 2.85Å; R101-G151 PolarHBondContact NH2-O 3.07Å
102	R	47.9	Very low	56.6	Low	208 Å²	208	107.9 Å²	107.9	79%	0.785	53%	0.531	S	S	*	.			trans	-120.1	-0.2	-176.1	-64.7	179.9	-175.5	-124.5	7.9	114.1	E100	E100-R102 VanDerWaalsContact C-N 3.32Å; E100-R102 HydrophobicContact CB-CG 4.34Å; E100-R102 PolarHBondContact O-N 2.98Å; E100-R102 IonicContact OE2-CZ 2.7Å; E100-R102 VanDerWaalsContact OE2-CZ 3.25Å; E100-R102 IonicContact OE2-NE 2.76Å; E100-R102 PolarHBondContact OE2-NE 3.22Å; E100-R102 IonicContact OE2-NH2 3.09Å; E100-R102 PolarHBondContact OE2-NH2 3.49Å
103	Y	65.1	Low	60	Low	135 Å²	135	101 Å²	101	53%	0.529	50%	0.495	S	S	.	.			trans	-135.5	123.1	179.4	-168.5	-98.5	0	0	0	111.8	M105 R134	Y103-M105 HydrophobicContact CE1-CB 4Å; Y103-M105 HydrophobicContact CE1-CE 4.3Å; Y103-M105 WeakPolarHBondContact OH-CE 3.17Å; Y103-R134 HydrophobicContact CE1-CG 4.08Å
104	W	86.1	Confident	63.1	Low	125 Å²	125	100.5 Å²	100.5	47%	0.473	48%	0.482	S	S	.	.			trans	-138.9	115.1	168.8	-171.9	-90.9	0	0	0	107.1	Q106 H128	W104-Q106 PolarHBondContact O-N 3.4Å; W104-H128 AromaticContact CE2-CD2 3.43Å; W104-H128 VanDerWaalsContact CE2-CD2 3.43Å; W104-H128 AromaticContact CE2-CG 3.58Å; W104-H128 AromaticContact CE2-NE2 3.83Å; W104-H128 HydrophobicContact CH2-CB 3.4Å; W104-H128 AromaticContact CH2-CG 3.77Å; W104-H128 HydrophobicContact CZ2-CB 3.43Å; W104-H128 VanDerWaalsContact CZ2-CB 3.43Å; W104-H128 AromaticContact CZ2-CD2 3.6Å; W104-H128 AromaticContact CZ2-CG 3.21Å; W104-H128 AromaticContact CZ2-ND1 3.58Å; W104-H128 HydrophobicContact CZ3-CB 4.08Å; W104-H128 AromaticContact NE1-CD2 3.46Å; W104-H128 PolarHBondContact NE1-CD2 3.22Å; W104-H128 AromaticContact NE1-CE1 3.86Å; W104-H128 AromaticContact NE1-CG 3.94Å; W104-H128 AromaticContact NE1-NE2 3.39Å; W104-H128 PolarHBondContact NE1-NE2 2.78Å
105	M	86.2	Confident	66	Low	21 Å²	21	101.5 Å²	101.5	10%	0.103	47%	0.47	C	S	.	.			trans	-73.7	120.3	-179.1	-168.6	-175.9	-83.7	0	0	108.2	Y103 N109 C110 F114 H128 G133 R134 I135	Y103-M105 HydrophobicContact CE1-CB 4Å; Y103-M105 HydrophobicContact CE1-CE 4.3Å; Y103-M105 WeakPolarHBondContact OH-CE 3.17Å; M105-N109 HydrophobicContact CG-CB 4.3Å; M105-C110 HydrophobicContact SD-CB 3.79Å; M105-C110 VanDerWaalsContact SD-SG 3.67Å; M105-F114 HydrophobicContact CE-CD2 4.42Å; M105-H128 PolarHBondContact O-CD2 2.91Å; M105-H128 VanDerWaalsContact O-CD2 3.27Å; M105-H128 PolarHBondContact O-NE2 2.72Å; M105-G133 VanDerWaalsContact CB-O 3.27Å; M105-G133 WeakPolarHBondContact CB-O 2.96Å; M105-G133 PolarHBondContact N-O 2.93Å; M105-R134 HydrophobicContact CE-CB 4.31Å; M105-R134 HydrophobicContact CE-CG 4.08Å; M105-I135 HydrophobicContact CB-CD1 3.94Å; M105-I135 HydrophobicContact CB-CG1 4.31Å; M105-I135 HydrophobicContact CG-CD1 3.82Å; M105-I135 VanDerWaalsContact O-CD1 3.26Å; M105-I135 WeakPolarHBondContact O-CD1 3.3Å; M105-I135 HydrophobicContact SD-CB 4.16Å; M105-I135 HydrophobicContact SD-CD1 4.01Å; M105-I135 HydrophobicContact SD-CG1 4.34Å
106	Q	82.2	Confident	69.2	Low	115 Å²	115	99.1 Å²	99.1	54%	0.537	45%	0.453	S	S	.	.			trans	-62.5	143	173.3	-69.8	163.7	-39.7	0	0	110	W104 E108 N109 I135	W104-Q106 PolarHBondContact O-N 3.4Å; Q106-E108 PolarHBondContact O-N 3.08Å; Q106-N109 WeakPolarHBondContact O-CB 3.49Å; Q106-N109 PolarHBondContact O-N 3.02Å; Q106-N109 PolarHBondContact OE1-ND2 3.28Å; Q106-N109 VanDerWaalsContact OE1-ND2 3.11Å; Q106-I135 VanDerWaalsContact O-CD1 3.3Å; Q106-I135 WeakPolarHBondContact O-CD1 3.4Å
107	D	84	Confident	72	Confident	69 Å²	69	95.8 Å²	95.8	37%	0.369	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-55.2	-39.7	-177.5	-88.8	-49.2	0	0	0	112.8	N109 C110 K126 H128	D107-N109 PolarHBondContact O-N 3.25Å; D107-C110 PolarHBondContact O-N 2.89Å; D107-K126 HydrophobicContact CB-CD 4.03Å; D107-K126 WeakPolarHBondContact O-CD 3.34Å; D107-K126 PolarHBondContact O-NZ 2.96Å; D107-K126 WeakPolarHBondContact OD1-CB 3.48Å; D107-H128 IonicContact OD1-CE1 2.97Å; D107-H128 PolarHBondContact OD1-CE1 3.07Å; D107-H128 IonicContact OD1-NE2 2.8Å; D107-H128 IonicContact OD2-CE1 3.89Å; D107-H128 PolarHBondContact OD2-CE1 2.69Å
108	E	75.8	Confident	75	Confident	100 Å²	100	88.7 Å²	88.7	47%	0.467	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-53.1	-39.5	175.2	-57.7	175.1	163.7	0	0	111.9	Q106 C110 A2622 Q2623	Q106-E108 PolarHBondContact O-N 3.08Å; E108-C110 PolarHBondContact O-N 2.74Å; E108-C110 VanDerWaalsContact O-N 3.17Å; E108-A2622 HydrophobicContact CB-CB 4.01Å; E108-A2622 HydrophobicContact CG-CB 3.69Å; E108-A2622 WeakPolarHBondContact OE1-CB 3.19Å; E108-Q2623 HydrophobicContact CB-CG 4.37Å; E108-Q2623 WeakPolarHBondContact O-CG 3.38Å
109	N	82	Confident	77.7	Confident	70 Å²	70	93 Å²	93	37%	0.374	43%	0.432	S	S	.	.	G	3₁₀ helix	trans	-74.3	-0.3	-175.3	-82.5	-42.3	0	0	0	115.3	M105 Q106 D107 Q2623	M105-N109 HydrophobicContact CG-CB 4.3Å; Q106-N109 WeakPolarHBondContact O-CB 3.49Å; Q106-N109 PolarHBondContact O-N 3.02Å; Q106-N109 PolarHBondContact OE1-ND2 3.28Å; Q106-N109 VanDerWaalsContact OE1-ND2 3.11Å; D107-N109 PolarHBondContact O-N 3.25Å; N109-Q2623 WeakPolarHBondContact OD1-CG 3.09Å; N109-Q2623 PolarHBondContact OD1-NE2 2.76Å
110	C	84.3	Confident	80.5	Confident	9 Å²	9	89.6 Å²	89.6	6%	0.061	41%	0.408	C	S	.	.			trans	-125.5	106.9	-178.9	-148.7	0	0	0	0	111.9	M105 D107 E108 F112 F120 K126 I135	M105-C110 HydrophobicContact SD-CB 3.79Å; M105-C110 VanDerWaalsContact SD-SG 3.67Å; D107-C110 PolarHBondContact O-N 2.89Å; E108-C110 PolarHBondContact O-N 2.74Å; E108-C110 VanDerWaalsContact O-N 3.17Å; C110-F112 PolarHBondContact SG-O 3.02Å; C110-F120 HydrophobicContact CB-CE2 4.26Å; C110-K126 WeakPolarHBondContact O-CE 3.34Å; C110-K126 PolarHBondContact O-NZ 2.97Å; C110-I135 HydrophobicContact CB-CB 3.75Å; C110-I135 HydrophobicContact CB-CD1 3.65Å; C110-I135 HydrophobicContact CB-CG1 4.35Å; C110-I135 HydrophobicContact CB-CG2 3.78Å
111	K	90.2	Very high	82.9	Confident	93 Å²	93	86.9 Å²	86.9	40%	0.404	40%	0.4	S	S	.	.	S	Bend	trans	-89.8	-19.5	176.3	-72.7	171.7	175.9	161.1	0	113.1	R119 F120 S2621	K111-R119 WeakPolarHBondContact O-CG 3.28Å; K111-F120 PolarHBondContact O-N 2.9Å; K111-F120 VanDerWaalsContact O-N 3.14Å; K111-S2621 PolarHBondContact NZ-OG 2.84Å; K111-S2621 VanDerWaalsContact NZ-OG 3.1Å
112	F	93.9	Very high	84.8	Confident	107 Å²	107	83.4 Å²	83.4	47%	0.469	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-137.9	145.8	-173.5	-57.6	-85.4	0	0	0	110.1	C110 F114 G117 R119 F120	C110-F112 PolarHBondContact SG-O 3.02Å; F112-F114 PolarHBondContact O-N 2.87Å; F112-G117 WeakPolarHBondContact CB-O 3.05Å; F112-G117 WeakPolarHBondContact CD1-O 3.32Å; F112-R119 HydrophobicContact CD1-CB 3.72Å; F112-R119 HydrophobicContact CD1-CG 4.08Å; F112-R119 HydrophobicContact CE1-CB 3.79Å; F112-R119 HydrophobicContact CE1-CG 3.9Å; F112-F120 VanDerWaalsContact O-CE2 3.31Å; F112-F120 WeakPolarHBondContact O-CE2 3.46Å
113	C	94.1	Very high	86.3	Confident	3 Å²	3	81.1 Å²	81.1	2%	0.02	41%	0.41	C	S	.	.			trans	-56.4	128.4	175.1	179.5	0	0	0	0	110.7	E115 G117 T118 F120 C137	C113-E115 PolarHBondContact O-N 3.16Å; C113-E115 VanDerWaalsContact O-N 3.11Å; C113-G117 VanDerWaalsContact O-CA 3.3Å; C113-G117 WeakPolarHBondContact O-CA 3.15Å; C113-G117 PolarHBondContact O-N 2.82Å; C113-T118 PolarHBondContact N-O 3.45Å; C113-F120 HydrophobicContact CB-CZ 4.12Å; C113-C137 HydrophobicContact CB-CB 4.23Å; C113-C137 PolarHBondContact SG-N 3.12Å
114	F	92.2	Very high	87.4	Confident	101 Å²	101	79.2 Å²	79.2	44%	0.443	40%	0.402	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-23.2	-176.4	-173.4	-87.2	0	0	0	114.1	M105 F112 R134 I135 F136	M105-F114 HydrophobicContact CE-CD2 4.42Å; F112-F114 PolarHBondContact O-N 2.87Å; F114-R134 HydrophobicContact CD2-CG 4.5Å; F114-R134 HydrophobicContact CG-CB 4.28Å; F114-I135 VanDerWaalsContact CB-O 3.23Å; F114-I135 WeakPolarHBondContact CB-O 3.04Å; F114-I135 PolarHBondContact N-O 3.38Å; F114-I135 VanDerWaalsContact N-O 3.1Å; F114-F136 HydrophobicContact CB-CD1 4.17Å; F114-F136 HydrophobicContact CB-CE1 3.88Å; F114-F136 HydrophobicContact CB-CZ 4.13Å; F114-F136 AromaticContact CD1-CE1 3.92Å; F114-F136 HydrophobicContact CD1-CE1 3.92Å; F114-F136 AromaticContact CD1-CZ 3.99Å; F114-F136 HydrophobicContact CD1-CZ 3.99Å; F114-F136 HydrophobicContact CG-CE1 4.34Å; F114-F136 HydrophobicContact CG-CZ 4.37Å
115	E	89.4	Confident	87.6	Confident	82 Å²	82	81.9 Å²	81.9	38%	0.383	41%	0.412	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	-55.2	-175.3	-165.1	158.1	-160.6	0	0	112.5	C113 F136 C140 Y161	C113-E115 PolarHBondContact O-N 3.16Å; C113-E115 VanDerWaalsContact O-N 3.11Å; E115-F136 HydrophobicContact CB-CD1 3.76Å; E115-F136 HydrophobicContact CB-CE1 3.86Å; E115-C140 HydrophobicContact CB-CB 3.95Å; E115-C140 HydrophobicContact CG-CB 4.42Å; E115-C140 WeakPolarHBondContact OE2-CB 3.16Å; E115-Y161 PolarHBondContact OE1-N 3.48Å
116	C	91.6	Very high	87.9	Confident	60 Å²	60	84.2 Å²	84.2	41%	0.405	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	6	-178.5	69.8	0	0	0	0	115.2	T118 C140	C116-T118 PolarHBondContact O-N 2.89Å; C116-T118 PolarHBondContact SG-OG1 2.92Å; C116-C140 PolarHBondContact SG-SG 2.88Å
117	G	89	Confident	88.4	Confident	45 Å²	45	80.9 Å²	80.9	46%	0.464	41%	0.406	S	S	.	.			trans	64.8	-8.5	178.5	0	0	0	0	0	116.4	F112 C113 R119	F112-G117 WeakPolarHBondContact CB-O 3.05Å; F112-G117 WeakPolarHBondContact CD1-O 3.32Å; C113-G117 VanDerWaalsContact O-CA 3.3Å; C113-G117 WeakPolarHBondContact O-CA 3.15Å; C113-G117 PolarHBondContact O-N 2.82Å; G117-R119 PolarHBondContact O-N 3.41Å
118	T	90.5	Very high	88.9	Confident	48 Å²	48	79.1 Å²	79.1	29%	0.294	40%	0.395	S	S	.	.	P	Polyproline II helix	trans	-65.6	134.4	-175.1	60.2	0	0	0	0	112.3	C113 C116 R124	C113-T118 PolarHBondContact N-O 3.45Å; C116-T118 PolarHBondContact O-N 2.89Å; C116-T118 PolarHBondContact SG-OG1 2.92Å; T118-R124 WeakPolarHBondContact OG1-CD 3.41Å
119	R	91	Very high	89.7	Confident	167 Å²	167	74.4 Å²	74.4	63%	0.63	37%	0.373	S	S	*	.	B	Isolated β-bridge	trans	-63.7	138.3	-179.9	-166.7	170.8	173.2	152.6	-6.3	111.3	K111 F112 G117 R124	K111-R119 WeakPolarHBondContact O-CG 3.28Å; F112-R119 HydrophobicContact CD1-CB 3.72Å; F112-R119 HydrophobicContact CD1-CG 4.08Å; F112-R119 HydrophobicContact CE1-CB 3.79Å; F112-R119 HydrophobicContact CE1-CG 3.9Å; G117-R119 PolarHBondContact O-N 3.41Å; R119-R124 PolarHBondContact O-NH1 3.48Å
120	F	94.4	Very high	90.1	Very high	20 Å²	20	76.3 Å²	76.3	9%	0.088	38%	0.375	C	S	.	.	P	Polyproline II helix	trans	-73.1	145.3	173.7	-67.2	-69	0	0	0	111.4	C110 K111 F112 C113 R124 R125 K126 I135 F136 C137	C110-F120 HydrophobicContact CB-CE2 4.26Å; K111-F120 PolarHBondContact O-N 2.9Å; K111-F120 VanDerWaalsContact O-N 3.14Å; F112-F120 VanDerWaalsContact O-CE2 3.31Å; F112-F120 WeakPolarHBondContact O-CE2 3.46Å; C113-F120 HydrophobicContact CB-CZ 4.12Å; F120-R124 WeakPolarHBondContact CA-O 3.21Å; F120-R124 HydrophobicContact CD1-CG 4.42Å; F120-R124 WeakPolarHBondContact CD1-O 3.06Å; F120-R125 WeakPolarHBondContact CD1-O 3.26Å; F120-R125 WeakPolarHBondContact CE1-O 3.31Å; F120-K126 HydrophobicContact CB-CG 4.14Å; F120-K126 HydrophobicContact CD1-CB 4.44Å; F120-K126 HydrophobicContact CD1-CG 3.67Å; F120-K126 HydrophobicContact CD2-CD 4.24Å; F120-K126 HydrophobicContact CD2-CG 3.75Å; F120-K126 HydrophobicContact CE1-CB 4.34Å; F120-K126 HydrophobicContact CE1-CG 3.93Å; F120-K126 HydrophobicContact CE2-CG 4Å; F120-K126 HydrophobicContact CG-CD 4.4Å; F120-K126 HydrophobicContact CG-CG 3.58Å; F120-K126 HydrophobicContact CZ-CG 4.1Å; F120-I135 HydrophobicContact CE1-CG2 4.39Å; F120-I135 HydrophobicContact CE2-CG2 3.72Å; F120-I135 HydrophobicContact CZ-CG2 3.52Å; F120-F136 WeakPolarHBondContact CE1-O 3.45Å; F120-C137 HydrophobicContact CE1-CB 4.03Å
121	T	88.2	Confident	90.3	Very high	76 Å²	76	77.7 Å²	77.7	47%	0.466	38%	0.383	S	S	.	.			trans	-139.3	177	179.4	68.5	0	0	0	0	109.7	I123 R124	T121-I123 PolarHBondContact O-N 2.75Å; T121-I123 PolarHBondContact OG1-N 2.68Å; T121-R124 PolarHBondContact N-O 2.74Å; T121-R124 CarbonylContact O-C 3.55Å; T121-R124 VanDerWaalsContact O-C 3.23Å; T121-R124 PolarHBondContact O-N 3.31Å; T121-R124 PolarHBondContact OG1-N 2.97Å
122	A	82.6	Confident	90.3	Very high	97 Å²	97	75.1 Å²	75.1	80%	0.802	38%	0.376	S	S	*	.	S	Bend	trans	-56.4	-35.4	174.8	0	0	0	0	0	112.6	R125	A122-R125 WeakPolarHBondContact O-CG 3.33Å
123	I	79.5	Confident	90.1	Very high	161 Å²	161	70.1 Å²	70.1	83%	0.826	36%	0.355	S	S	*	.	S	Bend	trans	-83.8	-48.6	177.7	-54.6	173.5	0	0	0	110.6	T121 R125	T121-I123 PolarHBondContact O-N 2.75Å; T121-I123 PolarHBondContact OG1-N 2.68Å; I123-R125 VanDerWaalsContact C-N 3.35Å; I123-R125 PolarHBondContact O-N 3.17Å
124	R	88.8	Confident	90.1	Very high	95 Å²	95	75 Å²	75	36%	0.358	37%	0.373	S	S	.	.	S	Bend	trans	-83.4	81.1	175.3	-171.7	-179.7	-70.8	123.1	-3.5	109.2	T118 R119 F120 T121 C137	T118-R124 WeakPolarHBondContact OG1-CD 3.41Å; R119-R124 PolarHBondContact O-NH1 3.48Å; F120-R124 WeakPolarHBondContact CA-O 3.21Å; F120-R124 HydrophobicContact CD1-CG 4.42Å; F120-R124 WeakPolarHBondContact CD1-O 3.06Å; T121-R124 PolarHBondContact N-O 2.74Å; T121-R124 CarbonylContact O-C 3.55Å; T121-R124 VanDerWaalsContact O-C 3.23Å; T121-R124 PolarHBondContact O-N 3.31Å; T121-R124 PolarHBondContact OG1-N 2.97Å; R124-C137 HydrophobicContact CG-CB 3.78Å
125	R	89.5	Confident	90.2	Very high	181 Å²	181	70.2 Å²	70.2	68%	0.683	35%	0.352	S	S	*	.			trans	-70.7	164.2	-179.7	-59.1	-174.5	77.3	165.4	3.8	112.7	F120 A122 I123 H127	F120-R125 WeakPolarHBondContact CD1-O 3.26Å; F120-R125 WeakPolarHBondContact CE1-O 3.31Å; A122-R125 WeakPolarHBondContact O-CG 3.33Å; I123-R125 VanDerWaalsContact C-N 3.35Å; I123-R125 PolarHBondContact O-N 3.17Å; R125-H127 PolarHBondContact O-CD2 2.65Å
126	K	92.5	Very high	90.5	Very high	69 Å²	69	66.5 Å²	66.5	30%	0.3	34%	0.335	S	S	.	.			trans	-89.3	141.2	179	-63.5	178.5	-172	-176.2	0	110.6	D107 C110 F120 I135	D107-K126 HydrophobicContact CB-CD 4.03Å; D107-K126 WeakPolarHBondContact O-CD 3.34Å; D107-K126 PolarHBondContact O-NZ 2.96Å; D107-K126 WeakPolarHBondContact OD1-CB 3.48Å; C110-K126 WeakPolarHBondContact O-CE 3.34Å; C110-K126 PolarHBondContact O-NZ 2.97Å; F120-K126 HydrophobicContact CB-CG 4.14Å; F120-K126 HydrophobicContact CD1-CB 4.44Å; F120-K126 HydrophobicContact CD1-CG 3.67Å; F120-K126 HydrophobicContact CD2-CD 4.24Å; F120-K126 HydrophobicContact CD2-CG 3.75Å; F120-K126 HydrophobicContact CE1-CB 4.34Å; F120-K126 HydrophobicContact CE1-CG 3.93Å; F120-K126 HydrophobicContact CE2-CG 4Å; F120-K126 HydrophobicContact CG-CD 4.4Å; F120-K126 HydrophobicContact CG-CG 3.58Å; F120-K126 HydrophobicContact CZ-CG 4.1Å; K126-I135 HydrophobicContact CB-CG2 3.71Å; K126-I135 HydrophobicContact CD-CG2 4.35Å; K126-I135 HydrophobicContact CG-CG2 3.99Å
127	H	93.2	Very high	90.7	Very high	45 Å²	45	63.7 Å²	63.7	21%	0.208	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	129.1	178.1	-54.2	-83.9	0	0	0	110.7	R125 I135 F136 N138	R125-H127 PolarHBondContact O-CD2 2.65Å; H127-I135 WeakPolarHBondContact O-CA 3.38Å; H127-F136 PolarHBondContact N-O 2.82Å; H127-F136 PolarHBondContact O-N 2.68Å; H127-N138 PolarHBondContact CD2-N 3.17Å
128	H	93.7	Very high	90.8	Very high	33 Å²	33	65.5 Å²	65.5	15%	0.153	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	137.9	174	-56.6	81.2	0	0	0	112	W104 M105 D107 R134 I135	W104-H128 AromaticContact CE2-CD2 3.43Å; W104-H128 VanDerWaalsContact CE2-CD2 3.43Å; W104-H128 AromaticContact CE2-CG 3.58Å; W104-H128 AromaticContact CE2-NE2 3.83Å; W104-H128 HydrophobicContact CH2-CB 3.4Å; W104-H128 AromaticContact CH2-CG 3.77Å; W104-H128 HydrophobicContact CZ2-CB 3.43Å; W104-H128 VanDerWaalsContact CZ2-CB 3.43Å; W104-H128 AromaticContact CZ2-CD2 3.6Å; W104-H128 AromaticContact CZ2-CG 3.21Å; W104-H128 AromaticContact CZ2-ND1 3.58Å; W104-H128 HydrophobicContact CZ3-CB 4.08Å; W104-H128 AromaticContact NE1-CD2 3.46Å; W104-H128 PolarHBondContact NE1-CD2 3.22Å; W104-H128 AromaticContact NE1-CE1 3.86Å; W104-H128 AromaticContact NE1-CG 3.94Å; W104-H128 AromaticContact NE1-NE2 3.39Å; W104-H128 PolarHBondContact NE1-NE2 2.78Å; M105-H128 PolarHBondContact O-CD2 2.91Å; M105-H128 VanDerWaalsContact O-CD2 3.27Å; M105-H128 PolarHBondContact O-NE2 2.72Å; D107-H128 IonicContact OD1-CE1 2.97Å; D107-H128 PolarHBondContact OD1-CE1 3.07Å; D107-H128 IonicContact OD1-NE2 2.8Å; D107-H128 IonicContact OD2-CE1 3.89Å; D107-H128 PolarHBondContact OD2-CE1 2.69Å; H128-R134 WeakPolarHBondContact CA-O 3.4Å; H128-I135 VanDerWaalsContact CD2-CG1 3.45Å; H128-I135 WeakPolarHBondContact CD2-CG1 3.39Å; H128-I135 WeakPolarHBondContact NE2-CG1 3.39Å
129	C	93.3	Very high	90.8	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	33%	0.332	C	S	.	.			trans	-74.6	120.2	158.3	173.5	0	0	0	0	109	V131 C132 G133 R134 F136 C159 C162	C129-V131 PolarHBondContact O-N 3.19Å; C129-V131 PolarHBondContact SG-N 3.16Å; C129-C132 VanDerWaalsContact CB-SG 3.56Å; C129-C132 PolarHBondContact O-N 3.13Å; C129-G133 WeakPolarHBondContact O-CA 3.26Å; C129-G133 PolarHBondContact O-N 3.02Å; C129-R134 PolarHBondContact N-O 3.28Å; C129-F136 HydrophobicContact CB-CD2 3.87Å; C129-F136 HydrophobicContact CB-CE2 3.48Å; C129-F136 VanDerWaalsContact CB-CE2 3.48Å; C129-F136 HydrophobicContact CB-CZ 4.42Å; C129-C159 HydrophobicContact CB-CB 3.99Å; C129-C159 PolarHBondContact SG-N 3.23Å; C129-C162 VanDerWaalsContact SG-SG 3.69Å
130	R	89.8	Confident	90.9	Very high	110 Å²	110	62.6 Å²	62.6	42%	0.415	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.4	-179.6	-152.3	72.5	158.7	137.2	-1	113.8	I150 L152 Q156 R157	R130-I150 HydrophobicContact CB-CD1 4.07Å; R130-I150 HydrophobicContact CG-CD1 4Å; R130-L152 HydrophobicContact CG-CD1 3.49Å; R130-L152 VanDerWaalsContact CG-CD1 3.49Å; R130-Q156 HydrophobicContact CB-CB 4.07Å; R130-Q156 HydrophobicContact CG-CB 4.06Å; R130-Q156 HydrophobicContact CG-CG 4.33Å; R130-R157 WeakPolarHBondContact CB-O 3.42Å; R130-R157 PolarHBondContact N-O 2.92Å
131	V	88.3	Confident	90.9	Very high	38 Å²	38	61.6 Å²	61.6	23%	0.23	30%	0.302	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-44.3	-179.3	-168.7	0	0	0	0	112	C129 V145 I150 A158 C162 L166	C129-V131 PolarHBondContact O-N 3.19Å; C129-V131 PolarHBondContact SG-N 3.16Å; V131-V145 HydrophobicContact CG2-CG2 4.41Å; V131-I150 HydrophobicContact CG1-CG2 4.28Å; V131-I150 HydrophobicContact CG2-CD1 4.34Å; V131-I150 HydrophobicContact CG2-CG2 4.3Å; V131-A158 HydrophobicContact CG2-CB 3.93Å; V131-C162 HydrophobicContact CB-CB 3.89Å; V131-C162 HydrophobicContact CG1-CB 4.23Å; V131-C162 HydrophobicContact CG2-CB 4.02Å; V131-L166 HydrophobicContact CG1-CD1 4.35Å; V131-L166 HydrophobicContact CG2-CD1 3.68Å
132	C	90.2	Very high	90.9	Very high	39 Å²	39	62 Å²	62	26%	0.264	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116.1	-3.6	-172.8	73.9	0	0	0	0	115.1	C129 R134	C129-C132 VanDerWaalsContact CB-SG 3.56Å; C129-C132 PolarHBondContact O-N 3.13Å; C132-R134 PolarHBondContact O-N 2.7Å
133	G	90.5	Very high	91.2	Very high	3 Å²	3	61.1 Å²	61.1	3%	0.031	28%	0.281	C	S	.	.			trans	69.3	-3.3	176.7	0	0	0	0	0	115.9	M105 C129	M105-G133 VanDerWaalsContact CB-O 3.27Å; M105-G133 WeakPolarHBondContact CB-O 2.96Å; M105-G133 PolarHBondContact N-O 2.93Å; C129-G133 WeakPolarHBondContact O-CA 3.26Å; C129-G133 PolarHBondContact O-N 3.02Å
134	R	93.2	Very high	91.6	Very high	105 Å²	105	58.3 Å²	58.3	40%	0.396	27%	0.267	S	S	.	.			trans	-77.7	163.3	176.2	-62.5	176	179.1	163.3	0.3	111.3	Y103 M105 F114 H128 C129 C132 F136	Y103-R134 HydrophobicContact CE1-CG 4.08Å; M105-R134 HydrophobicContact CE-CB 4.31Å; M105-R134 HydrophobicContact CE-CG 4.08Å; F114-R134 HydrophobicContact CD2-CG 4.5Å; F114-R134 HydrophobicContact CG-CB 4.28Å; H128-R134 WeakPolarHBondContact CA-O 3.4Å; C129-R134 PolarHBondContact N-O 3.28Å; C132-R134 PolarHBondContact O-N 2.7Å; R134-F136 VanDerWaalsContact C-CE2 3.44Å; R134-F136 HydrophobicContact CB-CE2 3.59Å; R134-F136 HydrophobicContact CB-CZ 3.87Å; R134-F136 VanDerWaalsContact O-CD2 3.28Å; R134-F136 WeakPolarHBondContact O-CD2 3.21Å; R134-F136 WeakPolarHBondContact O-CE2 3.24Å
135	I	95	Very high	91.6	Very high	0 Å²	0	54.1 Å²	54.1	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	135.1	-174	-71	154.8	0	0	0	112	M105 Q106 C110 F114 F120 K126 H127 H128	M105-I135 HydrophobicContact CB-CD1 3.94Å; M105-I135 HydrophobicContact CB-CG1 4.31Å; M105-I135 HydrophobicContact CG-CD1 3.82Å; M105-I135 VanDerWaalsContact O-CD1 3.26Å; M105-I135 WeakPolarHBondContact O-CD1 3.3Å; M105-I135 HydrophobicContact SD-CB 4.16Å; M105-I135 HydrophobicContact SD-CD1 4.01Å; M105-I135 HydrophobicContact SD-CG1 4.34Å; Q106-I135 VanDerWaalsContact O-CD1 3.3Å; Q106-I135 WeakPolarHBondContact O-CD1 3.4Å; C110-I135 HydrophobicContact CB-CB 3.75Å; C110-I135 HydrophobicContact CB-CD1 3.65Å; C110-I135 HydrophobicContact CB-CG1 4.35Å; C110-I135 HydrophobicContact CB-CG2 3.78Å; F114-I135 VanDerWaalsContact CB-O 3.23Å; F114-I135 WeakPolarHBondContact CB-O 3.04Å; F114-I135 PolarHBondContact N-O 3.38Å; F114-I135 VanDerWaalsContact N-O 3.1Å; F120-I135 HydrophobicContact CE1-CG2 4.39Å; F120-I135 HydrophobicContact CE2-CG2 3.72Å; F120-I135 HydrophobicContact CZ-CG2 3.52Å; K126-I135 HydrophobicContact CB-CG2 3.71Å; K126-I135 HydrophobicContact CD-CG2 4.35Å; K126-I135 HydrophobicContact CG-CG2 3.99Å; H127-I135 WeakPolarHBondContact O-CA 3.38Å; H128-I135 VanDerWaalsContact CD2-CG1 3.45Å; H128-I135 WeakPolarHBondContact CD2-CG1 3.39Å; H128-I135 WeakPolarHBondContact NE2-CG1 3.39Å
136	F	96.4	Very high	91.2	Very high	4 Å²	4	50 Å²	50	2%	0.018	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	162.5	-173.1	-57.4	-98	0	0	0	109.9	F114 E115 F120 H127 C129 R134 C140 C159	F114-F136 HydrophobicContact CB-CD1 4.17Å; F114-F136 HydrophobicContact CB-CE1 3.88Å; F114-F136 HydrophobicContact CB-CZ 4.13Å; F114-F136 AromaticContact CD1-CE1 3.92Å; F114-F136 HydrophobicContact CD1-CE1 3.92Å; F114-F136 AromaticContact CD1-CZ 3.99Å; F114-F136 HydrophobicContact CD1-CZ 3.99Å; F114-F136 HydrophobicContact CG-CE1 4.34Å; F114-F136 HydrophobicContact CG-CZ 4.37Å; E115-F136 HydrophobicContact CB-CD1 3.76Å; E115-F136 HydrophobicContact CB-CE1 3.86Å; F120-F136 WeakPolarHBondContact CE1-O 3.45Å; H127-F136 PolarHBondContact N-O 2.82Å; H127-F136 PolarHBondContact O-N 2.68Å; C129-F136 HydrophobicContact CB-CD2 3.87Å; C129-F136 HydrophobicContact CB-CE2 3.48Å; C129-F136 VanDerWaalsContact CB-CE2 3.48Å; C129-F136 HydrophobicContact CB-CZ 4.42Å; R134-F136 VanDerWaalsContact C-CE2 3.44Å; R134-F136 HydrophobicContact CB-CE2 3.59Å; R134-F136 HydrophobicContact CB-CZ 3.87Å; R134-F136 VanDerWaalsContact O-CD2 3.28Å; R134-F136 WeakPolarHBondContact O-CD2 3.21Å; R134-F136 WeakPolarHBondContact O-CE2 3.24Å; F136-C140 HydrophobicContact CB-CB 4.16Å; F136-C140 HydrophobicContact CD1-CB 4.15Å; F136-C159 HydrophobicContact CD1-CB 3.55Å; F136-C159 HydrophobicContact CD2-CB 3.71Å; F136-C159 HydrophobicContact CE1-CB 3.36Å; F136-C159 HydrophobicContact CE2-CB 3.55Å; F136-C159 HydrophobicContact CG-CB 3.74Å; F136-C159 HydrophobicContact CZ-CB 3.38Å; F136-C159 WeakPolarHBondContact CZ-SG 3.46Å
137	C	95.4	Very high	90.6	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.007	23%	0.225	C	C	.	.			trans	-78.9	166	166.3	70.8	0	0	0	0	110.5	C113 F120 R124 Q139 C140 S141	C113-C137 HydrophobicContact CB-CB 4.23Å; C113-C137 PolarHBondContact SG-N 3.12Å; F120-C137 HydrophobicContact CE1-CB 4.03Å; R124-C137 HydrophobicContact CG-CB 3.78Å; C137-Q139 PolarHBondContact O-N 3.45Å; C137-Q139 VanDerWaalsContact O-N 3.14Å; C137-C140 PolarHBondContact O-N 2.81Å; C137-C140 VanDerWaalsContact O-N 3.16Å; C137-S141 PolarHBondContact O-N 2.79Å; C137-S141 VanDerWaalsContact O-N 3.1Å; C137-S141 PolarHBondContact O-OG 3.16Å
138	N	91.7	Very high	89.7	Confident	84 Å²	84	48.3 Å²	48.3	45%	0.449	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-30.4	-178.6	-169.2	51.7	0	0	0	112.9	H127 S141 N142 R157	H127-N138 PolarHBondContact CD2-N 3.17Å; N138-S141 CarbonylContact O-C 3.5Å; N138-S141 PolarHBondContact O-N 2.91Å; N138-N142 VanDerWaalsContact O-CA 3.31Å; N138-N142 WeakPolarHBondContact O-CA 3.29Å; N138-N142 VanDerWaalsContact O-CB 3.26Å; N138-N142 WeakPolarHBondContact O-CB 3.17Å; N138-N142 PolarHBondContact O-N 3.16Å; N138-R157 PolarHBondContact OD1-NH1 3.09Å; N138-R157 PolarHBondContact OD1-NH2 3.48Å
139	Q	88.7	Confident	88.7	Confident	138 Å²	138	49.6 Å²	49.6	65%	0.645	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.2	-39.7	178.1	-71.3	169.4	-50.2	0	0	113	C137 S141 N142	C137-Q139 PolarHBondContact O-N 3.45Å; C137-Q139 VanDerWaalsContact O-N 3.14Å; Q139-S141 VanDerWaalsContact C-N 3.25Å; Q139-S141 PolarHBondContact O-N 3.37Å; Q139-N142 PolarHBondContact O-OD1 3.31Å
140	C	94.6	Very high	87.9	Confident	15 Å²	15	50.3 Å²	50.3	10%	0.101	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.9	1.2	176.4	-61.9	0	0	0	0	113.3	E115 C116 F136 C137 C159 S160	E115-C140 HydrophobicContact CB-CB 3.95Å; E115-C140 HydrophobicContact CG-CB 4.42Å; E115-C140 WeakPolarHBondContact OE2-CB 3.16Å; C116-C140 PolarHBondContact SG-SG 2.88Å; F136-C140 HydrophobicContact CB-CB 4.16Å; F136-C140 HydrophobicContact CD1-CB 4.15Å; C137-C140 PolarHBondContact O-N 2.81Å; C137-C140 VanDerWaalsContact O-N 3.16Å; C140-C159 CarbonylContact O-C 3.59Å; C140-C159 WeakPolarHBondContact O-CA 3.24Å; C140-C159 WeakPolarHBondContact O-CB 3.43Å; C140-S160 PolarHBondContact O-N 2.82Å
141	S	93.1	Very high	87.1	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-145.9	33.6	178.2	60.8	0	0	0	0	112.9	C137 N138 Q139 R157 A158	C137-S141 PolarHBondContact O-N 2.79Å; C137-S141 VanDerWaalsContact O-N 3.1Å; C137-S141 PolarHBondContact O-OG 3.16Å; N138-S141 CarbonylContact O-C 3.5Å; N138-S141 PolarHBondContact O-N 2.91Å; Q139-S141 VanDerWaalsContact C-N 3.25Å; Q139-S141 PolarHBondContact O-N 3.37Å; S141-R157 VanDerWaalsContact O-CD 3.27Å; S141-R157 WeakPolarHBondContact O-CD 3.32Å; S141-R157 WeakPolarHBondContact O-CG 3.4Å; S141-R157 PolarHBondContact O-NH1 3.5Å; S141-A158 CarbonylContact C-O 3.53Å; S141-A158 VanDerWaalsContact CA-O 3.23Å; S141-A158 WeakPolarHBondContact CA-O 3.48Å
142	N	89.3	Confident	86.4	Confident	84 Å²	84	47.3 Å²	47.3	45%	0.449	25%	0.252	S	S	.	.			trans	-72.1	-20.6	172.6	55.6	-5.2	0	0	0	111.9	N138 Q139	N138-N142 VanDerWaalsContact O-CA 3.31Å; N138-N142 WeakPolarHBondContact O-CA 3.29Å; N138-N142 VanDerWaalsContact O-CB 3.26Å; N138-N142 WeakPolarHBondContact O-CB 3.17Å; N138-N142 PolarHBondContact O-N 3.16Å; Q139-N142 PolarHBondContact O-OD1 3.31Å
143	Q	89.6	Confident	85.7	Confident	78 Å²	78	52.4 Å²	52.4	36%	0.364	28%	0.276	S	S	.	.			trans	-67.2	138.8	-178.6	-59.1	-59.8	-21.8	0	0	111.8	A158 A163	Q143-A158 PolarHBondContact O-N 3.14Å; Q143-A163 HydrophobicContact CB-CB 3.31Å; Q143-A163 HydrophobicContact CG-CB 3.74Å
144	I	87.7	Confident	85.2	Confident	103 Å²	103	54.7 Å²	54.7	53%	0.528	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	121.8	-179.5	-61.9	177.9	0	0	0	107.3	L155	I144-L155 HydrophobicContact CG2-CB 3.65Å; I144-L155 HydrophobicContact CG2-CD1 4.27Å; I144-L155 HydrophobicContact CG2-CD2 4.3Å; I144-L155 HydrophobicContact CG2-CG 4.29Å
145	V	87.6	Confident	84.9	Confident	6 Å²	6	55.9 Å²	55.9	4%	0.036	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	155	178	-64.4	0	0	0	0	110.1	V131 G147 Q156 A158 A163 L166	V131-V145 HydrophobicContact CG2-CG2 4.41Å; V145-G147 PolarHBondContact O-N 2.76Å; V145-Q156 WeakPolarHBondContact CG2-O 3.02Å; V145-Q156 PolarHBondContact N-O 3.35Å; V145-Q156 PolarHBondContact O-N 3.5Å; V145-A158 HydrophobicContact CG1-CB 4.15Å; V145-A158 HydrophobicContact CG2-CB 4Å; V145-A163 HydrophobicContact CG1-CB 3.92Å; V145-L166 HydrophobicContact CB-CD1 4.16Å; V145-L166 HydrophobicContact CG1-CB 4.38Å; V145-L166 HydrophobicContact CG1-CD1 4.04Å; V145-L166 HydrophobicContact CG2-CD1 3.9Å
146	E	81.7	Confident	84.6	Confident	94 Å²	94	57.5 Å²	57.5	44%	0.439	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70	124	174.2	-160.5	-163.4	147.8	0	0	109.5	T148 Q149	E146-T148 HydrophobicContact CG-CG2 4.32Å; E146-T148 WeakPolarHBondContact CG-OG1 3.48Å; E146-T148 PolarHBondContact O-N 2.89Å; E146-T148 VanDerWaalsContact O-N 3.13Å; E146-T148 VanDerWaalsContact OE1-CG2 3.29Å; E146-T148 WeakPolarHBondContact OE1-CG2 3.39Å; E146-T148 PolarHBondContact OE1-OG1 2.94Å; E146-Q149 HydrophobicContact CB-CG 4.22Å; E146-Q149 WeakPolarHBondContact O-CB 3.44Å; E146-Q149 WeakPolarHBondContact O-CG 3.41Å; E146-Q149 PolarHBondContact O-N 3.31Å; E146-Q149 VanDerWaalsContact O-N 3.17Å
147	G	80.1	Confident	84.4	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	34%	0.335	C	S	.	.	G	3₁₀ helix	trans	-60.4	-26.5	-174.6	0	0	0	0	0	113.7	V145 Q149 I150 G151 L152 G154	V145-G147 PolarHBondContact O-N 2.76Å; G147-Q149 PolarHBondContact O-N 2.96Å; G147-Q149 VanDerWaalsContact O-N 3.16Å; G147-I150 CarbonylContact O-C 3.51Å; G147-I150 WeakPolarHBondContact O-CA 3.3Å; G147-I150 VanDerWaalsContact O-CG1 3.22Å; G147-I150 WeakPolarHBondContact O-CG1 3.42Å; G147-I150 PolarHBondContact O-N 3.01Å; G147-G151 PolarHBondContact O-N 2.8Å; G147-L152 CarbonylContact C-O 3.55Å; G147-L152 WeakPolarHBondContact CA-O 3.33Å; G147-L152 PolarHBondContact O-N 2.74Å; G147-L152 VanDerWaalsContact O-O 3.08Å; G147-G154 VanDerWaalsContact CA-O 3.3Å; G147-G154 WeakPolarHBondContact CA-O 3.43Å; G147-G154 PolarHBondContact N-O 2.71Å
148	T	73.4	Confident	84.3	Confident	79 Å²	79	61 Å²	61	49%	0.485	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-56.4	-33.2	179.6	59.1	0	0	0	0	111.3	E146 I150 G151 L152	E146-T148 HydrophobicContact CG-CG2 4.32Å; E146-T148 WeakPolarHBondContact CG-OG1 3.48Å; E146-T148 PolarHBondContact O-N 2.89Å; E146-T148 VanDerWaalsContact O-N 3.13Å; E146-T148 VanDerWaalsContact OE1-CG2 3.29Å; E146-T148 WeakPolarHBondContact OE1-CG2 3.39Å; E146-T148 PolarHBondContact OE1-OG1 2.94Å; T148-I150 PolarHBondContact O-N 2.78Å; T148-G151 PolarHBondContact O-N 3.27Å; T148-L152 WeakPolarHBondContact CA-O 3.31Å; T148-L152 PolarHBondContact N-O 2.92Å
149	Q	72.8	Confident	84.4	Confident	60 Å²	60	57.2 Å²	57.2	28%	0.28	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-64.6	-19.3	177.1	-55	174	15.6	0	0	112.9	E146 G147 L166 N170	E146-Q149 HydrophobicContact CB-CG 4.22Å; E146-Q149 WeakPolarHBondContact O-CB 3.44Å; E146-Q149 WeakPolarHBondContact O-CG 3.41Å; E146-Q149 PolarHBondContact O-N 3.31Å; E146-Q149 VanDerWaalsContact O-N 3.17Å; G147-Q149 PolarHBondContact O-N 2.96Å; G147-Q149 VanDerWaalsContact O-N 3.16Å; Q149-L166 HydrophobicContact CB-CD2 4.4Å; Q149-N170 PolarHBondContact NE2-ND2 2.78Å
150	I	77	Confident	84.5	Confident	15 Å²	15	52.4 Å²	52.4	8%	0.077	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-124.1	12.3	176.9	61.3	171.5	0	0	0	113.4	R101 R130 V131 G147 T148 L152 Q156 L166	R101-I150 PolarHBondContact NH2-O 2.85Å; R130-I150 HydrophobicContact CB-CD1 4.07Å; R130-I150 HydrophobicContact CG-CD1 4Å; V131-I150 HydrophobicContact CG1-CG2 4.28Å; V131-I150 HydrophobicContact CG2-CD1 4.34Å; V131-I150 HydrophobicContact CG2-CG2 4.3Å; G147-I150 CarbonylContact O-C 3.51Å; G147-I150 WeakPolarHBondContact O-CA 3.3Å; G147-I150 VanDerWaalsContact O-CG1 3.22Å; G147-I150 WeakPolarHBondContact O-CG1 3.42Å; G147-I150 PolarHBondContact O-N 3.01Å; T148-I150 PolarHBondContact O-N 2.78Å; I150-L152 HydrophobicContact CD1-CD1 4.03Å; I150-L152 HydrophobicContact CG1-CD1 4.41Å; I150-L152 HydrophobicContact CG1-CG 4.49Å; I150-Q156 HydrophobicContact CD1-CB 4.47Å; I150-L166 HydrophobicContact CG2-CD1 4.09Å; I150-L166 HydrophobicContact CG2-CD2 4.46Å
151	G	73.1	Confident	84.3	Confident	54 Å²	54	59.2 Å²	59.2	56%	0.557	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.4	37.5	179.8	0	0	0	0	0	114.9	R101 G147 T148	R101-G151 PolarHBondContact NH2-O 3.07Å; G147-G151 PolarHBondContact O-N 2.8Å; T148-G151 PolarHBondContact O-N 3.27Å
152	L	74.1	Confident	84.3	Confident	31 Å²	31	59.9 Å²	59.9	16%	0.162	33%	0.325	C	S	.	.			trans	-123.4	158.6	169.4	-69	176.6	0	0	0	109.5	R130 G147 T148 I150 Q156	R130-L152 HydrophobicContact CG-CD1 3.49Å; R130-L152 VanDerWaalsContact CG-CD1 3.49Å; G147-L152 CarbonylContact C-O 3.55Å; G147-L152 WeakPolarHBondContact CA-O 3.33Å; G147-L152 PolarHBondContact O-N 2.74Å; G147-L152 VanDerWaalsContact O-O 3.08Å; T148-L152 WeakPolarHBondContact CA-O 3.31Å; T148-L152 PolarHBondContact N-O 2.92Å; I150-L152 HydrophobicContact CD1-CD1 4.03Å; I150-L152 HydrophobicContact CG1-CD1 4.41Å; I150-L152 HydrophobicContact CG1-CG 4.49Å; L152-Q156 HydrophobicContact CB-CG 4.1Å; L152-Q156 HydrophobicContact CD1-CG 3.98Å
153	D	75.7	Confident	84.3	Confident	146 Å²	146	55.9 Å²	55.9	78%	0.781	30%	0.304	S	S	*	.	S	Bend	trans	-87.5	156	171.6	-56.3	-59.7	0	0	0	111.5	Q156	D153-Q156 PolarHBondContact O-NE2 2.81Å
154	G	78.6	Confident	84	Confident	51 Å²	51	58.5 Å²	58.5	53%	0.526	32%	0.316	S	S	.	.	S	Bend	trans	67.6	-172.9	177.7	0	0	0	0	0	115.1	G147	G147-G154 VanDerWaalsContact CA-O 3.3Å; G147-G154 WeakPolarHBondContact CA-O 3.43Å; G147-G154 PolarHBondContact N-O 2.71Å
155	L	86.6	Confident	83.7	Confident	131 Å²	131	56.3 Å²	56.3	69%	0.686	31%	0.307	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.6	138.2	179.4	-67.4	-179.7	0	0	0	111.5	I144	I144-L155 HydrophobicContact CG2-CB 3.65Å; I144-L155 HydrophobicContact CG2-CD1 4.27Å; I144-L155 HydrophobicContact CG2-CD2 4.3Å; I144-L155 HydrophobicContact CG2-CG 4.29Å
156	Q	89.4	Confident	83.4	Confident	33 Å²	33	57.3 Å²	57.3	15%	0.154	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	135.3	-172.3	-60.1	-65.5	-35.8	0	0	111.3	R130 V145 I150 L152 D153	R130-Q156 HydrophobicContact CB-CB 4.07Å; R130-Q156 HydrophobicContact CG-CB 4.06Å; R130-Q156 HydrophobicContact CG-CG 4.33Å; V145-Q156 WeakPolarHBondContact CG2-O 3.02Å; V145-Q156 PolarHBondContact N-O 3.35Å; V145-Q156 PolarHBondContact O-N 3.5Å; I150-Q156 HydrophobicContact CD1-CB 4.47Å; L152-Q156 HydrophobicContact CB-CG 4.1Å; L152-Q156 HydrophobicContact CD1-CG 3.98Å; D153-Q156 PolarHBondContact O-NE2 2.81Å
157	R	92.8	Very high	83.1	Confident	80 Å²	80	56.8 Å²	56.8	30%	0.302	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	136.9	179.3	-174.5	-179.2	-72.3	-104.2	6.1	111.9	R130 N138 S141	R130-R157 WeakPolarHBondContact CB-O 3.42Å; R130-R157 PolarHBondContact N-O 2.92Å; N138-R157 PolarHBondContact OD1-NH1 3.09Å; N138-R157 PolarHBondContact OD1-NH2 3.48Å; S141-R157 VanDerWaalsContact O-CD 3.27Å; S141-R157 WeakPolarHBondContact O-CD 3.32Å; S141-R157 WeakPolarHBondContact O-CG 3.4Å; S141-R157 PolarHBondContact O-NH1 3.5Å
158	A	92.8	Very high	82.5	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	33%	0.333	C	S	.	.			trans	-129.6	157.5	173	0	0	0	0	0	111.2	V131 S141 Q143 V145 C162 A163	V131-A158 HydrophobicContact CG2-CB 3.93Å; S141-A158 CarbonylContact C-O 3.53Å; S141-A158 VanDerWaalsContact CA-O 3.23Å; S141-A158 WeakPolarHBondContact CA-O 3.48Å; Q143-A158 PolarHBondContact O-N 3.14Å; V145-A158 HydrophobicContact CG1-CB 4.15Å; V145-A158 HydrophobicContact CG2-CB 4Å; A158-C162 HydrophobicContact CB-CB 4.27Å; A158-A163 HydrophobicContact CB-CB 4.05Å
159	C	94.3	Very high	81.7	Confident	3 Å²	3	60 Å²	60	2%	0.02	33%	0.334	C	S	.	.			trans	-75.3	159.3	165.5	72.1	0	0	0	0	110.7	C129 F136 C140 Y161 C162 A163	C129-C159 HydrophobicContact CB-CB 3.99Å; C129-C159 PolarHBondContact SG-N 3.23Å; F136-C159 HydrophobicContact CD1-CB 3.55Å; F136-C159 HydrophobicContact CD2-CB 3.71Å; F136-C159 HydrophobicContact CE1-CB 3.36Å; F136-C159 HydrophobicContact CE2-CB 3.55Å; F136-C159 HydrophobicContact CG-CB 3.74Å; F136-C159 HydrophobicContact CZ-CB 3.38Å; F136-C159 WeakPolarHBondContact CZ-SG 3.46Å; C140-C159 CarbonylContact O-C 3.59Å; C140-C159 WeakPolarHBondContact O-CA 3.24Å; C140-C159 WeakPolarHBondContact O-CB 3.43Å; C159-Y161 PolarHBondContact O-N 3.14Å; C159-C162 PolarHBondContact O-N 3.19Å; C159-C162 PolarHBondContact SG-SG 3.04Å; C159-A163 PolarHBondContact O-N 3.33Å
160	S	89.7	Confident	80.4	Confident	37 Å²	37	59.7 Å²	59.7	26%	0.259	33%	0.334	S	S	.	.	H	α-helix	trans	-50.4	-54.4	-175.4	-61.6	0	0	0	0	111.9	C140 C162 A163 E164	C140-S160 PolarHBondContact O-N 2.82Å; S160-C162 VanDerWaalsContact C-N 3.34Å; S160-C162 PolarHBondContact O-N 2.76Å; S160-A163 PolarHBondContact O-N 2.54Å; S160-E164 WeakPolarHBondContact O-CB 3.34Å; S160-E164 PolarHBondContact O-N 3.41Å
161	Y	91	Very high	78.4	Confident	159 Å²	159	63.6 Å²	63.6	62%	0.624	36%	0.359	S	S	*	.	H	α-helix	trans	-52.9	-42.7	174.8	178.2	-97.4	0	0	0	114.7	E115 C159 T165	E115-Y161 PolarHBondContact OE1-N 3.48Å; C159-Y161 PolarHBondContact O-N 3.14Å; Y161-T165 WeakPolarHBondContact O-CB 3.44Å; Y161-T165 PolarHBondContact O-N 3.39Å; Y161-T165 PolarHBondContact O-OG1 3.33Å
162	C	92.6	Very high	76.3	Confident	13 Å²	13	66.7 Å²	66.7	9%	0.088	36%	0.363	C	S	.	.	H	α-helix	trans	-74.7	-36	-178.4	-71.5	0	0	0	0	112.2	C129 V131 A158 C159 S160 L166	C129-C162 VanDerWaalsContact SG-SG 3.69Å; V131-C162 HydrophobicContact CB-CB 3.89Å; V131-C162 HydrophobicContact CG1-CB 4.23Å; V131-C162 HydrophobicContact CG2-CB 4.02Å; A158-C162 HydrophobicContact CB-CB 4.27Å; C159-C162 PolarHBondContact O-N 3.19Å; C159-C162 PolarHBondContact SG-SG 3.04Å; S160-C162 VanDerWaalsContact C-N 3.34Å; S160-C162 PolarHBondContact O-N 2.76Å; C162-L166 WeakPolarHBondContact O-CG 3.1Å; C162-L166 PolarHBondContact O-N 2.8Å; C162-L166 VanDerWaalsContact O-N 3.09Å
163	A	88.9	Confident	73.9	Confident	1 Å²	1	72 Å²	72	1%	0.008	39%	0.385	C	S	.	.	H	α-helix	trans	-67.5	-46	174.5	0	0	0	0	0	111.1	Q143 V145 A158 C159 S160 T165 L166 I167	Q143-A163 HydrophobicContact CB-CB 3.31Å; Q143-A163 HydrophobicContact CG-CB 3.74Å; V145-A163 HydrophobicContact CG1-CB 3.92Å; A158-A163 HydrophobicContact CB-CB 4.05Å; C159-A163 PolarHBondContact O-N 3.33Å; S160-A163 PolarHBondContact O-N 2.54Å; A163-T165 VanDerWaalsContact C-N 3.31Å; A163-T165 PolarHBondContact O-N 2.97Å; A163-L166 CarbonylContact O-C 3.24Å; A163-L166 PolarHBondContact O-N 3.18Å; A163-L166 VanDerWaalsContact O-N 3.12Å; A163-I167 HydrophobicContact CB-CD1 4.46Å; A163-I167 WeakPolarHBondContact O-CB 3.24Å; A163-I167 VanDerWaalsContact O-CG1 3.24Å; A163-I167 WeakPolarHBondContact O-CG1 3.31Å; A163-I167 PolarHBondContact O-N 3.49Å
164	E	84.5	Confident	71.5	Confident	133 Å²	133	70.9 Å²	70.9	62%	0.621	39%	0.385	S	S	*	.	H	α-helix	trans	-60.9	-39.9	176.2	-172.6	174.2	-160.1	0	0	111.6	S160 L166 I167 S168	S160-E164 WeakPolarHBondContact O-CB 3.34Å; S160-E164 PolarHBondContact O-N 3.41Å; E164-L166 PolarHBondContact O-N 2.89Å; E164-I167 PolarHBondContact O-N 2.88Å; E164-S168 VanDerWaalsContact O-CB 3.22Å; E164-S168 WeakPolarHBondContact O-CB 3.43Å; E164-S168 PolarHBondContact O-N 3.48Å; E164-S168 PolarHBondContact O-OG 3.23Å
165	T	81.1	Confident	68.8	Low	56 Å²	56	77.5 Å²	77.5	34%	0.344	40%	0.403	S	S	.	.	H	α-helix	trans	-62.2	-39	173.2	-59.1	0	0	0	0	112.6	Y161 A163 S168 T169	Y161-T165 WeakPolarHBondContact O-CB 3.44Å; Y161-T165 PolarHBondContact O-N 3.39Å; Y161-T165 PolarHBondContact O-OG1 3.33Å; A163-T165 VanDerWaalsContact C-N 3.31Å; A163-T165 PolarHBondContact O-N 2.97Å; T165-S168 PolarHBondContact O-OG 3Å; T165-T169 WeakPolarHBondContact O-CG2 3.28Å; T165-T169 PolarHBondContact O-N 3.47Å; T165-T169 PolarHBondContact O-OG1 2.75Å
166	L	82	Confident	65.8	Low	27 Å²	27	80.3 Å²	80.3	14%	0.141	41%	0.412	C	S	.	.	H	α-helix	trans	-76.6	-35.1	176.9	-74.1	171.4	0	0	0	113	V131 V145 Q149 I150 C162 A163 E164 T169 N170	V131-L166 HydrophobicContact CG1-CD1 4.35Å; V131-L166 HydrophobicContact CG2-CD1 3.68Å; V145-L166 HydrophobicContact CB-CD1 4.16Å; V145-L166 HydrophobicContact CG1-CB 4.38Å; V145-L166 HydrophobicContact CG1-CD1 4.04Å; V145-L166 HydrophobicContact CG2-CD1 3.9Å; Q149-L166 HydrophobicContact CB-CD2 4.4Å; I150-L166 HydrophobicContact CG2-CD1 4.09Å; I150-L166 HydrophobicContact CG2-CD2 4.46Å; C162-L166 WeakPolarHBondContact O-CG 3.1Å; C162-L166 PolarHBondContact O-N 2.8Å; C162-L166 VanDerWaalsContact O-N 3.09Å; A163-L166 CarbonylContact O-C 3.24Å; A163-L166 PolarHBondContact O-N 3.18Å; A163-L166 VanDerWaalsContact O-N 3.12Å; E164-L166 PolarHBondContact O-N 2.89Å; L166-T169 WeakPolarHBondContact CA-OG1 3.38Å; L166-T169 PolarHBondContact O-OG1 2.87Å; L166-T169 VanDerWaalsContact O-OG1 3.06Å; L166-N170 WeakPolarHBondContact O-CB 3.49Å; L166-N170 PolarHBondContact O-N 3.36Å
167	I	73.8	Confident	62.7	Low	84 Å²	84	84 Å²	84	43%	0.431	44%	0.441	S	S	.	.	H	α-helix	trans	-73	-48.2	179	-68.4	163.9	0	0	0	110.2	A163 E164 T169 N170 T171	A163-I167 HydrophobicContact CB-CD1 4.46Å; A163-I167 WeakPolarHBondContact O-CB 3.24Å; A163-I167 VanDerWaalsContact O-CG1 3.24Å; A163-I167 WeakPolarHBondContact O-CG1 3.31Å; A163-I167 PolarHBondContact O-N 3.49Å; E164-I167 PolarHBondContact O-N 2.88Å; I167-T169 PolarHBondContact O-N 2.98Å; I167-N170 PolarHBondContact O-N 3.26Å; I167-T171 HydrophobicContact CG2-CG2 3.89Å; I167-T171 WeakPolarHBondContact O-CG2 3.37Å; I167-T171 PolarHBondContact O-N 3.28Å; I167-T171 PolarHBondContact O-OG1 2.99Å
168	S	68.2	Low	59.1	Low	65 Å²	65	87.7 Å²	87.7	46%	0.455	47%	0.466	S	S	.	.	H	α-helix	trans	-63.2	-22.8	178.6	58.9	0	0	0	0	114	E164 T165	E164-S168 VanDerWaalsContact O-CB 3.22Å; E164-S168 WeakPolarHBondContact O-CB 3.43Å; E164-S168 PolarHBondContact O-N 3.48Å; E164-S168 PolarHBondContact O-OG 3.23Å; T165-S168 PolarHBondContact O-OG 3Å
169	T	56.2	Low	55.8	Low	82 Å²	82	95.4 Å²	95.4	50%	0.503	51%	0.507	S	S	.	.	H	α-helix	trans	-84.5	-16.2	171.8	47.4	0	0	0	0	113.6	T165 L166 I167	T165-T169 WeakPolarHBondContact O-CG2 3.28Å; T165-T169 PolarHBondContact O-N 3.47Å; T165-T169 PolarHBondContact O-OG1 2.75Å; L166-T169 WeakPolarHBondContact CA-OG1 3.38Å; L166-T169 PolarHBondContact O-OG1 2.87Å; L166-T169 VanDerWaalsContact O-OG1 3.06Å; I167-T169 PolarHBondContact O-N 2.98Å
170	N	47.3	Very low	52.2	Low	52 Å²	52	103 Å²	103	28%	0.278	54%	0.54	S	S	.	.	H	α-helix	trans	-106.1	-25.8	-175.6	-147.9	-0.9	0	0	0	113.5	Q149 L166 I167 N172 K173	Q149-N170 PolarHBondContact NE2-ND2 2.78Å; L166-N170 WeakPolarHBondContact O-CB 3.49Å; L166-N170 PolarHBondContact O-N 3.36Å; I167-N170 PolarHBondContact O-N 3.26Å; N170-N172 PolarHBondContact O-N 2.83Å; N170-K173 PolarHBondContact O-N 3.36Å; N170-K173 PolarHBondContact OD1-NZ 2.92Å
171	T	34.4	Very low	48.9	Very low	98 Å²	98	109 Å²	109	60%	0.601	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	7.1	177.5	51.4	0	0	0	0	115.2	I167 K173	I167-T171 HydrophobicContact CG2-CG2 3.89Å; I167-T171 WeakPolarHBondContact O-CG2 3.37Å; I167-T171 PolarHBondContact O-N 3.28Å; I167-T171 PolarHBondContact O-OG1 2.99Å; T171-K173 PolarHBondContact O-N 3.34Å
172	N	27.9	Very low	45.6	Very low	119 Å²	119	106.2 Å²	106.2	64%	0.636	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	24.3	165.8	-82.9	-77.5	0	0	0	113.1	N170	N170-N172 PolarHBondContact O-N 2.83Å
173	K	23.7	Very low	42.1	Very low	142 Å²	142	111 Å²	111	62%	0.617	60%	0.601	S	S	*	*	S	Bend	trans	-108.5	124.1	163.5	-70.7	168.3	-178.4	155.5	0	108.4	N170 T171 E175	N170-K173 PolarHBondContact O-N 3.36Å; N170-K173 PolarHBondContact OD1-NZ 2.92Å; T171-K173 PolarHBondContact O-N 3.34Å; K173-E175 PolarHBondContact O-N 3.24Å
174	P	26.8	Very low	38.8	Very low	122 Å²	122	121.6 Å²	121.6	79%	0.792	64%	0.641	S	S	*	*			trans	-73.1	122.6	174.9	29.8	-32.3	0	0	0	109.8
175	E	21.9	Very low	35.7	Very low	191 Å²	191	120.2 Å²	120.2	89%	0.893	65%	0.646	S	S	*	*			trans	-76.5	138.1	171.6	-66.1	-169	137	0	0	110.6	K173 S177	K173-E175 PolarHBondContact O-N 3.24Å; E175-S177 PolarHBondContact O-N 3.29Å; E175-S177 VanDerWaalsContact O-N 3.13Å
176	H	23.4	Very low	32.8	Very low	190 Å²	190	125.2 Å²	125.2	88%	0.88	67%	0.67	S	S	*	*			trans	-77.5	93.9	175.4	-83.7	-103.5	0	0	0	110.3
177	S	23.3	Very low	29.8	Very low	109 Å²	109	130.4 Å²	130.4	76%	0.762	70%	0.698	S	S	*	*			trans	-67.1	133	152.3	56.6	0	0	0	0	109	E175	E175-S177 PolarHBondContact O-N 3.29Å; E175-S177 VanDerWaalsContact O-N 3.13Å
178	L	18.5	Very low	27.2	Very low	158 Å²	158	131.8 Å²	131.8	83%	0.827	71%	0.71	S	S	*	*			trans	-67.4	148.6	174.4	-57.1	95.9	0	0	0	110.4
179	D	23.3	Very low	25	Very low	162 Å²	162	135.6 Å²	135.6	87%	0.866	73%	0.726	S	S	*	*				-151.4	166.6	125.6	-136.8	-29.4	0	0	0	112.6
180	K	18.3	Very low	23.4	Very low	163 Å²	163	139.1 Å²	139.1	71%	0.709	74%	0.741	S	S	*	*			trans	-114.1	156.8	179.2	-66.8	175.7	-179.6	172.6	0	110.8
181	N	19.9	Very low	22.2	Very low	163 Å²	163	144.1 Å²	144.1	87%	0.872	77%	0.767	S	S	*	*			trans	72.8	144.9	172.8	-42.5	-41.5	0	0	0	113
182	S	21.2	Very low	21.7	Very low	101 Å²	101	146.1 Å²	146.1	71%	0.706	77%	0.769	S	S	*	*			cis	-156.5	155.8	3.4	83.5	0	0	0	0	113.5
183	V	19.9	Very low	21.5	Very low	112 Å²	112	143.6 Å²	143.6	68%	0.679	77%	0.771	S	S	*	*			trans	63	107.2	135	173.8	0	0	0	0	121.2
184	R	19.2	Very low	21.6	Very low	224 Å²	224	144.3 Å²	144.3	85%	0.845	78%	0.78	S	S	*	*			trans	63.5	161	130.5	-65.2	-177.2	178.1	158.8	-3.8	122.9
185	S	20.6	Very low	21.4	Very low	104 Å²	104	145.5 Å²	145.5	73%	0.727	77%	0.773	S	S	*	*			trans	73.2	116.9	161.2	4.9	0	0	0	0	115.4
186	L	18.5	Very low	21.3	Very low	161 Å²	161	142 Å²	142	84%	0.843	76%	0.755	S	S	*	*				80.4	145.2	50.8	-73.9	171.1	0	0	0	114.4
187	N	19.1	Very low	21.4	Very low	136 Å²	136	140.9 Å²	140.9	73%	0.727	75%	0.747	S	S	*	*			trans	69.7	123.7	-178.4	-56.1	-0.8	0	0	0	112.9
188	T	20	Very low	21.2	Very low	113 Å²	113	141 Å²	141	69%	0.693	74%	0.739	S	S	*	*				59.8	86	52.6	76.1	0	0	0	0	112.6
189	D	22	Very low	21.4	Very low	146 Å²	146	134.9 Å²	134.9	78%	0.781	71%	0.709	S	S	*	*				-175.3	-175.8	113.3	-91.6	-16.7	0	0	0	111.8
190	N	22.9	Very low	21.3	Very low	156 Å²	156	134 Å²	134	83%	0.834	70%	0.703	S	S	*	*			trans	77.3	33.1	169.3	-53.9	-59	0	0	0	118.2
191	I	21.8	Very low	21.5	Very low	157 Å²	157	134.8 Å²	134.8	81%	0.805	71%	0.714	S	S	*	*	S	Bend	trans	-64.1	147	137.9	-57.1	-179.3	0	0	0	107.3
192	H	22.6	Very low	21.6	Very low	140 Å²	140	133.7 Å²	133.7	65%	0.648	70%	0.704	S	S	*	*			trans	78.6	44.6	177.9	-94.3	-99.8	0	0	0	117.9	K195	H192-K195 VanDerWaalsContact CE1-CD 3.47Å; H192-K195 WeakPolarHBondContact CE1-CD 3.39Å; H192-K195 PolarHBondContact NE2-NZ 3.42Å
193	G	25.4	Very low	21.6	Very low	66 Å²	66	137.8 Å²	137.8	68%	0.68	71%	0.709	S	S	*	*	S	Bend	trans	-95	-25.4	168.6	0	0	0	0	0	117.5
194	L	24.9	Very low	21.7	Very low	156 Å²	156	138.5 Å²	138.5	82%	0.817	71%	0.714	S	S	*	*			trans	-132.6	27.5	-169.9	-99.7	98.2	0	0	0	116.1	K196	L194-K196 PolarHBondContact O-N 3.36Å
195	K	22	Very low	21.9	Very low	147 Å²	147	136.4 Å²	136.4	64%	0.639	71%	0.714	S	S	*	*	S	Bend	trans	-75.7	117.5	159	-91.7	173	178.3	169	0	108.5	H192	H192-K195 VanDerWaalsContact CE1-CD 3.47Å; H192-K195 WeakPolarHBondContact CE1-CD 3.39Å; H192-K195 PolarHBondContact NE2-NZ 3.42Å
196	K	21.4	Very low	21.9	Very low	118 Å²	118	142.2 Å²	142.2	51%	0.513	72%	0.72	S	S	.	*			trans	49.6	101.3	-163.7	-54.9	-166.9	178.4	-175.9	0	116.5	A39 S40 F41 L194	A39-K196 WeakPolarHBondContact O-CB 3.31Å; A39-K196 WeakPolarHBondContact O-CD 2.9Å; A39-K196 VanDerWaalsContact O-CG 3.27Å; A39-K196 WeakPolarHBondContact O-CG 3.26Å; S40-K196 WeakPolarHBondContact O-CD 3.32Å; F41-K196 PolarHBondContact O-NZ 3.3Å; L194-K196 PolarHBondContact O-N 3.36Å
197	K	24.1	Very low	22	Very low	166 Å²	166	140.4 Å²	140.4	72%	0.722	71%	0.711	S	S	*	*				-117.9	73.2	124	-93.2	-177.3	170	-179.9	0	106.2
198	I	20.4	Very low	22	Very low	112 Å²	112	140.1 Å²	140.1	57%	0.574	71%	0.709	S	S	*	*				-45.4	103.6	79.8	-52.7	178.9	0	0	0	114.6	S40 F41	S40-I198 VanDerWaalsContact O-O 3.11Å; F41-I198 HydrophobicContact CB-CG2 4.48Å
199	S	21.3	Very low	22	Very low	29 Å²	29	140.3 Å²	140.3	20%	0.203	71%	0.71	C	S	.	*			trans	173	138.5	160.3	179.5	0	0	0	0	105.9	F41	F41-S199 WeakPolarHBondContact CD2-OG 3.37Å; F41-S199 WeakPolarHBondContact CE2-OG 3.45Å; F41-S199 WeakPolarHBondContact CG-OG 3.23Å; F41-S199 WeakPolarHBondContact CZ-OG 3.34Å
200	L	21.6	Very low	22	Very low	143 Å²	143	144 Å²	144	75%	0.749	71%	0.713	S	S	*	*			trans	65.4	95.9	-169.5	-44.7	155.8	0	0	0	109.3
201	L	23.2	Very low	22.6	Very low	180 Å²	180	141 Å²	141	94%	0.942	70%	0.703	S	S	*	*				-143.8	75.4	73.2	-88.3	148.1	0	0	0	113.2
202	E	20.6	Very low	22.6	Very low	140 Å²	140	142.5 Å²	142.5	65%	0.654	70%	0.703	S	S	*	*			trans	-99	105.7	154.4	-75.7	-173	105.5	0	0	109.3
203	K	22.6	Very low	22.8	Very low	187 Å²	187	140.3 Å²	140.3	81%	0.813	70%	0.704	S	S	*	*			trans	-152.4	121.8	157.5	-84.3	-155.2	176.3	-177.6	0	111.5
204	T	22.2	Very low	23.3	Very low	128 Å²	128	143.6 Å²	143.6	79%	0.785	71%	0.711	S	S	*	*			trans	71.8	163.1	167	73.6	0	0	0	0	117.5
205	Q	23.6	Very low	23.6	Very low	179 Å²	179	141.9 Å²	141.9	84%	0.836	71%	0.708	S	S	*	*			trans	66.5	84.7	177.8	-49	-164.8	32.1	0	0	113
206	R	20	Very low	23.5	Very low	227 Å²	227	139.2 Å²	139.2	86%	0.857	71%	0.708	S	S	*	*			cis	68.2	134.8	34.7	-153.7	-164.7	-162.5	174.4	7.2	112.8
207	N	20.9	Very low	23.6	Very low	123 Å²	123	141.8 Å²	141.8	66%	0.658	72%	0.722	S	S	*	*			trans	79	124.7	176.9	-61.8	-28.2	0	0	0	115.3
208	N	19.4	Very low	23.5	Very low	130 Å²	130	139.8 Å²	139.8	70%	0.695	72%	0.723	S	S	*	*			cis	87.8	137.4	42.4	-74.5	-47	0	0	0	113.3
209	T	19.3	Very low	23.7	Very low	116 Å²	116	139.1 Å²	139.1	71%	0.712	73%	0.729	S	S	*	*			trans	66.9	126.7	153.7	47.5	0	0	0	0	118.4
210	R	22.3	Very low	23.6	Very low	223 Å²	223	146.1 Å²	146.1	84%	0.842	76%	0.758	S	S	*	*			cis	74.5	135.8	42.9	-177.6	-162.2	-175.2	-144.6	8	111.5
211	P	35.1	Very low	23.7	Very low	94 Å²	94	146.8 Å²	146.8	61%	0.61	76%	0.761	S	S	*	*			cis	-129.2	-144.5	-18.5	33.3	-10.1	0	0	0	110.6
212	K	22.1	Very low	23.8	Very low	188 Å²	188	142.9 Å²	142.9	82%	0.817	75%	0.749	S	S	*	*			trans	76.9	148.3	156.9	-72.9	161.3	-178.3	-174.9	0	117.1
213	S	25.4	Very low	23.8	Very low	95 Å²	95	143 Å²	143	66%	0.664	75%	0.754	S	S	*	*			cis	-170.4	150.1	-10.8	46.2	0	0	0	0	113.8
214	V	36.9	Very low	23.8	Very low	135 Å²	135	142.4 Å²	142.4	82%	0.818	76%	0.759	S	S	*	*				48.1	119.9	129.6	-179.5	0	0	0	0	117.4
215	P	30.5	Very low	23.9	Very low	119 Å²	119	142.9 Å²	142.9	77%	0.773	76%	0.757	S	S	*	*				-145.4	173.4	86.8	41	-25.2	0	0	0	117.4
216	S	21	Very low	23.6	Very low	91 Å²	91	142.7 Å²	142.7	64%	0.636	76%	0.76	S	S	*	*			trans	-63.9	154	161.3	48.1	0	0	0	0	113
217	H	23.9	Very low	23.6	Very low	172 Å²	172	140.5 Å²	140.5	80%	0.796	75%	0.751	S	S	*	*				-179.5	110	127.5	-95.7	-69.4	0	0	0	112.2
218	V	22.3	Very low	23.5	Very low	125 Å²	125	141.3 Å²	141.3	76%	0.758	75%	0.753	S	S	*	*			trans	42.1	147.5	141.6	-154.2	0	0	0	0	122.3
219	S	22.9	Very low	23.6	Very low	98 Å²	98	139.5 Å²	139.5	69%	0.685	75%	0.75	S	S	*	*			trans	71.4	114.2	152.6	42.7	0	0	0	0	122.4
220	H	20.5	Very low	23.6	Very low	175 Å²	175	140.4 Å²	140.4	81%	0.81	76%	0.756	S	S	*	*				21.6	139.6	126.1	-74.8	-94.5	0	0	0	123.2
221	L	22.4	Very low	23.4	Very low	158 Å²	158	133.5 Å²	133.5	83%	0.827	75%	0.754	S	S	*	*			trans	72.7	150.1	151.5	-67.9	162	0	0	0	117.1
222	S	25.1	Very low	22.6	Very low	97 Å²	97	136.5 Å²	136.5	68%	0.678	76%	0.764	S	S	*	*			cis	-136.3	158.3	10.5	53.9	0	0	0	0	114.9
223	N	21.6	Very low	22.4	Very low	144 Å²	144	134.2 Å²	134.2	77%	0.77	76%	0.76	S	S	*	*			trans	68	67.3	160.3	-61.9	-1.4	0	0	0	120.7
224	L	22.4	Very low	22.1	Very low	173 Å²	173	135.5 Å²	135.5	91%	0.906	76%	0.76	S	S	*	*				60.9	113.4	128.1	-80.5	158.8	0	0	0	121.5
225	N	23.5	Very low	21.2	Very low	138 Å²	138	135 Å²	135	74%	0.738	75%	0.751	S	S	*	*			trans	-91.2	134.4	166.6	-109.6	-85.4	0	0	0	112.6	R227	N225-R227 HydrophobicContact CB-CB 4.41Å
226	I	18.8	Very low	20.7	Very low	176 Å²	176	133.9 Å²	133.9	90%	0.903	75%	0.746	S	S	*	*			trans	-129.5	89.5	140.9	-57.2	178.9	0	0	0	104.5
227	R	20.4	Very low	20.6	Very low	181 Å²	181	136.5 Å²	136.5	68%	0.683	75%	0.753	S	S	*	*			cis	91.3	136.9	44.6	-159.3	-158.6	179.1	-179.5	2.4	112.2	N225	N225-R227 HydrophobicContact CB-CB 4.41Å
228	M	18.8	Very low	20.5	Very low	139 Å²	139	132.2 Å²	132.2	69%	0.685	74%	0.742	S	S	*	*			trans	78.1	156.4	168.9	-54.2	-50.2	-137.6	0	0	118.3
229	S	20.2	Very low	20.4	Very low	92 Å²	92	135.4 Å²	135.4	64%	0.643	75%	0.746	S	S	*	*			cis	-169.6	170.9	-43.7	57.6	0	0	0	0	110.2
230	T	19.4	Very low	20.3	Very low	136 Å²	136	135.2 Å²	135.2	83%	0.834	75%	0.75	S	S	*	*			trans	-50.2	147.9	151.4	50.3	0	0	0	0	111.8
231	G	18.2	Very low	20.2	Very low	78 Å²	78	131.8 Å²	131.8	80%	0.804	75%	0.746	S	S	*	*			trans	179.1	114.1	171.1	0	0	0	0	0	116
232	L	18.3	Very low	20.1	Very low	157 Å²	157	131.1 Å²	131.1	82%	0.822	74%	0.743	S	S	*	*			trans	-58.9	146.4	172.5	-71.6	154	0	0	0	115.2
233	L	18.5	Very low	19.8	Very low	139 Å²	139	131.7 Å²	131.7	73%	0.728	74%	0.742	S	S	*	*			trans	68.3	144	134.6	-69	170.2	0	0	0	122.7
234	N	18.7	Very low	19.7	Very low	123 Å²	123	130.4 Å²	130.4	66%	0.658	74%	0.744	S	S	*	*			trans	85.5	142.4	134.6	-86	-2.1	0	0	0	122.5
235	I	18.5	Very low	19.7	Very low	125 Å²	125	127.4 Å²	127.4	64%	0.641	74%	0.735	S	S	*	*			trans	59.3	95.4	141	-65	166.8	0	0	0	113.8
236	S	19.4	Very low	19.5	Very low	94 Å²	94	125.6 Å²	125.6	66%	0.657	73%	0.733	S	S	*	*				63	161.1	72.3	88.4	0	0	0	0	113.6
237	N	19.9	Very low	19.5	Very low	146 Å²	146	127.4 Å²	127.4	78%	0.781	73%	0.73	S	S	*	*			trans	69.9	153.9	-169.1	-56.4	-43.4	0	0	0	114.1
238	S	21.1	Very low	19.6	Very low	82 Å²	82	127.2 Å²	127.2	57%	0.573	74%	0.742	S	S	*	*			cis	-173.2	164.5	-23.8	57.6	0	0	0	0	110.3
239	K	20.3	Very low	19.7	Very low	193 Å²	193	126.5 Å²	126.5	84%	0.839	74%	0.741	S	S	*	*			trans	61.3	136.8	146.1	-72.4	163.6	-179.5	178.4	0	120
240	A	20.2	Very low	19.6	Very low	93 Å²	93	131.5 Å²	131.5	77%	0.769	75%	0.746	S	S	*	*			trans	70.7	140.3	147.9	0	0	0	0	0	119.9
241	S	19.4	Very low	19.5	Very low	104 Å²	104	132.4 Å²	132.4	73%	0.727	74%	0.744	S	S	*	*	S	Bend	trans	61.6	96.1	161.9	-159.4	0	0	0	0	118
242	L	18.7	Very low	19.6	Very low	144 Å²	144	132.8 Å²	132.8	75%	0.754	74%	0.739	S	S	*	*	S	Bend	cis	-133.9	116.7	-23	-86.6	103.6	0	0	0	104.7
243	T	18.7	Very low	19.6	Very low	109 Å²	109	131.2 Å²	131.2	67%	0.669	74%	0.736	S	S	*	*				48.6	126.9	91.5	63.1	0	0	0	0	114.3
244	S	20.5	Very low	19.6	Very low	116 Å²	116	130.8 Å²	130.8	81%	0.811	73%	0.734	S	S	*	*			cis	-119.7	152.3	17	-70.3	0	0	0	0	114.3
245	P	21.6	Very low	19.5	Very low	110 Å²	110	132.6 Å²	132.6	71%	0.714	74%	0.743	S	S	*	*			trans	-96.4	-163	-173.6	41.2	-38.3	0	0	0	113.1
246	S	19.2	Very low	19.5	Very low	100 Å²	100	131.1 Å²	131.1	70%	0.699	75%	0.75	S	S	*	*			trans	71.9	115.3	156.4	45.7	0	0	0	0	119.5
247	Y	18.6	Very low	19.7	Very low	214 Å²	214	132.1 Å²	132.1	84%	0.839	76%	0.756	S	S	*	*				37.4	129.1	117.6	-86.4	-98.5	0	0	0	119.2	N249	Y247-N249 PolarHBondContact O-N 2.97Å
248	L	24	Very low	20.6	Very low	178 Å²	178	130 Å²	130	93%	0.932	75%	0.751	S	S	*	*			trans	-51	106.2	144.7	-84.2	166.5	0	0	0	109.9
249	N	19.3	Very low	20.5	Very low	124 Å²	124	132.7 Å²	132.7	66%	0.663	76%	0.759	S	S	*	*			trans	-151.3	92.7	163.4	-137.6	-7.9	0	0	0	112.2	Y247	Y247-N249 PolarHBondContact O-N 2.97Å
250	R	18.3	Very low	20.4	Very low	197 Å²	197	130 Å²	130	74%	0.743	75%	0.754	S	S	*	*			trans	68.6	149.9	133	-85.5	-178	167.2	179.8	-5.8	121.9
251	I	18.9	Very low	20.3	Very low	155 Å²	155	130.3 Å²	130.3	80%	0.795	75%	0.75	S	S	*	*			trans	85.2	152.5	149	-70.7	154.1	0	0	0	117.5
252	A	18.6	Very low	20.2	Very low	86 Å²	86	131.1 Å²	131.1	71%	0.711	75%	0.751	S	S	*	*			trans	76.5	119.1	-177.8	0	0	0	0	0	115.6
253	V	18.1	Very low	20.3	Very low	123 Å²	123	129.1 Å²	129.1	75%	0.745	75%	0.749	S	S	*	*			cis	98.3	126.7	17.8	-176.9	0	0	0	0	114.2
254	D	18.5	Very low	20.5	Very low	131 Å²	131	130 Å²	130	70%	0.701	76%	0.755	S	S	*	*			trans	67.1	113	161.2	-62.9	-11.7	0	0	0	123.7
255	L	17.6	Very low	20.6	Very low	161 Å²	161	129.5 Å²	129.5	84%	0.843	75%	0.751	S	S	*	*				55.6	139.6	124.2	-81.4	70.7	0	0	0	123.6
256	A	18.1	Very low	20.5	Very low	94 Å²	94	129.9 Å²	129.9	78%	0.777	76%	0.756	S	S	*	*			trans	86.1	121.5	144.8	0	0	0	0	0	121.8
257	S	24.4	Very low	20.7	Very low	114 Å²	114	129.2 Å²	129.2	80%	0.797	76%	0.757	S	S	*	*				14.8	163.6	123	-66.8	0	0	0	0	122.2
258	P	38.9	Very low	20.8	Very low	103 Å²	103	126.6 Å²	126.6	67%	0.669	76%	0.757	S	S	*	*			cis	-139.3	-154.1	-14	32	-7.1	0	0	0	113.2
259	N	18.3	Very low	20.7	Very low	137 Å²	137	127.6 Å²	127.6	73%	0.733	76%	0.757	S	S	*	*			trans	83.1	129.8	148.7	-71.3	-9.3	0	0	0	122
260	N	18.1	Very low	20.6	Very low	137 Å²	137	127 Å²	127	73%	0.733	76%	0.762	S	S	*	*			trans	26.8	136.9	131	-61.1	-11.6	0	0	0	122
261	S	18.2	Very low	20.6	Very low	100 Å²	100	129.7 Å²	129.7	70%	0.699	77%	0.772	S	S	*	*			trans	71.3	138.3	135.6	63.1	0	0	0	0	120.7
262	T	18.4	Very low	20.6	Very low	120 Å²	120	128.9 Å²	128.9	74%	0.736	77%	0.769	S	S	*	*			trans	52.2	114	147.5	51.6	0	0	0	0	119.8
263	S	19.3	Very low	20.7	Very low	103 Å²	103	133 Å²	133	72%	0.72	78%	0.778	S	S	*	*			trans	68.9	141.8	147.3	63.9	0	0	0	0	119.8
264	T	23.8	Very low	20.7	Very low	128 Å²	128	135.3 Å²	135.3	79%	0.785	78%	0.778	S	S	*	*			trans	68.1	125.4	168.3	59.8	0	0	0	0	119.3
265	S	23	Very low	20.8	Very low	105 Å²	105	133.6 Å²	133.6	73%	0.734	77%	0.774	S	S	*	*			trans	59.2	121.8	152.8	51	0	0	0	0	122.3
266	S	19.4	Very low	21	Very low	118 Å²	118	128.6 Å²	128.6	83%	0.825	75%	0.751	S	S	*	*			trans	88.1	150.9	143.6	77.3	0	0	0	0	121.3
267	A	22.7	Very low	21	Very low	86 Å²	86	130.7 Å²	130.7	71%	0.711	74%	0.743	S	S	*	*			trans	79.4	132.7	166.4	0	0	0	0	0	121
268	D	20.6	Very low	20.9	Very low	159 Å²	159	132.9 Å²	132.9	85%	0.85	74%	0.738	S	S	*	*			trans	53.3	85.2	149.5	-57.8	-8.9	0	0	0	121
269	E	21.7	Very low	20.1	Very low	199 Å²	199	131.1 Å²	131.1	93%	0.93	73%	0.728	S	S	*	*			trans	-76	113.8	167.8	-62.5	173.6	147	0	0	112.1
270	C	18.7	Very low	20.1	Very low	112 Å²	112	126.5 Å²	126.5	76%	0.757	71%	0.709	S	S	*	*			trans	-85.8	122	167.9	-86.5	0	0	0	0	111.7	D272	C270-D272 PolarHBondContact O-N 3.39Å
271	R	18.2	Very low	20.3	Very low	253 Å²	253	123.6 Å²	123.6	96%	0.955	70%	0.696	S	S	*	*			trans	31.5	59.2	150.7	-72.5	-178.6	162.5	157.9	-4.7	117.1
272	D	18.8	Very low	20.4	Very low	138 Å²	138	127.4 Å²	127.4	74%	0.738	70%	0.7	S	S	*	*			trans	-90.5	129.2	172.6	-100	-44.7	0	0	0	112.3	C270	C270-D272 PolarHBondContact O-N 3.39Å
273	L	19.3	Very low	20.7	Very low	172 Å²	172	126.3 Å²	126.3	90%	0.901	70%	0.695	S	S	*	*			trans	-137.4	73.1	176.1	-77.1	170.4	0	0	0	110.2
274	F	18.2	Very low	20.6	Very low	172 Å²	172	127.9 Å²	127.9	75%	0.754	70%	0.696	S	S	*	*			trans	-142.2	137.5	-177.2	-94	-74.2	0	0	0	114.1
275	P	21.8	Very low	20.5	Very low	95 Å²	95	125 Å²	125	62%	0.617	69%	0.691	S	S	*	*				-140.6	160.4	121.2	37.8	-25.6	0	0	0	113.3
276	T	20.6	Very low	20.2	Very low	56 Å²	56	126.2 Å²	126.2	34%	0.344	69%	0.69	S	S	.	*			cis	95.5	81.5	10	79.8	0	0	0	0	119.7	T313 P314	T276-T313 VanDerWaalsContact CA-O 3.3Å; T276-T313 WeakPolarHBondContact CA-O 3.16Å; T276-P314 HydrophobicContact CG2-CB 4.36Å
277	F	19.6	Very low	20.1	Very low	138 Å²	138	126.4 Å²	126.4	61%	0.605	68%	0.681	S	S	*	*			trans	-156.9	120.5	172.9	-96	-95.9	0	0	0	116	T313	F277-T313 PolarHBondContact N-O 2.96Å
278	F	21.4	Very low	19.9	Very low	160 Å²	160	127.9 Å²	127.9	70%	0.702	69%	0.693	S	S	*	*			trans	36.4	145.5	151.4	-63.8	-104.1	0	0	0	124.1
279	S	21.1	Very low	19.8	Very low	65 Å²	65	123.7 Å²	123.7	46%	0.455	68%	0.677	S	S	.	*			cis	114.5	122.3	8.3	-179.9	0	0	0	0	116.4	L292 D293	S279-L292 WeakPolarHBondContact O-CD2 3.36Å; S279-D293 WeakPolarHBondContact CA-OD1 3.44Å; S279-D293 WeakPolarHBondContact CA-OD2 3.42Å; S279-D293 PolarHBondContact N-OD1 2.92Å; S279-D293 PolarHBondContact N-OD2 2.76Å
280	A	20.1	Very low	21.1	Very low	40 Å²	40	119.1 Å²	119.1	33%	0.331	66%	0.664	S	S	.	*			cis	-161.6	171.5	-9.4	0	0	0	0	0	115.8	L292 D293	A280-L292 VanDerWaalsContact C-C 3.48Å; A280-D293 VanDerWaalsContact CA-N 3.32Å; A280-D293 HydrophobicContact CB-CB 3.99Å
281	T	20.5	Very low	21.1	Very low	76 Å²	76	117.3 Å²	117.3	47%	0.466	65%	0.653	S	S	.	*			trans	71	122.4	156.9	48.5	0	0	0	0	127.7	S291 L292 D293	T281-S291 CarbonylContact C-O 3.53Å; T281-L292 VanDerWaalsContact N-C 3.32Å; T281-L292 PolarHBondContact N-O 3.42Å; T281-D293 PolarHBondContact N-O 3.16Å
282	F	20.4	Very low	21.2	Very low	180 Å²	180	109.5 Å²	109.5	79%	0.789	63%	0.63	S	S	*	*				164.3	179.7	124.9	-92.6	-52.9	0	0	0	115.9
283	P	25.7	Very low	21.4	Very low	97 Å²	97	106.3 Å²	106.3	63%	0.63	61%	0.612	S	S	*	*			trans	-119.1	173.4	-152.1	45.3	-31.8	0	0	0	117.9
284	N	17.7	Very low	21.5	Very low	137 Å²	137	103.1 Å²	103.1	73%	0.733	60%	0.604	S	S	*	*			trans	26.3	125.6	151	-142.5	47.5	0	0	0	119.5	N286	N284-N286 CarbonylContact O-C 3.33Å
285	G	20.3	Very low	21.7	Very low	67 Å²	67	101.5 Å²	101.5	69%	0.691	60%	0.602	S	S	*	*	S	Bend	trans	-70.4	126.6	157.6	0	0	0	0	0	110.2
286	N	16.7	Very low	21.6	Very low	131 Å²	131	107.6 Å²	107.6	70%	0.701	61%	0.613	S	S	*	*	S	Bend	cis	10	95.5	-15.1	-65.6	5.7	0	0	0	121.3	N284	N284-N286 CarbonylContact O-C 3.33Å
287	N	17.8	Very low	21.7	Very low	122 Å²	122	112.9 Å²	112.9	65%	0.652	63%	0.634	S	S	*	*	S	Bend	trans	74.8	132	156.3	-46.7	-25.3	0	0	0	114.1	S289	N287-S289 WeakPolarHBondContact CB-OG 3.22Å; N287-S289 PolarHBondContact O-N 3.48Å; N287-S289 VanDerWaalsContact O-N 3.12Å; N287-S289 PolarHBondContact O-OG 3.08Å
288	A	18.1	Very low	21.7	Very low	116 Å²	116	111.1 Å²	111.1	96%	0.959	63%	0.634	S	S	*	*				50.4	37.9	68.9	0	0	0	0	0	112.7
289	S	18.7	Very low	21.6	Very low	72 Å²	72	111.6 Å²	111.6	50%	0.503	64%	0.641	S	S	.	*			trans	-139.1	157.2	-178.1	-39.2	0	0	0	0	110.2	N287	N287-S289 WeakPolarHBondContact CB-OG 3.22Å; N287-S289 PolarHBondContact O-N 3.48Å; N287-S289 VanDerWaalsContact O-N 3.12Å; N287-S289 PolarHBondContact O-OG 3.08Å
290	P	48.7	Very low	21.5	Very low	102 Å²	102	117.6 Å²	117.6	66%	0.662	66%	0.661	S	S	*	*			trans	-113.8	176.8	-163.9	41.4	-33.5	0	0	0	116.8
291	S	19	Very low	21.3	Very low	74 Å²	74	121.6 Å²	121.6	52%	0.517	68%	0.682	S	S	.	*			trans	70.7	116.8	154.7	58.6	0	0	0	0	122.7	T281	T281-S291 CarbonylContact C-O 3.53Å
292	L	21	Very low	21.1	Very low	90 Å²	90	123.2 Å²	123.2	47%	0.471	69%	0.691	S	S	.	*			trans	63.2	175.7	136.2	-102.5	42.3	0	0	0	120.9	S279 A280 T281	S279-L292 WeakPolarHBondContact O-CD2 3.36Å; A280-L292 VanDerWaalsContact C-C 3.48Å; T281-L292 VanDerWaalsContact N-C 3.32Å; T281-L292 PolarHBondContact N-O 3.42Å
293	D	22.3	Very low	21	Very low	70 Å²	70	122.6 Å²	122.6	37%	0.374	69%	0.691	S	S	.	*			trans	-38.8	149.1	-152.3	-53	21.2	0	0	0	122.8	S279 A280 T281	S279-D293 WeakPolarHBondContact CA-OD1 3.44Å; S279-D293 WeakPolarHBondContact CA-OD2 3.42Å; S279-D293 PolarHBondContact N-OD1 2.92Å; S279-D293 PolarHBondContact N-OD2 2.76Å; A280-D293 VanDerWaalsContact CA-N 3.32Å; A280-D293 HydrophobicContact CB-CB 3.99Å; T281-D293 PolarHBondContact N-O 3.16Å
294	S	22.6	Very low	20.7	Very low	105 Å²	105	122.8 Å²	122.8	73%	0.734	70%	0.695	S	S	*	*			trans	-140.2	133.2	138.6	-81.2	0	0	0	0	107.5
295	I	21.8	Very low	20.7	Very low	138 Å²	138	120.7 Å²	120.7	71%	0.708	69%	0.691	S	S	*	*				93.9	110.4	61.3	-74.3	167.3	0	0	0	113.2
296	R	20	Very low	20.7	Very low	224 Å²	224	123 Å²	123	85%	0.845	69%	0.691	S	S	*	*			trans	52.3	157	145.4	-63.3	176	178.9	158.4	-1.9	122.5
297	Q	21.7	Very low	21.1	Very low	167 Å²	167	126.8 Å²	126.8	78%	0.78	70%	0.702	S	S	*	*			trans	104.1	133.6	133.4	-129	169.8	-16.5	0	0	118.9
298	T	19.9	Very low	21.4	Very low	100 Å²	100	124.6 Å²	124.6	61%	0.613	71%	0.708	S	S	*	*			trans	48.4	110.4	147.5	40.8	0	0	0	0	119.2
299	M	19.8	Very low	21.6	Very low	171 Å²	171	125.5 Å²	125.5	84%	0.842	70%	0.701	S	S	*	*				88.7	142.8	80.6	-85.8	179.4	151.5	0	0	113.7	T301	M299-T301 PolarHBondContact O-N 3.07Å
300	H	18	Very low	21.7	Very low	191 Å²	191	128.9 Å²	128.9	88%	0.884	71%	0.712	S	S	*	*			trans	-57.4	120.7	166	-76.3	-118.2	0	0	0	111.3
301	T	17.3	Very low	20.4	Very low	123 Å²	123	133.4 Å²	133.4	76%	0.755	72%	0.716	S	S	*	*			trans	-163.4	140.4	143.3	22	0	0	0	0	108.8	M299	M299-T301 PolarHBondContact O-N 3.07Å
302	V	16.6	Very low	20.6	Very low	111 Å²	111	139.1 Å²	139.1	67%	0.673	73%	0.726	S	S	*	*				50	131.1	128	-176.5	0	0	0	0	119.4
303	E	18	Very low	21.2	Very low	167 Å²	167	139.1 Å²	139.1	78%	0.78	73%	0.73	S	S	*	*			trans	68.6	124.3	153.3	-77.6	159.3	-151	0	0	122
304	S	18.2	Very low	22	Very low	101 Å²	101	140.5 Å²	140.5	71%	0.706	74%	0.743	S	S	*	*				81.6	147.5	124.2	82.3	0	0	0	0	122.6
305	S	17.8	Very low	22	Very low	93 Å²	93	145.2 Å²	145.2	65%	0.65	75%	0.745	S	S	*	*			trans	25.1	138.8	143	54.1	0	0	0	0	124.5
306	T	21.5	Very low	22.1	Very low	115 Å²	115	145.3 Å²	145.3	71%	0.706	75%	0.745	S	S	*	*			trans	85.5	114	136.6	41.3	0	0	0	0	123.8
307	F	24.8	Very low	22.2	Very low	211 Å²	211	139.3 Å²	139.3	93%	0.925	74%	0.738	S	S	*	*			trans	58.1	121.1	145.6	-64.8	-74.1	0	0	0	123.9
308	G	22.9	Very low	22.3	Very low	75 Å²	75	141 Å²	141	77%	0.773	75%	0.745	S	S	*	*			trans	130.9	112.9	134	0	0	0	0	0	124.6
309	V	22.5	Very low	22.4	Very low	136 Å²	136	139.9 Å²	139.9	82%	0.824	75%	0.754	S	S	*	*				57.9	112	126.9	-177.5	0	0	0	0	125.9
310	I	21.1	Very low	22.4	Very low	143 Å²	143	139.9 Å²	139.9	73%	0.733	76%	0.757	S	S	*	*			trans	63.7	126.6	133.4	-60.6	179	0	0	0	126.6
311	R	21.4	Very low	22.6	Very low	197 Å²	197	136.5 Å²	136.5	74%	0.743	75%	0.749	S	S	*	*			trans	74.8	130.5	150.1	-84.3	173.4	-172	-163.4	5.4	126.5
312	R	22.7	Very low	22.7	Very low	193 Å²	193	137.8 Å²	137.8	73%	0.728	75%	0.751	S	S	*	*			trans	58.4	168.8	146.5	-67.8	-171.7	177.4	-178.8	-0.5	120.4
313	T	33.4	Very low	22.8	Very low	90 Å²	90	139 Å²	139	55%	0.552	75%	0.754	S	S	*	*			trans	-152.7	151.4	-155.5	59.5	0	0	0	0	116.9	T276 F277	T276-T313 VanDerWaalsContact CA-O 3.3Å; T276-T313 WeakPolarHBondContact CA-O 3.16Å; F277-T313 PolarHBondContact N-O 2.96Å
314	P	39.5	Very low	22.8	Very low	100 Å²	100	139.3 Å²	139.3	65%	0.649	76%	0.755	S	S	*	*			trans	-153.7	148.8	157	37.4	-17.2	0	0	0	121.1	T276	T276-P314 HydrophobicContact CG2-CB 4.36Å
315	R	23	Very low	22.9	Very low	204 Å²	204	139.9 Å²	139.9	77%	0.77	76%	0.759	S	S	*	*			trans	77	128.7	143.7	-77.7	-177.8	174.1	-178.1	0.9	125.8
316	I	23.6	Very low	22.8	Very low	139 Å²	139	143 Å²	143	71%	0.713	77%	0.767	S	S	*	*				68.2	122.7	124	-59.5	173.6	0	0	0	124
317	S	22.4	Very low	22.6	Very low	98 Å²	98	143.5 Å²	143.5	69%	0.685	77%	0.766	S	S	*	*			trans	62.5	135.4	146.1	78.8	0	0	0	0	126.5
318	Q	23	Very low	22.3	Very low	202 Å²	202	140 Å²	140	94%	0.944	76%	0.755	S	S	*	*			trans	48.6	130.2	142.7	-69.3	-173.5	-9.7	0	0	122.4
319	G	22.5	Very low	22	Very low	78 Å²	78	143 Å²	143	80%	0.804	75%	0.754	S	S	*	*			trans	178.8	158.1	166.8	0	0	0	0	0	113.5
320	L	21	Very low	21.8	Very low	171 Å²	171	144.6 Å²	144.6	90%	0.895	76%	0.756	S	S	*	*			trans	-143.8	172.2	-176	-107.1	169.9	0	0	0	111.3
321	V	21.1	Very low	21.6	Very low	120 Å²	120	146.3 Å²	146.3	73%	0.727	76%	0.758	S	S	*	*			trans	88.4	122.2	163.3	-171.2	0	0	0	0	118.5
322	L	19.1	Very low	21.4	Very low	149 Å²	149	142.8 Å²	142.8	78%	0.78	76%	0.764	S	S	*	*			trans	26.5	157.8	141.3	-50.3	173.5	0	0	0	121.1
323	N	18.7	Very low	21.5	Very low	138 Å²	138	137.9 Å²	137.9	74%	0.738	77%	0.765	S	S	*	*			cis	-162.8	-170.2	29.7	-143.1	14.1	0	0	0	113.6
324	E	19.5	Very low	20.9	Very low	173 Å²	173	139.8 Å²	139.8	81%	0.808	78%	0.778	S	S	*	*			trans	-88.8	161.3	-173.2	-51	168.7	127	0	0	116.4
325	S	18.5	Very low	19.8	Very low	112 Å²	112	144.6 Å²	144.6	78%	0.783	79%	0.79	S	S	*	*			trans	-175	136.2	146.2	16.5	0	0	0	0	115.4
326	L	16.8	Very low	19.6	Very low	159 Å²	159	144.5 Å²	144.5	83%	0.832	80%	0.795	S	S	*	*			trans	33.8	148.7	139.9	-60.1	165.7	0	0	0	121.2
327	N	17.6	Very low	19.2	Very low	125 Å²	125	146.4 Å²	146.4	67%	0.668	80%	0.798	S	S	*	*			cis	-165.7	157.4	29.8	-144.9	1.1	0	0	0	115.4
328	I	17.3	Very low	19	Very low	138 Å²	138	148.8 Å²	148.8	71%	0.708	80%	0.801	S	S	*	*			trans	69.9	124.1	156.2	-66.2	157.4	0	0	0	121.4
329	D	16.9	Very low	18.6	Very low	139 Å²	139	143.5 Å²	143.5	74%	0.743	79%	0.787	S	S	*	*			trans	-90.6	156.2	166.3	-47.8	-96	0	0	0	114.3
330	I	18.1	Very low	18.4	Very low	168 Å²	168	144.6 Å²	144.6	86%	0.862	78%	0.782	S	S	*	*			trans	-138.9	139.7	145.9	-63	-173	0	0	0	109.7
331	F	17.2	Very low	18.2	Very low	180 Å²	180	140.6 Å²	140.6	79%	0.789	77%	0.768	S	S	*	*			trans	-101.1	162.9	-174.7	-110.1	-99.2	0	0	0	114.5
332	S	18.2	Very low	18.1	Very low	122 Å²	122	143 Å²	143	85%	0.853	77%	0.771	S	S	*	*			trans	79.8	158.6	151.5	78.9	0	0	0	0	120.4
333	A	23.4	Very low	17.9	Very low	91 Å²	91	139.5 Å²	139.5	75%	0.752	76%	0.759	S	S	*	*			trans	-118.9	169.7	-177.5	0	0	0	0	0	111.4
334	P	22.3	Very low	17.8	Very low	129 Å²	129	141.4 Å²	141.4	84%	0.838	76%	0.761	S	S	*	*			trans	-143.3	157.5	140.5	37.5	-23.4	0	0	0	116.6
335	F	15.2	Very low	17.7	Very low	202 Å²	202	140.6 Å²	140.6	89%	0.886	76%	0.757	S	S	*	*			trans	-74.3	149.7	164	-86.3	-112.7	0	0	0	112.7
336	K	18.1	Very low	17.6	Very low	202 Å²	202	140.1 Å²	140.1	88%	0.878	75%	0.753	S	S	*	*			trans	167.7	167.8	136.5	-93.4	157.5	-178.6	178.6	0	110.5
337	K	16.6	Very low	17.8	Very low	179 Å²	179	140.1 Å²	140.1	78%	0.778	75%	0.753	S	S	*	*			cis	177.6	165.3	-41	-153.5	-176.2	-179.6	-177	0	106.9
338	I	16.9	Very low	18	Very low	148 Å²	148	140.1 Å²	140.1	76%	0.759	76%	0.76	S	S	*	*			trans	75.1	138.5	161.8	-61.1	160.2	0	0	0	115
339	S	16.4	Very low	18	Very low	91 Å²	91	138.5 Å²	138.5	64%	0.636	76%	0.76	S	S	*	*			cis	-170.6	161.1	-20	61.1	0	0	0	0	113.3
340	S	17.3	Very low	18.1	Very low	101 Å²	101	137.4 Å²	137.4	71%	0.706	76%	0.764	S	S	*	*			trans	14	149.2	139.1	65.6	0	0	0	0	121.4
341	S	17	Very low	18.1	Very low	86 Å²	86	133.4 Å²	133.4	60%	0.601	76%	0.756	S	S	*	*			cis	174.3	176.1	11.7	35.4	0	0	0	0	112.9
342	H	18.1	Very low	18.1	Very low	171 Å²	171	130.1 Å²	130.1	79%	0.792	76%	0.755	S	S	*	*			trans	77.2	158.7	158	-66.8	-66.1	0	0	0	119.7
343	S	16.8	Very low	18.1	Very low	76 Å²	76	133 Å²	133	53%	0.531	76%	0.755	S	S	.	*				-177.5	178.9	-54	47.9	0	0	0	0	110.4
344	F	16.4	Very low	17.8	Very low	178 Å²	178	133.6 Å²	133.6	78%	0.781	75%	0.754	S	S	*	*			trans	75.5	157.8	177	-63	-89.1	0	0	0	117.6
345	E	16.1	Very low	17.5	Very low	156 Å²	156	134.5 Å²	134.5	73%	0.729	75%	0.751	S	S	*	*			cis	-168	167.1	-45.5	-129.3	176	-164.3	0	0	111.8
346	C	17.9	Very low	17.7	Very low	102 Å²	102	132.4 Å²	132.4	69%	0.689	74%	0.742	S	S	*	*			trans	45.8	123.4	154.8	-68.1	0	0	0	0	124.9
347	L	20.8	Very low	17.8	Very low	158 Å²	158	125.4 Å²	125.4	83%	0.827	71%	0.714	S	S	*	*				24.4	145.8	115.9	-77.8	160.8	0	0	0	120.4
348	P	21.6	Very low	18.5	Very low	126 Å²	126	119.4 Å²	119.4	82%	0.818	69%	0.693	S	S	*	*				-149.9	-149.2	60.6	42.8	-21.2	0	0	0	116.9
349	S	16.7	Very low	18.7	Very low	103 Å²	103	115.9 Å²	115.9	72%	0.72	68%	0.682	S	S	*	*			trans	-129	167.1	-154	57.6	0	0	0	0	116.1
350	S	18.1	Very low	19	Very low	116 Å²	116	117.8 Å²	117.8	81%	0.811	70%	0.695	S	S	*	*				146.5	159	122.3	65.1	0	0	0	0	118.5
351	A	18.4	Very low	19.2	Very low	84 Å²	84	116.8 Å²	116.8	69%	0.694	70%	0.701	S	S	*	*			trans	80.9	122.6	149.7	0	0	0	0	0	125
352	S	17.9	Very low	19.4	Very low	112 Å²	112	121.7 Å²	121.7	78%	0.783	71%	0.714	S	S	*	*			trans	60.5	159.8	138.4	55.3	0	0	0	0	123.2
353	Q	17.9	Very low	19.7	Very low	181 Å²	181	121.3 Å²	121.3	85%	0.846	72%	0.718	S	S	*	*			cis	-168.2	148.8	-45.1	-124.6	-179.2	8.8	0	0	111.6
354	S	17.4	Very low	19.9	Very low	104 Å²	104	124.9 Å²	124.9	73%	0.727	73%	0.73	S	S	*	*			trans	76.5	164.7	152.5	82	0	0	0	0	124
355	L	16.8	Very low	20.2	Very low	148 Å²	148	123.9 Å²	123.9	78%	0.775	73%	0.731	S	S	*	*			trans	92.3	74.1	156.9	-71.7	157.7	0	0	0	123.5
356	F	18.4	Very low	20.5	Very low	159 Å²	159	126.2 Å²	126.2	70%	0.697	74%	0.735	S	S	*	*				50.1	148.6	123.8	-68.9	-75.7	0	0	0	127.1	N1041	F356-N1041 VanDerWaalsContact CD1-OD1 3.28Å; F356-N1041 WeakPolarHBondContact CD1-OD1 3.39Å; F356-N1041 VanDerWaalsContact CE1-OD1 3.32Å; F356-N1041 WeakPolarHBondContact CE1-OD1 3.33Å
357	N	21.4	Very low	20.7	Very low	55 Å²	55	127.3 Å²	127.3	29%	0.294	73%	0.733	S	S	.	*			trans	-75.2	-171.5	175.6	-98.8	-59.3	0	0	0	115.5	S1040 D1042	N357-S1040 WeakPolarHBondContact CB-OG 3.42Å; N357-D1042 PolarHBondContact ND2-OD2 2.74Å
358	P	30.9	Very low	20.6	Very low	53 Å²	53	129 Å²	129	34%	0.344	73%	0.729	S	S	.	*			cis	-140.9	179	-24.1	41.4	-25.1	0	0	0	117.2	I1039 S1040	P358-I1039 HydrophobicContact CG-CG2 4.3Å; P358-S1040 WeakPolarHBondContact CG-OG 3.45Å
359	S	20.1	Very low	20.6	Very low	73 Å²	73	127.3 Å²	127.3	51%	0.51	72%	0.72	S	S	.	*			trans	24.7	124.7	142.8	70.4	0	0	0	0	123.8
360	S	22.7	Very low	20.8	Very low	131 Å²	131	131.9 Å²	131.9	92%	0.916	72%	0.721	S	S	*	*				151.9	157.2	121.1	60.4	0	0	0	0	112.9
361	G	20.9	Very low	20.8	Very low	80 Å²	80	133.7 Å²	133.7	83%	0.825	72%	0.721	S	S	*	*			trans	129.3	121	171.7	0	0	0	0	0	114.5
362	Q	23.3	Very low	20.9	Very low	190 Å²	190	142 Å²	142	89%	0.888	74%	0.735	S	S	*	*			trans	-102.2	128.2	163.4	-68.5	171.7	-105.2	0	0	108.1
363	D	22.4	Very low	21.1	Very low	162 Å²	162	140.5 Å²	140.5	87%	0.866	73%	0.729	S	S	*	*			trans	179.5	-174.7	138.7	-96.8	-25.6	0	0	0	109.7
364	I	22.7	Very low	21.2	Very low	152 Å²	152	139.5 Å²	139.5	78%	0.779	73%	0.729	S	S	*	*			trans	67.5	50.4	-174.5	-36.8	177.8	0	0	0	113.3
365	L	22.5	Very low	21.4	Very low	156 Å²	156	139.8 Å²	139.8	82%	0.817	73%	0.732	S	S	*	*			trans	-112.7	7.5	150.4	-114.4	172.6	0	0	0	113
366	Y	22.4	Very low	21.5	Very low	205 Å²	205	138.7 Å²	138.7	80%	0.804	73%	0.733	S	S	*	*	S	Bend	trans	-89.8	-9.6	-177.8	-171.1	-110.3	0	0	0	114.8
367	L	20.8	Very low	21.6	Very low	125 Å²	125	139.6 Å²	139.6	65%	0.654	74%	0.737	S	S	*	*	S	Bend	trans	-100	-8.2	-179.4	-122.3	77.1	0	0	0	115.1
368	W	19.9	Very low	21.6	Very low	195 Å²	195	144 Å²	144	74%	0.739	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.9	22.3	-169.4	-95.2	48.8	0	0	0	115.1	F484	W368-F484 HydrophobicContact CE3-CD2 4.36Å; W368-F484 HydrophobicContact CE3-CE2 4.49Å; W368-F484 HydrophobicContact CH2-CB 3.84Å; W368-F484 AromaticContact CH2-CD2 3.56Å; W368-F484 HydrophobicContact CH2-CD2 3.56Å; W368-F484 HydrophobicContact CH2-CE2 4.4Å; W368-F484 AromaticContact CH2-CG 3.93Å; W368-F484 HydrophobicContact CH2-CG 3.93Å; W368-F484 HydrophobicContact CZ2-CD2 4.49Å; W368-F484 AromaticContact CZ3-CD2 3.48Å; W368-F484 HydrophobicContact CZ3-CD2 3.48Å; W368-F484 VanDerWaalsContact CZ3-CD2 3.48Å; W368-F484 AromaticContact CZ3-CE2 3.86Å; W368-F484 HydrophobicContact CZ3-CE2 3.86Å; W368-F484 HydrophobicContact CZ3-CG 4.14Å
369	S	21.1	Very low	21.1	Very low	90 Å²	90	148.5 Å²	148.5	63%	0.629	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.6	13.7	173.4	58.5	0	0	0	0	114.3
370	R	20.1	Very low	21.1	Very low	198 Å²	198	154.4 Å²	154.4	75%	0.747	80%	0.801	S	S	*	*	S	Bend	trans	-139.6	19.2	-177.3	-136.8	-176.7	-171.9	-169.3	1.4	117.8
371	L	19.1	Very low	21	Very low	154 Å²	154	156.7 Å²	156.7	81%	0.806	79%	0.794	S	S	*	*	S	Bend	trans	-126.2	16.2	176.3	-80.8	172.6	0	0	0	114.9
372	W	21.4	Very low	21.1	Very low	259 Å²	259	157.5 Å²	157.5	98%	0.981	79%	0.787	S	S	*	*			trans	-124.4	59.3	168.2	-86	70.6	0	0	0	110.6
373	A	20.9	Very low	21	Very low	80 Å²	80	153.6 Å²	153.6	66%	0.661	78%	0.776	S	S	*	*			trans	-131.1	59.1	174.2	0	0	0	0	0	110.3
374	N	20.2	Very low	21	Very low	160 Å²	160	149 Å²	149	86%	0.856	75%	0.751	S	S	*	*			trans	-176.5	134.7	150.6	-94.7	-30.7	0	0	0	109.4
375	S	20.6	Very low	20.9	Very low	111 Å²	111	144.6 Å²	144.6	78%	0.776	73%	0.734	S	S	*	*			trans	-84.8	145.4	174.4	50.3	0	0	0	0	111.6
376	P	20.3	Very low	20.9	Very low	125 Å²	125	143.1 Å²	143.1	81%	0.812	73%	0.726	S	S	*	*			trans	-100.5	160.5	136.7	-13.1	30.8	0	0	0	110.5
377	K	19.3	Very low	20.9	Very low	177 Å²	177	136.1 Å²	136.1	77%	0.77	71%	0.706	S	S	*	*			trans	-89.9	178	170.9	-61	176	-178.3	174.8	0	110
378	D	21.9	Very low	20.9	Very low	149 Å²	149	136.7 Å²	136.7	80%	0.797	71%	0.706	S	S	*	*			trans	70.3	53.4	155	-45.5	-36.4	0	0	0	117.5
379	L	21.4	Very low	20.9	Very low	146 Å²	146	132.2 Å²	132.2	76%	0.764	70%	0.696	S	S	*	*			trans	-153.3	134.1	149.2	-137.8	71.4	0	0	0	111.1	F381	L379-F381 HydrophobicContact CB-CE2 4.25Å; L379-F381 WeakPolarHBondContact O-CD2 3.3Å
380	E	20.2	Very low	21	Very low	198 Å²	198	131.3 Å²	131.3	93%	0.925	69%	0.687	S	S	*	*			trans	-84.7	115.9	-175.6	-68.8	-168.4	135.1	0	0	112.9
381	F	20.1	Very low	21	Very low	179 Å²	179	125.2 Å²	125.2	79%	0.785	68%	0.679	S	S	*	*			trans	-101.4	111.9	174.2	-67.8	-92.5	0	0	0	110.8	L379	L379-F381 HydrophobicContact CB-CE2 4.25Å; L379-F381 WeakPolarHBondContact O-CD2 3.3Å
382	S	22.1	Very low	21	Very low	96 Å²	96	122.7 Å²	122.7	67%	0.671	67%	0.673	S	S	*	*			trans	-112	121.9	177.7	53.4	0	0	0	0	112.5	I384	S382-I384 PolarHBondContact O-N 2.86Å
383	T	20.8	Very low	20.9	Very low	108 Å²	108	113.3 Å²	113.3	66%	0.663	65%	0.647	S	S	*	*			trans	-87.6	90.5	176.6	-56.7	0	0	0	0	109.4	S385	T383-S385 PolarHBondContact O-N 2.9Å
384	I	22.5	Very low	21	Very low	67 Å²	67	113 Å²	113	34%	0.344	64%	0.638	S	S	.	*			trans	-74.1	111.8	-172.3	-64.4	177.7	0	0	0	111.2	S382 Q388 L389	S382-I384 PolarHBondContact O-N 2.86Å; I384-Q388 HydrophobicContact CG2-CB 4.23Å; I384-L389 HydrophobicContact CG2-CD1 4.37Å; I384-L389 HydrophobicContact CG2-CG 4.09Å
385	S	22.3	Very low	21	Very low	58 Å²	58	106.2 Å²	106.2	41%	0.406	61%	0.605	S	S	.	*			trans	-68.6	147.3	157.3	-178.3	0	0	0	0	109.4	T383 S387 Q388	T383-S385 PolarHBondContact O-N 2.9Å; S385-S387 PolarHBondContact O-N 2.96Å; S385-S387 PolarHBondContact OG-OG 2.81Å; S385-Q388 PolarHBondContact O-N 3.47Å
386	I	21.8	Very low	21.7	Very low	126 Å²	126	102.6 Å²	102.6	65%	0.646	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-58.9	-23.6	-174.3	-66.5	172.8	0	0	0	112.4	Q388	I386-Q388 PolarHBondContact O-N 3.41Å
387	S	22.1	Very low	21.6	Very low	57 Å²	57	101.8 Å²	101.8	40%	0.399	57%	0.567	S	S	.	*	G	3₁₀ helix	trans	-70.8	3	172.1	60.6	0	0	0	0	115.6	S385	S385-S387 PolarHBondContact O-N 2.96Å; S385-S387 PolarHBondContact OG-OG 2.81Å
388	Q	21.1	Very low	21.7	Very low	138 Å²	138	97.9 Å²	97.9	65%	0.645	56%	0.562	S	S	*	*	G	3₁₀ helix	trans	-121.3	6.3	179.5	-76.1	-175.9	-29.1	0	0	114.4	I384 S385 I386 T390	I384-Q388 HydrophobicContact CG2-CB 4.23Å; S385-Q388 PolarHBondContact O-N 3.47Å; I386-Q388 PolarHBondContact O-N 3.41Å; Q388-T390 PolarHBondContact O-N 2.98Å
389	L	19.7	Very low	21.6	Very low	101 Å²	101	101.7 Å²	101.7	53%	0.529	57%	0.565	S	S	.	*	S	Bend	trans	-84.4	8.4	165.3	-96.2	163.6	0	0	0	113.1	I384	I384-L389 HydrophobicContact CG2-CD1 4.37Å; I384-L389 HydrophobicContact CG2-CG 4.09Å
390	T	22.2	Very low	21.3	Very low	71 Å²	71	100 Å²	100	44%	0.436	56%	0.561	S	S	.	*			trans	-131.3	82.1	-175.1	53.6	0	0	0	0	112.6	Q388 L542	Q388-T390 PolarHBondContact O-N 2.98Å; T390-L542 VanDerWaalsContact C-CD2 3.49Å; T390-L542 VanDerWaalsContact CA-CD2 3.45Å; T390-L542 HydrophobicContact CG2-CB 4.14Å; T390-L542 HydrophobicContact CG2-CD2 4.16Å; T390-L542 WeakPolarHBondContact O-CD1 3.39Å
391	A	20.3	Very low	21.2	Very low	70 Å²	70	98.5 Å²	98.5	58%	0.579	55%	0.554	S	S	*	*			trans	-173.6	81.2	160	0	0	0	0	0	113.3
392	S	19.3	Very low	21.2	Very low	100 Å²	100	93.4 Å²	93.4	70%	0.699	54%	0.54	S	S	*	.			trans	-159.9	113.8	173.6	57.5	0	0	0	0	115.9
393	S	20.9	Very low	21.1	Very low	62 Å²	62	95.1 Å²	95.1	43%	0.434	54%	0.537	S	S	.	.			trans	-156.5	48.2	165.4	51.8	0	0	0	0	112.7	N546	S393-N546 WeakPolarHBondContact CA-OD1 3.43Å; S393-N546 PolarHBondContact N-OD1 3.35Å; S393-N546 PolarHBondContact O-ND2 3.46Å; S393-N546 PolarHBondContact O-OD1 2.88Å; S393-N546 PolarHBondContact OG-ND2 3.46Å; S393-N546 VanDerWaalsContact OG-ND2 3.17Å; S393-N546 PolarHBondContact OG-OD1 2.9Å
394	T	21.2	Very low	21	Very low	75 Å²	75	92.8 Å²	92.8	46%	0.46	53%	0.525	S	S	.	.			trans	-77.2	141.1	-156.9	51.1	0	0	0	0	118.1	R505 N546	T394-R505 VanDerWaalsContact O-CG 3.26Å; T394-R505 WeakPolarHBondContact O-CG 3.43Å; T394-R505 PolarHBondContact O-NE 2.75Å; T394-R505 PolarHBondContact O-NH2 3.1Å; T394-N546 WeakPolarHBondContact CA-OD1 3.25Å; T394-N546 PolarHBondContact N-OD1 3.46Å
395	G	21.8	Very low	20.9	Very low	16 Å²	16	94.8 Å²	94.8	17%	0.165	54%	0.537	C	S	.	.			trans	103.6	-169.3	158.6	0	0	0	0	0	115.6	R505 R506	G395-R505 VanDerWaalsContact C-CG 3.49Å; G395-R505 CarbonylContact O-C 3.42Å; G395-R505 WeakPolarHBondContact O-CA 3.36Å; G395-R505 VanDerWaalsContact O-CG 3.31Å; G395-R505 WeakPolarHBondContact O-CG 3.46Å; G395-R506 CarbonylContact O-C 3.51Å; G395-R506 WeakPolarHBondContact O-CA 3.35Å; G395-R506 PolarHBondContact O-N 3.14Å
396	P	34.9	Very low	20.8	Very low	36 Å²	36	98.7 Å²	98.7	23%	0.234	55%	0.549	C	S	.	.			cis	-114.2	-135.1	-27.5	42.2	-23.9	0	0	0	108.4	R505	P396-R505 WeakPolarHBondContact CD-O 3.4Å; P396-R505 HydrophobicContact CG-CB 4.35Å; P396-R505 HydrophobicContact CG-CG 4.34Å
397	L	18.7	Very low	20.8	Very low	107 Å²	107	99 Å²	99	56%	0.56	55%	0.551	S	S	*	*			trans	59.5	92.8	-151.7	-102.3	-167.4	0	0	0	111.2	R506	L397-R506 HydrophobicContact CB-CG 4.22Å
398	S	20.7	Very low	20.6	Very low	95 Å²	95	104 Å²	104	66%	0.664	57%	0.573	S	S	*	*				-16.7	148.6	129.1	54.1	0	0	0	0	114.9
399	R	18.7	Very low	20.7	Very low	229 Å²	229	103.8 Å²	103.8	86%	0.864	58%	0.581	S	S	*	*			cis	-161.3	132.8	39.3	-169.9	171.2	-179.2	173.8	1	112.8
400	V	16.9	Very low	20.8	Very low	112 Å²	112	106.5 Å²	106.5	68%	0.679	59%	0.591	S	S	*	*			trans	77.8	121.8	150.4	162.1	0	0	0	0	120.7
401	H	17.8	Very low	20.8	Very low	166 Å²	166	107.4 Å²	107.4	77%	0.769	59%	0.593	S	S	*	*			trans	61	93.4	154.3	-66	-41.1	0	0	0	124
402	S	18.8	Very low	20.9	Very low	71 Å²	71	109.6 Å²	109.6	50%	0.497	60%	0.595	S	S	.	*				61.8	143.3	118.6	57.4	0	0	0	0	124.3
403	H	19.8	Very low	21.2	Very low	132 Å²	132	108.2 Å²	108.2	61%	0.611	59%	0.585	S	S	*	*			trans	92	74.9	163.4	-55.1	-66.9	0	0	0	120.9	E551	H403-E551 IonicContact CE1-OE1 3.18Å; H403-E551 IonicContact CE1-OE2 2.78Å; H403-E551 PolarHBondContact CE1-OE2 2.86Å; H403-E551 VanDerWaalsContact CE1-OE2 3.25Å; H403-E551 IonicContact CG-OE1 2.87Å; H403-E551 IonicContact CG-OE2 2.96Å; H403-E551 IonicContact ND1-OE1 2.72Å; H403-E551 PolarHBondContact ND1-OE1 3.5Å; H403-E551 IonicContact ND1-OE2 3.64Å; H403-E551 PolarHBondContact ND1-OE2 3.13Å
404	S	20	Very low	21.5	Very low	59 Å²	59	110.6 Å²	110.6	41%	0.413	60%	0.602	S	S	.	*				78.4	129	106.5	73.4	0	0	0	0	125.4
405	N	19.4	Very low	21.6	Very low	110 Å²	110	113 Å²	113	59%	0.588	62%	0.621	S	S	*	*			trans	83.2	104.7	132.8	-161.3	40.5	0	0	0	122.7	N550	N405-N550 WeakPolarHBondContact CA-O 3.29Å; N405-N550 WeakPolarHBondContact CB-O 3.47Å; N405-N550 PolarHBondContact N-O 3.37Å
406	E	19.8	Very low	22	Very low	140 Å²	140	119.7 Å²	119.7	65%	0.654	65%	0.645	S	S	*	*			trans	-155.4	140.9	141.8	-126	-164	-145.8	0	0	114.9
407	N	22.3	Very low	21.9	Very low	131 Å²	131	121.2 Å²	121.2	70%	0.701	66%	0.657	S	S	*	*			trans	54.7	108.5	154.4	-70	-44	0	0	0	123.3
408	L	18.6	Very low	23	Very low	163 Å²	163	118 Å²	118	85%	0.853	64%	0.64	S	S	*	*			trans	-90.9	148.9	162.7	-75.6	68	0	0	0	111.8
409	T	23.2	Very low	24.1	Very low	133 Å²	133	118.1 Å²	118.1	82%	0.816	63%	0.63	S	S	*	*			trans	-142.9	137.8	154.6	33	0	0	0	0	114.6
410	Q	22.5	Very low	25.2	Very low	159 Å²	159	111.1 Å²	111.1	74%	0.743	61%	0.61	S	S	*	*			trans	70.5	102.2	158.7	-65.2	179.8	-8.4	0	0	120.6
411	D	21.8	Very low	26.9	Very low	90 Å²	90	108.4 Å²	108.4	48%	0.481	59%	0.589	S	S	.	*			trans	-73.4	156	168.6	-67.8	-41.2	0	0	0	114.3	H988 R990	D411-H988 PolarHBondContact O-CE1 2.63Å; D411-H988 PolarHBondContact O-NE2 2.75Å; D411-R990 IonicContact OD2-CZ 3.17Å; D411-R990 IonicContact OD2-NH1 2.64Å; D411-R990 PolarHBondContact OD2-NH1 3.37Å; D411-R990 IonicContact OD2-NH2 2.69Å; D411-R990 PolarHBondContact OD2-NH2 3.3Å
412	N	21.7	Very low	28.3	Very low	116 Å²	116	106.1 Å²	106.1	62%	0.62	57%	0.573	S	S	*	*			trans	-107.2	125.8	164.3	-87.2	-53.2	0	0	0	112
413	S	26.1	Very low	29.6	Very low	70 Å²	70	106.1 Å²	106.1	49%	0.49	57%	0.568	S	S	.	*			trans	-170.4	137.3	168.3	61.3	0	0	0	0	111.7
414	S	26.5	Very low	30.7	Very low	113 Å²	113	106.8 Å²	106.8	79%	0.79	57%	0.568	S	S	*	*			cis	-165.2	128.6	-10.1	44.4	0	0	0	0	111.4
415	C	22.7	Very low	31.8	Very low	126 Å²	126	109 Å²	109	85%	0.851	58%	0.576	S	S	*	*	S	Bend	trans	-88.2	154.5	155.7	-160.2	0	0	0	0	109.2	S417	C415-S417 PolarHBondContact O-N 2.97Å
416	K	30.4	Very low	32.9	Very low	155 Å²	155	112.5 Å²	112.5	67%	0.674	59%	0.589	S	S	*	*			trans	-76.7	82.3	-175.4	-68.1	-178.7	-177	173.4	0	111.8
417	S	33.3	Very low	34	Very low	68 Å²	68	113.4 Å²	113.4	48%	0.476	60%	0.598	S	S	.	*			trans	-64.6	153.9	171.5	50.9	0	0	0	0	112.4	C415 Q419	C415-S417 PolarHBondContact O-N 2.97Å; S417-Q419 PolarHBondContact O-N 2.96Å
418	L	41	Very low	34.6	Very low	40 Å²	40	112.2 Å²	112.2	21%	0.209	59%	0.588	C	S	.	*			trans	-64.4	118.7	168	-177	76	0	0	0	108.7	L420 V437 L438 W441	L418-L420 HydrophobicContact CD2-CD2 3.69Å; L418-L420 HydrophobicContact CD2-CG 4.23Å; L418-L420 HydrophobicContact CG-CD2 4.11Å; L418-L420 HydrophobicContact CG-CG 4.46Å; L418-L420 PolarHBondContact O-N 2.84Å; L418-V437 HydrophobicContact CD1-CG1 3.91Å; L418-L438 HydrophobicContact CD1-CB 4.37Å; L418-L438 HydrophobicContact CD1-CD1 3.82Å; L418-L438 HydrophobicContact CD2-CD1 4.06Å; L418-W441 HydrophobicContact CB-CD2 4.39Å; L418-W441 HydrophobicContact CB-CG 4.1Å; L418-W441 HydrophobicContact CD1-CB 3.67Å; L418-W441 HydrophobicContact CD1-CD2 4.3Å; L418-W441 HydrophobicContact CD1-CG 3.91Å
419	Q	43.7	Very low	35.9	Very low	97 Å²	97	107.5 Å²	107.5	45%	0.453	56%	0.562	S	S	.	*			trans	-73	114.4	174.8	-71	-179.2	-37.4	0	0	109.8	S417 F421 T433 V437	S417-Q419 PolarHBondContact O-N 2.96Å; Q419-F421 HydrophobicContact CB-CE2 3.97Å; Q419-F421 HydrophobicContact CB-CZ 4.46Å; Q419-T433 PolarHBondContact O-OG1 3.12Å; Q419-V437 HydrophobicContact CB-CG1 4.16Å
420	L	43.1	Very low	37.6	Very low	83 Å²	83	103.7 Å²	103.7	44%	0.435	53%	0.533	S	S	.	.			trans	-107.8	118.5	173.5	-63.8	-178.1	0	0	0	109	L418 L489	L418-L420 HydrophobicContact CD2-CD2 3.69Å; L418-L420 HydrophobicContact CD2-CG 4.23Å; L418-L420 HydrophobicContact CG-CD2 4.11Å; L418-L420 HydrophobicContact CG-CG 4.46Å; L418-L420 PolarHBondContact O-N 2.84Å; L420-L489 HydrophobicContact CD2-CD1 3.38Å
421	F	52.6	Low	39.8	Very low	55 Å²	55	100.3 Å²	100.3	24%	0.241	51%	0.514	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.2	176.5	-65.7	-94.7	0	0	0	108.7	Q419 L423 C432 Y434 F486	Q419-F421 HydrophobicContact CB-CE2 3.97Å; Q419-F421 HydrophobicContact CB-CZ 4.46Å; F421-L423 PolarHBondContact O-N 2.76Å; F421-C432 HydrophobicContact CB-CB 4.31Å; F421-C432 PolarHBondContact N-O 2.93Å; F421-C432 WeakPolarHBondContact O-CB 3.42Å; F421-C432 PolarHBondContact O-N 3.01Å; F421-Y434 HydrophobicContact CD2-CD2 4.36Å; F421-Y434 HydrophobicContact CD2-CE2 4.11Å; F421-Y434 HydrophobicContact CE1-CE2 4.33Å; F421-Y434 AromaticContact CE2-CD2 3.63Å; F421-Y434 HydrophobicContact CE2-CD2 3.63Å; F421-Y434 AromaticContact CE2-CE2 3.31Å; F421-Y434 HydrophobicContact CE2-CE2 3.31Å; F421-Y434 HydrophobicContact CZ-CD2 4.2Å; F421-Y434 AromaticContact CZ-CE2 3.46Å; F421-Y434 HydrophobicContact CZ-CE2 3.46Å; F421-Y434 VanDerWaalsContact CZ-CE2 3.46Å; F421-F486 HydrophobicContact CB-CE1 4.13Å; F421-F486 HydrophobicContact CD2-CE1 4.16Å; F421-F486 HydrophobicContact CG-CE1 4.02Å
422	R	47.2	Very low	41.7	Very low	117 Å²	117	96 Å²	96	44%	0.442	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	94.1	174.8	-174.6	-178.8	-178.2	-171.4	1.3	108.5	E429 Y430 Y431	R422-E429 IonicContact CZ-OE1 3.67Å; R422-E429 IonicContact CZ-OE2 3.08Å; R422-E429 IonicContact NE-OE1 3.13Å; R422-E429 IonicContact NE-OE2 2.84Å; R422-E429 PolarHBondContact NE-OE2 3.19Å; R422-E429 VanDerWaalsContact NH2-CD 3.32Å; R422-E429 IonicContact NH2-OE1 3.25Å; R422-E429 PolarHBondContact NH2-OE1 3.07Å; R422-E429 IonicContact NH2-OE2 3.55Å; R422-E429 PolarHBondContact NH2-OE2 3.5Å; R422-Y430 CarbonylContact C-O 3.53Å; R422-Y430 WeakPolarHBondContact CA-O 3.47Å; R422-Y431 HydrophobicContact CB-CE1 4.4Å; R422-Y431 HydrophobicContact CG-CE1 4.28Å
423	L	46.2	Very low	44.1	Very low	72 Å²	72	90.5 Å²	90.5	38%	0.377	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	124.8	171.1	-75.2	175.2	0	0	0	108.8	F421 Y430 C432	F421-L423 PolarHBondContact O-N 2.76Å; L423-Y430 PolarHBondContact N-O 2.84Å; L423-Y430 PolarHBondContact O-N 3.14Å; L423-C432 HydrophobicContact CD1-CB 4.47Å
424	K	43.3	Very low	46.3	Very low	145 Å²	145	89.5 Å²	89.5	63%	0.63	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-111.8	115.3	177	-177.7	163.8	-168.7	149.9	0	108.8	E429	K424-E429 HydrophobicContact CB-CG 4.22Å; K424-E429 HydrophobicContact CD-CG 4.01Å; K424-E429 WeakPolarHBondContact CD-OE1 3.33Å; K424-E429 WeakPolarHBondContact CE-OE1 3.48Å; K424-E429 HydrophobicContact CG-CG 3.91Å; K424-E429 IonicContact NZ-OE1 3.38Å; K424-E429 PolarHBondContact NZ-OE1 3.08Å
425	N	43.1	Very low	48.5	Very low	105 Å²	105	84.1 Å²	84.1	56%	0.561	41%	0.409	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-124.9	108.2	-175.6	-168.3	35.8	0	0	0	110.9	N427 E428 Y430	N425-N427 PolarHBondContact O-N 3.33Å; N425-E428 PolarHBondContact N-O 3.1Å; N425-E428 PolarHBondContact O-N 3.43Å; N425-Y430 HydrophobicContact CB-CE2 4.41Å
426	E	42.3	Very low	50.6	Low	185 Å²	185	80.7 Å²	80.7	86%	0.864	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.5	-35.5	176.8	-61.3	-164.9	144	0	0	119.1
427	N	42	Very low	52.4	Low	158 Å²	158	74.5 Å²	74.5	85%	0.845	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-157.9	-21.3	163.9	-92.6	-55.5	0	0	0	113	N425	N425-N427 PolarHBondContact O-N 3.33Å
428	E	34.5	Very low	54.4	Low	106 Å²	106	71.9 Å²	71.9	50%	0.495	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	146.8	179.3	-78.8	-167.3	177.9	0	0	112.4	N425 Y430 K488	N425-E428 PolarHBondContact N-O 3.1Å; N425-E428 PolarHBondContact O-N 3.43Å; E428-Y430 HydrophobicContact CB-CD2 4.19Å; E428-Y430 HydrophobicContact CB-CE2 3.45Å; E428-Y430 VanDerWaalsContact CB-CE2 3.45Å; E428-Y430 WeakPolarHBondContact OE2-CE2 3.45Å; E428-Y430 VanDerWaalsContact OE2-CZ 3.23Å; E428-Y430 PolarHBondContact OE2-OH 3.26Å; E428-K488 IonicContact OE2-NZ 2.75Å
429	E	45.6	Very low	55.9	Low	64 Å²	64	70 Å²	70	30%	0.299	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	134.3	173.2	-65.7	-171.9	-176.9	0	0	110.9	R422 K424	R422-E429 IonicContact CZ-OE1 3.67Å; R422-E429 IonicContact CZ-OE2 3.08Å; R422-E429 IonicContact NE-OE1 3.13Å; R422-E429 IonicContact NE-OE2 2.84Å; R422-E429 PolarHBondContact NE-OE2 3.19Å; R422-E429 VanDerWaalsContact NH2-CD 3.32Å; R422-E429 IonicContact NH2-OE1 3.25Å; R422-E429 PolarHBondContact NH2-OE1 3.07Å; R422-E429 IonicContact NH2-OE2 3.55Å; R422-E429 PolarHBondContact NH2-OE2 3.5Å; K424-E429 HydrophobicContact CB-CG 4.22Å; K424-E429 HydrophobicContact CD-CG 4.01Å; K424-E429 WeakPolarHBondContact CD-OE1 3.33Å; K424-E429 WeakPolarHBondContact CE-OE1 3.48Å; K424-E429 HydrophobicContact CG-CG 3.91Å; K424-E429 IonicContact NZ-OE1 3.38Å; K424-E429 PolarHBondContact NZ-OE1 3.08Å
430	Y	59.8	Low	56.8	Low	53 Å²	53	69.8 Å²	69.8	21%	0.208	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	121.5	-172.5	-65.5	-118.5	0	0	0	108.2	R422 L423 N425 E428 C432 L472 K488	R422-Y430 CarbonylContact C-O 3.53Å; R422-Y430 WeakPolarHBondContact CA-O 3.47Å; L423-Y430 PolarHBondContact N-O 2.84Å; L423-Y430 PolarHBondContact O-N 3.14Å; N425-Y430 HydrophobicContact CB-CE2 4.41Å; E428-Y430 HydrophobicContact CB-CD2 4.19Å; E428-Y430 HydrophobicContact CB-CE2 3.45Å; E428-Y430 VanDerWaalsContact CB-CE2 3.45Å; E428-Y430 WeakPolarHBondContact OE2-CE2 3.45Å; E428-Y430 VanDerWaalsContact OE2-CZ 3.23Å; E428-Y430 PolarHBondContact OE2-OH 3.26Å; Y430-C432 VanDerWaalsContact CB-SG 3.52Å; Y430-C432 PolarHBondContact O-SG 3.22Å; Y430-C432 VanDerWaalsContact O-SG 3.37Å; Y430-L472 HydrophobicContact CD1-CD2 3.64Å; Y430-L472 HydrophobicContact CE1-CD2 4.17Å; Y430-L472 HydrophobicContact CG-CD2 4.36Å; Y430-K488 HydrophobicContact CD1-CB 4.49Å; Y430-K488 HydrophobicContact CD1-CD 3.4Å; Y430-K488 VanDerWaalsContact CD1-CD 3.4Å; Y430-K488 HydrophobicContact CD1-CG 3.9Å; Y430-K488 HydrophobicContact CE1-CD 3.73Å; Y430-K488 HydrophobicContact CG-CD 4.37Å
431	Y	67.8	Low	57.9	Low	89 Å²	89	70.6 Å²	70.6	35%	0.349	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	113.7	168.4	-69.6	-78.1	0	0	0	109.2	R422 L489	R422-Y431 HydrophobicContact CB-CE1 4.4Å; R422-Y431 HydrophobicContact CG-CE1 4.28Å; Y431-L489 PolarHBondContact O-N 3Å
432	C	62.1	Low	58.3	Low	0 Å²	0	69.3 Å²	69.3	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	130.4	-165.9	-52.2	0	0	0	0	109.8	F421 L423 Y430 L472 F486 Y487	F421-C432 HydrophobicContact CB-CB 4.31Å; F421-C432 PolarHBondContact N-O 2.93Å; F421-C432 WeakPolarHBondContact O-CB 3.42Å; F421-C432 PolarHBondContact O-N 3.01Å; L423-C432 HydrophobicContact CD1-CB 4.47Å; Y430-C432 VanDerWaalsContact CB-SG 3.52Å; Y430-C432 PolarHBondContact O-SG 3.22Å; Y430-C432 VanDerWaalsContact O-SG 3.37Å; C432-L472 HydrophobicContact CB-CD1 3.82Å; C432-L472 WeakPolarHBondContact SG-CD1 3.44Å; C432-F486 HydrophobicContact CB-CB 4.49Å; C432-F486 HydrophobicContact CB-CD1 3.92Å; C432-Y487 VanDerWaalsContact CA-O 3.32Å; C432-Y487 WeakPolarHBondContact CA-O 3.2Å
433	T	72.8	Confident	58.7	Low	0 Å²	0	64.1 Å²	64.1	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	144.1	171.6	-164.2	0	0	0	0	110.3	Q419 L438 Y487 L489	Q419-T433 PolarHBondContact O-OG1 3.12Å; T433-L438 HydrophobicContact CG2-CB 3.84Å; T433-L438 HydrophobicContact CG2-CD1 4.31Å; T433-L438 HydrophobicContact CG2-CD2 3.93Å; T433-L438 HydrophobicContact CG2-CG 4.24Å; T433-Y487 PolarHBondContact N-O 3.44Å; T433-Y487 PolarHBondContact O-N 3.29Å; T433-L489 HydrophobicContact CG2-CD1 3.92Å; T433-L489 HydrophobicContact CG2-CG 4.41Å
434	Y	71.6	Confident	59.1	Low	48 Å²	48	64.2 Å²	64.2	19%	0.188	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	137.2	167.7	-63	-59.2	0	0	0	109.2	F421 L436 V437 L438 F484 T485 F486	F421-Y434 HydrophobicContact CD2-CD2 4.36Å; F421-Y434 HydrophobicContact CD2-CE2 4.11Å; F421-Y434 HydrophobicContact CE1-CE2 4.33Å; F421-Y434 AromaticContact CE2-CD2 3.63Å; F421-Y434 HydrophobicContact CE2-CD2 3.63Å; F421-Y434 AromaticContact CE2-CE2 3.31Å; F421-Y434 HydrophobicContact CE2-CE2 3.31Å; F421-Y434 HydrophobicContact CZ-CD2 4.2Å; F421-Y434 AromaticContact CZ-CE2 3.46Å; F421-Y434 HydrophobicContact CZ-CE2 3.46Å; F421-Y434 VanDerWaalsContact CZ-CE2 3.46Å; Y434-L436 PolarHBondContact O-N 3.42Å; Y434-V437 HydrophobicContact CD2-CG2 3.89Å; Y434-V437 HydrophobicContact CG-CG2 4.45Å; Y434-V437 PolarHBondContact O-N 3.33Å; Y434-L438 PolarHBondContact O-N 3.1Å; Y434-F484 HydrophobicContact CD1-CB 3.98Å; Y434-F484 AromaticContact CD1-CD1 3.86Å; Y434-F484 HydrophobicContact CD1-CD1 3.86Å; Y434-F484 HydrophobicContact CD1-CG 4.44Å; Y434-F484 VanDerWaalsContact CD1-O 3.29Å; Y434-F484 WeakPolarHBondContact CD1-O 3.38Å; Y434-F484 AromaticContact CD2-CD1 3.88Å; Y434-F484 HydrophobicContact CD2-CD1 3.88Å; Y434-F484 HydrophobicContact CD2-CE1 4.3Å; Y434-F484 HydrophobicContact CE1-CB 4.18Å; Y434-F484 HydrophobicContact CE1-CD1 4.04Å; Y434-F484 HydrophobicContact CE2-CD1 4.08Å; Y434-F484 HydrophobicContact CE2-CE1 4.48Å; Y434-F484 AromaticContact CG-CD1 3.76Å; Y434-F484 HydrophobicContact CG-CD1 3.76Å; Y434-T485 WeakPolarHBondContact CA-O 3.41Å; Y434-F486 AromaticContact CD1-CD1 3.89Å; Y434-F486 HydrophobicContact CD1-CD1 3.89Å; Y434-F486 HydrophobicContact CD1-CD2 4.44Å; Y434-F486 AromaticContact CD1-CE1 3.91Å; Y434-F486 HydrophobicContact CD1-CE1 3.91Å; Y434-F486 HydrophobicContact CD1-CE2 4.45Å; Y434-F486 HydrophobicContact CD1-CG 4.19Å; Y434-F486 HydrophobicContact CD1-CZ 4.22Å; Y434-F486 AromaticContact CE1-CD1 3.74Å; Y434-F486 HydrophobicContact CE1-CD1 3.74Å; Y434-F486 HydrophobicContact CE1-CD2 4.01Å; Y434-F486 AromaticContact CE1-CE1 3.31Å; Y434-F486 HydrophobicContact CE1-CE1 3.31Å; Y434-F486 AromaticContact CE1-CE2 3.6Å; Y434-F486 HydrophobicContact CE1-CE2 3.6Å; Y434-F486 HydrophobicContact CE1-CG 4.09Å; Y434-F486 AromaticContact CE1-CZ 3.25Å; Y434-F486 HydrophobicContact CE1-CZ 3.25Å; Y434-F486 HydrophobicContact CE2-CE1 4.47Å; Y434-F486 AromaticContact CZ-CE1 3.63Å; Y434-F486 AromaticContact CZ-CZ 3.58Å; Y434-F486 WeakPolarHBondContact OH-CZ 3.44Å
435	G	72.6	Confident	59.2	Low	0 Å²	0	62.3 Å²	62.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-52.9	-42.2	176.2	0	0	0	0	0	112.6	V437 L438 V439 N483 T485	G435-V437 PolarHBondContact O-N 3.01Å; G435-L438 PolarHBondContact O-N 3.29Å; G435-V439 WeakPolarHBondContact O-CG2 3.47Å; G435-V439 PolarHBondContact O-N 3.43Å; G435-N483 PolarHBondContact N-O 2.74Å; G435-T485 PolarHBondContact N-O 3.06Å
436	L	67.7	Low	59.3	Low	54 Å²	54	61 Å²	61	28%	0.283	29%	0.294	S	S	.	.	H	α-helix	trans	-66.7	-32.9	176.7	-173.2	144.1	0	0	0	113.4	Y434 H440 N483	Y434-L436 PolarHBondContact O-N 3.42Å; L436-H440 WeakPolarHBondContact O-CB 3.24Å; L436-H440 PolarHBondContact O-N 3.04Å; L436-N483 VanDerWaalsContact CB-O 3.31Å; L436-N483 WeakPolarHBondContact CB-O 3.45Å; L436-N483 PolarHBondContact N-O 2.79Å
437	V	69	Low	59.3	Low	25 Å²	25	58.5 Å²	58.5	15%	0.152	29%	0.294	C	S	.	.	H	α-helix	trans	-71.9	-41.6	173.6	166.2	0	0	0	0	110.6	L418 Q419 Y434 G435 H440 W441	L418-V437 HydrophobicContact CD1-CG1 3.91Å; Q419-V437 HydrophobicContact CB-CG1 4.16Å; Y434-V437 HydrophobicContact CD2-CG2 3.89Å; Y434-V437 HydrophobicContact CG-CG2 4.45Å; Y434-V437 PolarHBondContact O-N 3.33Å; G435-V437 PolarHBondContact O-N 3.01Å; V437-H440 PolarHBondContact O-N 3.44Å; V437-W441 VanDerWaalsContact O-CB 3.28Å; V437-W441 WeakPolarHBondContact O-CB 3.24Å; V437-W441 PolarHBondContact O-N 3.32Å
438	L	74.8	Confident	59.2	Low	13 Å²	13	55.7 Å²	55.7	7%	0.068	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-47.2	177.9	-173.4	63	0	0	0	111.9	L418 T433 Y434 G435 W441 L442 C460 L469 F480	L418-L438 HydrophobicContact CD1-CB 4.37Å; L418-L438 HydrophobicContact CD1-CD1 3.82Å; L418-L438 HydrophobicContact CD2-CD1 4.06Å; T433-L438 HydrophobicContact CG2-CB 3.84Å; T433-L438 HydrophobicContact CG2-CD1 4.31Å; T433-L438 HydrophobicContact CG2-CD2 3.93Å; T433-L438 HydrophobicContact CG2-CG 4.24Å; Y434-L438 PolarHBondContact O-N 3.1Å; G435-L438 PolarHBondContact O-N 3.29Å; L438-W441 PolarHBondContact O-N 3Å; L438-L442 WeakPolarHBondContact O-CG 3.38Å; L438-L442 PolarHBondContact O-N 3.12Å; L438-C460 HydrophobicContact CD2-CB 4.43Å; L438-C460 VanDerWaalsContact CD2-SG 3.54Å; L438-L469 HydrophobicContact CD2-CD1 3.56Å; L438-L469 HydrophobicContact CD2-CD2 3.96Å; L438-L469 HydrophobicContact CD2-CG 4.41Å; L438-F480 HydrophobicContact CD2-CE2 4.48Å
439	V	72.6	Confident	59.8	Low	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-66.3	-43.4	175.1	177.4	0	0	0	0	111	G435 W441 L442 V443 R453 R457 F480	G435-V439 WeakPolarHBondContact O-CG2 3.47Å; G435-V439 PolarHBondContact O-N 3.43Å; V439-W441 VanDerWaalsContact C-N 3.29Å; V439-W441 PolarHBondContact O-N 3.27Å; V439-L442 PolarHBondContact O-N 3.48Å; V439-V443 HydrophobicContact CG1-CG2 4.2Å; V439-V443 WeakPolarHBondContact O-CB 3.49Å; V439-V443 WeakPolarHBondContact O-CG2 3.23Å; V439-V443 PolarHBondContact O-N 2.88Å; V439-R453 HydrophobicContact CG1-CB 4.37Å; V439-R453 HydrophobicContact CG1-CG 3.48Å; V439-R453 VanDerWaalsContact CG1-CG 3.48Å; V439-R453 WeakPolarHBondContact CG1-O 3.31Å; V439-R457 HydrophobicContact CG2-CB 4.37Å; V439-F480 HydrophobicContact CG2-CE1 3.5Å; V439-F480 VanDerWaalsContact CG2-CE1 3.5Å; V439-F480 HydrophobicContact CG2-CZ 3.83Å
440	H	61.5	Low	59.9	Low	94 Å²	94	61.1 Å²	61.1	44%	0.435	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-33.2	177.8	-176.7	-117.3	0	0	0	112.3	L436 V437 V443 N444	L436-H440 WeakPolarHBondContact O-CB 3.24Å; L436-H440 PolarHBondContact O-N 3.04Å; V437-H440 PolarHBondContact O-N 3.44Å; H440-V443 WeakPolarHBondContact O-CB 3.48Å; H440-V443 PolarHBondContact O-N 3.34Å; H440-N444 PolarHBondContact CD2-ND2 2.98Å; H440-N444 VanDerWaalsContact CD2-ND2 3.27Å; H440-N444 PolarHBondContact CE1-ND2 2.95Å; H440-N444 VanDerWaalsContact CE1-ND2 3.26Å; H440-N444 PolarHBondContact NE2-ND2 3.31Å; H440-N444 PolarHBondContact O-N 3.3Å; H440-N444 PolarHBondContact O-ND2 2.81Å
441	W	65.8	Low	59.6	Low	100 Å²	100	62.9 Å²	62.9	38%	0.379	31%	0.311	S	S	.	.	H	α-helix	trans	-66.7	-46.5	171.7	179.1	83.1	0	0	0	111.5	L418 V437 L438 V439 V443 N444 N445	L418-W441 HydrophobicContact CB-CD2 4.39Å; L418-W441 HydrophobicContact CB-CG 4.1Å; L418-W441 HydrophobicContact CD1-CB 3.67Å; L418-W441 HydrophobicContact CD1-CD2 4.3Å; L418-W441 HydrophobicContact CD1-CG 3.91Å; V437-W441 VanDerWaalsContact O-CB 3.28Å; V437-W441 WeakPolarHBondContact O-CB 3.24Å; V437-W441 PolarHBondContact O-N 3.32Å; L438-W441 PolarHBondContact O-N 3Å; V439-W441 VanDerWaalsContact C-N 3.29Å; V439-W441 PolarHBondContact O-N 3.27Å; W441-V443 VanDerWaalsContact C-N 3.29Å; W441-V443 PolarHBondContact O-N 2.88Å; W441-N444 PolarHBondContact O-N 3.36Å; W441-N445 PolarHBondContact NE1-ND2 2.64Å; W441-N445 PolarHBondContact O-N 3.23Å; W441-N445 PolarHBondContact O-ND2 3.32Å
442	L	62.4	Low	58.7	Low	28 Å²	28	58.9 Å²	58.9	15%	0.147	30%	0.296	C	S	.	.	H	α-helix	trans	-58.6	-40.6	173.7	-70.5	168.9	0	0	0	112	L438 V439 N445 L459	L438-L442 WeakPolarHBondContact O-CG 3.38Å; L438-L442 PolarHBondContact O-N 3.12Å; V439-L442 PolarHBondContact O-N 3.48Å; L442-N445 PolarHBondContact O-N 2.93Å; L442-L459 HydrophobicContact CD1-CB 4.44Å; L442-L459 HydrophobicContact CD1-CD2 4.06Å; L442-L459 HydrophobicContact CD2-CD2 3.83Å
443	V	56.1	Low	58.6	Low	7 Å²	7	63.6 Å²	63.6	4%	0.042	31%	0.314	C	S	.	.	H	α-helix	trans	-58.8	-48.7	175.4	161.3	0	0	0	0	112.6	V439 H440 W441 N445 V446 L449 C452 R453	V439-V443 HydrophobicContact CG1-CG2 4.2Å; V439-V443 WeakPolarHBondContact O-CB 3.49Å; V439-V443 WeakPolarHBondContact O-CG2 3.23Å; V439-V443 PolarHBondContact O-N 2.88Å; H440-V443 WeakPolarHBondContact O-CB 3.48Å; H440-V443 PolarHBondContact O-N 3.34Å; W441-V443 VanDerWaalsContact C-N 3.29Å; W441-V443 PolarHBondContact O-N 2.88Å; V443-N445 PolarHBondContact O-N 3.31Å; V443-V446 PolarHBondContact O-N 3.39Å; V443-L449 HydrophobicContact CG1-CB 4.47Å; V443-L449 HydrophobicContact CG1-CD1 3.42Å; V443-L449 VanDerWaalsContact CG1-CD1 3.42Å; V443-L449 HydrophobicContact CG1-CG 3.63Å; V443-L449 WeakPolarHBondContact CG1-O 3.02Å; V443-C452 HydrophobicContact CG2-CB 4.35Å; V443-R453 HydrophobicContact CG2-CB 3.72Å; V443-R453 HydrophobicContact CG2-CG 4.07Å
444	N	52.8	Low	58.4	Low	74 Å²	74	68 Å²	68	40%	0.396	34%	0.336	S	S	.	.	H	α-helix	trans	-72.4	-13.7	-176.3	-77.2	-93.6	0	0	0	113	H440 W441	H440-N444 PolarHBondContact CD2-ND2 2.98Å; H440-N444 VanDerWaalsContact CD2-ND2 3.27Å; H440-N444 PolarHBondContact CE1-ND2 2.95Å; H440-N444 VanDerWaalsContact CE1-ND2 3.26Å; H440-N444 PolarHBondContact NE2-ND2 3.31Å; H440-N444 PolarHBondContact O-N 3.3Å; H440-N444 PolarHBondContact O-ND2 2.81Å; W441-N444 PolarHBondContact O-N 3.36Å
445	N	46.8	Very low	58.1	Low	105 Å²	105	70.7 Å²	70.7	56%	0.561	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.6	1.3	177.5	-73.6	-80.2	0	0	0	113.7	W441 L442 V443	W441-N445 PolarHBondContact NE1-ND2 2.64Å; W441-N445 PolarHBondContact O-N 3.23Å; W441-N445 PolarHBondContact O-ND2 3.32Å; L442-N445 PolarHBondContact O-N 2.93Å; V443-N445 PolarHBondContact O-N 3.31Å
446	V	45.9	Very low	58.2	Low	78 Å²	78	70.9 Å²	70.9	47%	0.473	35%	0.35	S	S	.	.	S	Bend	trans	-136.2	134.9	179.3	-170.4	0	0	0	0	110.7	V443 E448 C452	V443-V446 PolarHBondContact O-N 3.39Å; V446-E448 VanDerWaalsContact C-N 3.32Å; V446-E448 PolarHBondContact O-N 2.98Å; V446-C452 HydrophobicContact CB-CB 4.22Å; V446-C452 VanDerWaalsContact CB-SG 3.57Å; V446-C452 WeakPolarHBondContact CG1-SG 3.35Å
447	P	40.9	Very low	58.6	Low	133 Å²	133	73 Å²	73	86%	0.864	35%	0.354	S	S	*	.	S	Bend	trans	-74.2	3.9	-156.7	-21.6	35.8	0	0	0	119
448	E	41	Very low	58.9	Low	98 Å²	98	77.2 Å²	77.2	46%	0.458	38%	0.376	S	S	.	.			trans	-119.5	71.2	-173.1	-63.5	-174.9	176.1	0	0	111.7	V446 E450 R451 C452	V446-E448 VanDerWaalsContact C-N 3.32Å; V446-E448 PolarHBondContact O-N 2.98Å; E448-E450 PolarHBondContact O-N 2.82Å; E448-R451 HydrophobicContact CB-CB 4.26Å; E448-R451 PolarHBondContact O-N 3.05Å; E448-R451 IonicContact OE1-NH1 3.54Å; E448-R451 WeakPolarHBondContact OE2-CD 3.33Å; E448-R451 IonicContact OE2-CZ 2.74Å; E448-R451 IonicContact OE2-NE 3.25Å; E448-R451 IonicContact OE2-NH1 3.57Å; E448-R451 PolarHBondContact OE2-NH1 2.96Å; E448-C452 VanDerWaalsContact C-SG 3.54Å; E448-C452 PolarHBondContact N-SG 2.96Å; E448-C452 VanDerWaalsContact N-SG 3.43Å; E448-C452 WeakPolarHBondContact O-CB 3.35Å; E448-C452 PolarHBondContact O-N 2.95Å; E448-C452 PolarHBondContact O-SG 3.42Å
449	L	46.8	Very low	59	Low	115 Å²	115	80.1 Å²	80.1	60%	0.602	39%	0.391	S	S	*	.	H	α-helix	trans	-34.4	-56.9	-160.6	-151.7	79.1	0	0	0	116.8	V443 R453	V443-L449 HydrophobicContact CG1-CB 4.47Å; V443-L449 HydrophobicContact CG1-CD1 3.42Å; V443-L449 VanDerWaalsContact CG1-CD1 3.42Å; V443-L449 HydrophobicContact CG1-CG 3.63Å; V443-L449 WeakPolarHBondContact CG1-O 3.02Å; L449-R453 PolarHBondContact O-N 3.24Å
450	E	46.8	Very low	59.4	Low	170 Å²	170	80.1 Å²	80.1	79%	0.794	39%	0.391	S	S	*	.	H	α-helix	trans	-79.9	-36.5	-173.7	-163.9	167.9	-147.1	0	0	113.1	E448 C452 R453 M454	E448-E450 PolarHBondContact O-N 2.82Å; E450-C452 VanDerWaalsContact C-N 3.3Å; E450-C452 PolarHBondContact O-N 2.8Å; E450-R453 VanDerWaalsContact O-CB 3.23Å; E450-R453 WeakPolarHBondContact O-CB 3.43Å; E450-R453 PolarHBondContact O-N 2.95Å; E450-R453 VanDerWaalsContact O-N 3.08Å; E450-M454 PolarHBondContact O-N 3.42Å
451	R	53.5	Low	60.3	Low	89 Å²	89	77.5 Å²	77.5	34%	0.336	38%	0.378	S	S	.	.	H	α-helix	trans	-68.3	-34.2	173	-160.2	-168.4	-155.1	157.9	13.1	111.2	E448 R453 M454 K455 N1041 D1042	E448-R451 HydrophobicContact CB-CB 4.26Å; E448-R451 PolarHBondContact O-N 3.05Å; E448-R451 IonicContact OE1-NH1 3.54Å; E448-R451 WeakPolarHBondContact OE2-CD 3.33Å; E448-R451 IonicContact OE2-CZ 2.74Å; E448-R451 IonicContact OE2-NE 3.25Å; E448-R451 IonicContact OE2-NH1 3.57Å; E448-R451 PolarHBondContact OE2-NH1 2.96Å; R451-R453 PolarHBondContact O-N 2.82Å; R451-M454 PolarHBondContact O-N 3.21Å; R451-K455 WeakPolarHBondContact O-CG 3.39Å; R451-K455 PolarHBondContact O-N 3.47Å; R451-N1041 PolarHBondContact NH2-O 3.14Å; R451-D1042 IonicContact CZ-OD1 2.73Å; R451-D1042 IonicContact CZ-OD2 3.45Å; R451-D1042 VanDerWaalsContact CZ-OD2 3.29Å; R451-D1042 IonicContact NE-OD1 2.79Å; R451-D1042 PolarHBondContact NE-OD1 3.22Å; R451-D1042 VanDerWaalsContact NE-OD1 3.13Å; R451-D1042 IonicContact NE-OD2 2.68Å; R451-D1042 PolarHBondContact NE-OD2 2.97Å; R451-D1042 IonicContact NH2-OD1 2.68Å; R451-D1042 PolarHBondContact NH2-OD1 2.7Å; R451-D1042 IonicContact NH2-OD2 3.33Å; R451-D1042 PolarHBondContact NH2-OD2 3.24Å
452	C	49.4	Very low	60.6	Low	6 Å²	6	78.8 Å²	78.8	4%	0.041	39%	0.387	C	S	.	.	H	α-helix	trans	-69	-21	172.4	-62.7	0	0	0	0	112	V443 V446 E448 E450 G456	V443-C452 HydrophobicContact CG2-CB 4.35Å; V446-C452 HydrophobicContact CB-CB 4.22Å; V446-C452 VanDerWaalsContact CB-SG 3.57Å; V446-C452 WeakPolarHBondContact CG1-SG 3.35Å; E448-C452 VanDerWaalsContact C-SG 3.54Å; E448-C452 PolarHBondContact N-SG 2.96Å; E448-C452 VanDerWaalsContact N-SG 3.43Å; E448-C452 WeakPolarHBondContact O-CB 3.35Å; E448-C452 PolarHBondContact O-N 2.95Å; E448-C452 PolarHBondContact O-SG 3.42Å; E450-C452 VanDerWaalsContact C-N 3.3Å; E450-C452 PolarHBondContact O-N 2.8Å; C452-G456 WeakPolarHBondContact O-CA 3.5Å; C452-G456 PolarHBondContact O-N 2.95Å
453	R	60.9	Low	61.3	Low	99 Å²	99	81 Å²	81	37%	0.374	40%	0.395	S	S	.	.	H	α-helix	trans	-69.1	-45.8	171.4	-159.5	-179	-179.9	145	7.8	110.9	V439 V443 L449 E450 R451 G456 R457 D482	V439-R453 HydrophobicContact CG1-CB 4.37Å; V439-R453 HydrophobicContact CG1-CG 3.48Å; V439-R453 VanDerWaalsContact CG1-CG 3.48Å; V439-R453 WeakPolarHBondContact CG1-O 3.31Å; V443-R453 HydrophobicContact CG2-CB 3.72Å; V443-R453 HydrophobicContact CG2-CG 4.07Å; L449-R453 PolarHBondContact O-N 3.24Å; E450-R453 VanDerWaalsContact O-CB 3.23Å; E450-R453 WeakPolarHBondContact O-CB 3.43Å; E450-R453 PolarHBondContact O-N 2.95Å; E450-R453 VanDerWaalsContact O-N 3.08Å; R451-R453 PolarHBondContact O-N 2.82Å; R453-G456 PolarHBondContact O-N 3.48Å; R453-R457 WeakPolarHBondContact O-CB 3.42Å; R453-R457 PolarHBondContact O-N 3.4Å; R453-D482 IonicContact CZ-OD1 3.74Å; R453-D482 IonicContact CZ-OD2 2.68Å; R453-D482 IonicContact NE-OD1 3.3Å; R453-D482 IonicContact NE-OD2 2.79Å; R453-D482 PolarHBondContact NE-OD2 3.29Å; R453-D482 IonicContact NH2-OD1 3.84Å; R453-D482 PolarHBondContact NH2-OD1 3.13Å; R453-D482 IonicContact NH2-OD2 3.09Å; R453-D482 PolarHBondContact NH2-OD2 3.27Å
454	M	67	Low	62.4	Low	93 Å²	93	81.4 Å²	81.4	46%	0.458	40%	0.397	S	S	.	.	H	α-helix	trans	-63.2	-46.4	173.5	-69.6	-67.6	-72.6	0	0	112.1	E450 R451 G456 R457 L458	E450-M454 PolarHBondContact O-N 3.42Å; R451-M454 PolarHBondContact O-N 3.21Å; M454-G456 PolarHBondContact O-N 2.91Å; M454-R457 PolarHBondContact O-N 2.9Å; M454-L458 WeakPolarHBondContact O-CB 3.41Å; M454-L458 PolarHBondContact O-N 3.27Å
455	K	65.8	Low	63	Low	104 Å²	104	82.9 Å²	82.9	45%	0.452	41%	0.405	S	S	.	.	H	α-helix	trans	-65.2	-38.3	177.6	-69.3	176.4	179.8	177.2	0	112	R451 L458 L459 D1042	R451-K455 WeakPolarHBondContact O-CG 3.39Å; R451-K455 PolarHBondContact O-N 3.47Å; K455-L458 PolarHBondContact O-N 3.19Å; K455-L459 PolarHBondContact O-N 3.42Å; K455-D1042 VanDerWaalsContact CE-OD1 3.32Å; K455-D1042 WeakPolarHBondContact CE-OD1 3.45Å; K455-D1042 IonicContact NZ-OD1 2.69Å; K455-D1042 PolarHBondContact NZ-OD1 2.69Å
456	G	74.6	Confident	63.9	Low	4 Å²	4	83.8 Å²	83.8	4%	0.041	41%	0.409	C	S	.	.	H	α-helix	trans	-63.6	-47.2	172.6	0	0	0	0	0	112.1	C452 R453 M454 L458 L459 C460	C452-G456 WeakPolarHBondContact O-CA 3.5Å; C452-G456 PolarHBondContact O-N 2.95Å; R453-G456 PolarHBondContact O-N 3.48Å; M454-G456 PolarHBondContact O-N 2.91Å; G456-L458 VanDerWaalsContact C-N 3.32Å; G456-L458 PolarHBondContact O-N 3.19Å; G456-L459 WeakPolarHBondContact O-CB 3.37Å; G456-L459 PolarHBondContact O-N 2.67Å; G456-L459 VanDerWaalsContact O-N 3.13Å; G456-C460 PolarHBondContact O-N 2.83Å; G456-C460 PolarHBondContact O-SG 3Å
457	R	75.8	Confident	65	Low	98 Å²	98	81.4 Å²	81.4	37%	0.37	40%	0.4	S	S	.	.	H	α-helix	trans	-59.2	-41.6	175.1	-167.2	-176.6	178.2	177.2	-3	112.1	V439 R453 M454 L459 C460 Q461 F480 D482	V439-R457 HydrophobicContact CG2-CB 4.37Å; R453-R457 WeakPolarHBondContact O-CB 3.42Å; R453-R457 PolarHBondContact O-N 3.4Å; M454-R457 PolarHBondContact O-N 2.9Å; R457-L459 VanDerWaalsContact C-N 3.34Å; R457-C460 PolarHBondContact O-N 2.9Å; R457-Q461 WeakPolarHBondContact O-CB 3.31Å; R457-Q461 PolarHBondContact O-N 3.44Å; R457-F480 HydrophobicContact CG-CD1 3.77Å; R457-F480 HydrophobicContact CG-CE1 4.14Å; R457-F480 PolarHBondContact NE-O 3.07Å; R457-F480 VanDerWaalsContact NE-O 3.09Å; R457-F480 PolarHBondContact NH2-O 3.49Å; R457-D482 HydrophobicContact CG-CB 4.31Å
458	L	75.7	Confident	66.5	Low	114 Å²	114	77 Å²	77	60%	0.597	37%	0.369	S	S	*	.	H	α-helix	trans	-66.6	-34.9	176.3	-168.3	71.3	0	0	0	112.3	M454 K455 G456 Q461 K462	M454-L458 WeakPolarHBondContact O-CB 3.41Å; M454-L458 PolarHBondContact O-N 3.27Å; K455-L458 PolarHBondContact O-N 3.19Å; G456-L458 VanDerWaalsContact C-N 3.32Å; G456-L458 PolarHBondContact O-N 3.19Å; L458-Q461 PolarHBondContact O-N 3.39Å; L458-K462 PolarHBondContact O-N 2.99Å
459	L	76.8	Confident	68.2	Low	73 Å²	73	72.5 Å²	72.5	38%	0.382	35%	0.348	S	S	.	.	H	α-helix	trans	-68.5	-41.4	173.4	-170.5	69	0	0	0	111.5	L442 K455 G456 R457 K462 F463	L442-L459 HydrophobicContact CD1-CB 4.44Å; L442-L459 HydrophobicContact CD1-CD2 4.06Å; L442-L459 HydrophobicContact CD2-CD2 3.83Å; K455-L459 PolarHBondContact O-N 3.42Å; G456-L459 WeakPolarHBondContact O-CB 3.37Å; G456-L459 PolarHBondContact O-N 2.67Å; G456-L459 VanDerWaalsContact O-N 3.13Å; R457-L459 VanDerWaalsContact C-N 3.34Å; L459-K462 PolarHBondContact O-N 3.06Å; L459-F463 HydrophobicContact CD1-CE2 4.33Å; L459-F463 HydrophobicContact CD2-CE2 3.91Å; L459-F463 HydrophobicContact CD2-CZ 4.5Å; L459-F463 HydrophobicContact CG-CD2 4.11Å; L459-F463 HydrophobicContact CG-CE2 3.67Å; L459-F463 HydrophobicContact CG-CZ 4.34Å; L459-F463 VanDerWaalsContact O-CD2 3.25Å; L459-F463 WeakPolarHBondContact O-CD2 3.27Å; L459-F463 PolarHBondContact O-N 2.81Å
460	C	81.7	Confident	69.6	Low	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-64.9	-37.9	173.4	-61.7	0	0	0	0	112.6	L438 G456 R457 F463 M464 L469 F480	L438-C460 HydrophobicContact CD2-CB 4.43Å; L438-C460 VanDerWaalsContact CD2-SG 3.54Å; G456-C460 PolarHBondContact O-N 2.83Å; G456-C460 PolarHBondContact O-SG 3Å; R457-C460 PolarHBondContact O-N 2.9Å; C460-F463 PolarHBondContact O-N 3.36Å; C460-M464 PolarHBondContact O-N 2.79Å; C460-L469 HydrophobicContact CB-CD1 4.15Å; C460-F480 HydrophobicContact CB-CD1 3.55Å; C460-F480 HydrophobicContact CB-CD2 3.58Å; C460-F480 HydrophobicContact CB-CE1 3.46Å; C460-F480 VanDerWaalsContact CB-CE1 3.46Å; C460-F480 HydrophobicContact CB-CE2 3.47Å; C460-F480 VanDerWaalsContact CB-CE2 3.47Å; C460-F480 HydrophobicContact CB-CG 3.6Å; C460-F480 HydrophobicContact CB-CZ 3.39Å
461	Q	79.6	Confident	71.2	Confident	39 Å²	39	61.3 Å²	61.3	18%	0.182	30%	0.296	C	S	.	.	H	α-helix	trans	-58.5	-49.5	169.7	-177.9	63.5	56.6	0	0	110.2	R457 L458 F463 M464 D465 K478 F480	R457-Q461 WeakPolarHBondContact O-CB 3.31Å; R457-Q461 PolarHBondContact O-N 3.44Å; L458-Q461 PolarHBondContact O-N 3.39Å; Q461-F463 VanDerWaalsContact C-N 3.31Å; Q461-F463 PolarHBondContact O-N 3.03Å; Q461-M464 CarbonylContact O-C 3.56Å; Q461-M464 WeakPolarHBondContact O-CA 3.4Å; Q461-M464 WeakPolarHBondContact O-CB 3.28Å; Q461-M464 PolarHBondContact O-N 3.11Å; Q461-D465 PolarHBondContact NE2-OD1 2.63Å; Q461-D465 PolarHBondContact O-N 2.76Å; Q461-K478 PolarHBondContact NE2-O 2.84Å; Q461-F480 HydrophobicContact CB-CB 4.32Å
462	K	71.6	Confident	71.9	Confident	127 Å²	127	59.9 Å²	59.9	55%	0.552	30%	0.295	S	S	*	.	H	α-helix	trans	-59.2	-38.2	174.8	-76.3	-169.4	173.7	-167.7	0	113.4	L458 L459 M464 D465 L466	L458-K462 PolarHBondContact O-N 2.99Å; L459-K462 PolarHBondContact O-N 3.06Å; K462-M464 VanDerWaalsContact C-N 3.3Å; K462-M464 PolarHBondContact O-N 2.81Å; K462-D465 WeakPolarHBondContact CA-OD2 3.44Å; K462-D465 PolarHBondContact O-N 2.87Å; K462-L466 VanDerWaalsContact O-CB 3.31Å; K462-L466 WeakPolarHBondContact O-CB 3.11Å; K462-L466 WeakPolarHBondContact O-CD1 3.37Å; K462-L466 WeakPolarHBondContact O-CG 3.32Å; K462-L466 PolarHBondContact O-N 3.26Å
463	F	77.6	Confident	72.5	Confident	75 Å²	75	66.4 Å²	66.4	33%	0.329	33%	0.325	S	S	.	.	H	α-helix	trans	-65.9	-32.2	173.7	-73.5	-54.1	0	0	0	112.5	L459 C460 Q461 G467 L468 L469	L459-F463 HydrophobicContact CD1-CE2 4.33Å; L459-F463 HydrophobicContact CD2-CE2 3.91Å; L459-F463 HydrophobicContact CD2-CZ 4.5Å; L459-F463 HydrophobicContact CG-CD2 4.11Å; L459-F463 HydrophobicContact CG-CE2 3.67Å; L459-F463 HydrophobicContact CG-CZ 4.34Å; L459-F463 VanDerWaalsContact O-CD2 3.25Å; L459-F463 WeakPolarHBondContact O-CD2 3.27Å; L459-F463 PolarHBondContact O-N 2.81Å; C460-F463 PolarHBondContact O-N 3.36Å; Q461-F463 VanDerWaalsContact C-N 3.31Å; Q461-F463 PolarHBondContact O-N 3.03Å; F463-G467 PolarHBondContact O-N 2.92Å; F463-L468 HydrophobicContact CB-CB 4.37Å; F463-L468 HydrophobicContact CD1-CB 4.22Å; F463-L468 HydrophobicContact CD1-CD1 3.9Å; F463-L468 HydrophobicContact CE1-CD1 4.36Å; F463-L468 CarbonylContact O-C 3.46Å; F463-L468 WeakPolarHBondContact O-CA 3.43Å; F463-L468 WeakPolarHBondContact O-CB 3.17Å; F463-L468 PolarHBondContact O-N 2.88Å; F463-L469 HydrophobicContact CB-CB 4.45Å; F463-L469 HydrophobicContact CB-CD1 3.63Å; F463-L469 HydrophobicContact CB-CG 3.77Å; F463-L469 PolarHBondContact O-N 3.11Å
464	M	79.3	Confident	72.9	Confident	15 Å²	15	65.4 Å²	65.4	7%	0.074	33%	0.327	C	S	.	.	H	α-helix	trans	-70.9	-44	170.8	178.4	-177.1	-81.4	0	0	112	C460 Q461 K462 L466 G467 L469 C477 Q479 F480 Y487	C460-M464 PolarHBondContact O-N 2.79Å; Q461-M464 CarbonylContact O-C 3.56Å; Q461-M464 WeakPolarHBondContact O-CA 3.4Å; Q461-M464 WeakPolarHBondContact O-CB 3.28Å; Q461-M464 PolarHBondContact O-N 3.11Å; K462-M464 VanDerWaalsContact C-N 3.3Å; K462-M464 PolarHBondContact O-N 2.81Å; M464-L466 PolarHBondContact O-N 3.18Å; M464-G467 WeakPolarHBondContact O-CA 3.35Å; M464-G467 PolarHBondContact O-N 3.19Å; M464-L469 HydrophobicContact CB-CB 4.4Å; M464-C477 VanDerWaalsContact SD-O 3.34Å; M464-Q479 WeakPolarHBondContact CE-O 3.46Å; M464-Q479 PolarHBondContact SD-N 3.47Å; M464-F480 HydrophobicContact CE-CB 4.16Å; M464-F480 HydrophobicContact CE-CD2 4.49Å; M464-F480 HydrophobicContact SD-CB 4.32Å; M464-Y487 HydrophobicContact CE-CD1 3.91Å; M464-Y487 HydrophobicContact CE-CE1 3.3Å
465	D	65.5	Low	72.9	Confident	106 Å²	106	65.3 Å²	65.3	57%	0.567	33%	0.333	S	S	*	.	H	α-helix	trans	-59.5	-35.2	176.2	-55.4	-32	0	0	0	111.6	Q461 K462 G467	Q461-D465 PolarHBondContact NE2-OD1 2.63Å; Q461-D465 PolarHBondContact O-N 2.76Å; K462-D465 WeakPolarHBondContact CA-OD2 3.44Å; K462-D465 PolarHBondContact O-N 2.87Å; D465-G467 VanDerWaalsContact C-N 3.28Å; D465-G467 PolarHBondContact O-N 3.02Å
466	L	65.3	Low	72.8	Confident	124 Å²	124	64.2 Å²	64.2	65%	0.649	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	-4.6	173.9	-70.2	168.1	0	0	0	114	K462 M464 L468	K462-L466 VanDerWaalsContact O-CB 3.31Å; K462-L466 WeakPolarHBondContact O-CB 3.11Å; K462-L466 WeakPolarHBondContact O-CD1 3.37Å; K462-L466 WeakPolarHBondContact O-CG 3.32Å; K462-L466 PolarHBondContact O-N 3.26Å; M464-L466 PolarHBondContact O-N 3.18Å; L466-L468 HydrophobicContact CB-CD1 4.05Å; L466-L468 HydrophobicContact CB-CG 4.08Å; L466-L468 HydrophobicContact CD1-CD1 4.19Å; L466-L468 PolarHBondContact O-N 3.23Å
467	G	69.8	Low	72.4	Confident	27 Å²	27	65.1 Å²	65.1	28%	0.278	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.9	21.7	-175	0	0	0	0	0	114.4	F463 M464 D465 K490	F463-G467 PolarHBondContact O-N 2.92Å; M464-G467 WeakPolarHBondContact O-CA 3.35Å; M464-G467 PolarHBondContact O-N 3.19Å; D465-G467 VanDerWaalsContact C-N 3.28Å; D465-G467 PolarHBondContact O-N 3.02Å; G467-K490 WeakPolarHBondContact O-CD 3.34Å
468	L	72.7	Confident	72.3	Confident	41 Å²	41	67.9 Å²	67.9	22%	0.215	35%	0.352	C	S	.	.	S	Bend	trans	-89.8	-21.3	175.2	-65.9	173.6	0	0	0	112.6	F463 L466 K490 I492	F463-L468 HydrophobicContact CB-CB 4.37Å; F463-L468 HydrophobicContact CD1-CB 4.22Å; F463-L468 HydrophobicContact CD1-CD1 3.9Å; F463-L468 HydrophobicContact CE1-CD1 4.36Å; F463-L468 CarbonylContact O-C 3.46Å; F463-L468 WeakPolarHBondContact O-CA 3.43Å; F463-L468 WeakPolarHBondContact O-CB 3.17Å; F463-L468 PolarHBondContact O-N 2.88Å; L466-L468 HydrophobicContact CB-CD1 4.05Å; L466-L468 HydrophobicContact CB-CG 4.08Å; L466-L468 HydrophobicContact CD1-CD1 4.19Å; L466-L468 PolarHBondContact O-N 3.23Å; L468-K490 PolarHBondContact O-N 3.04Å; L468-I492 HydrophobicContact CD1-CD1 4.19Å; L468-I492 HydrophobicContact CD2-CD1 3.85Å; L468-I492 HydrophobicContact CD2-CG1 3.66Å
469	L	75.5	Confident	72.3	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.016	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	137.1	162.2	-66.8	171.1	0	0	0	109.1	L438 C460 F463 M464 F480 Y487 K488 L489	L438-L469 HydrophobicContact CD2-CD1 3.56Å; L438-L469 HydrophobicContact CD2-CD2 3.96Å; L438-L469 HydrophobicContact CD2-CG 4.41Å; C460-L469 HydrophobicContact CB-CD1 4.15Å; F463-L469 HydrophobicContact CB-CB 4.45Å; F463-L469 HydrophobicContact CB-CD1 3.63Å; F463-L469 HydrophobicContact CB-CG 3.77Å; F463-L469 PolarHBondContact O-N 3.11Å; M464-L469 HydrophobicContact CB-CB 4.4Å; L469-F480 HydrophobicContact CD1-CD2 4.23Å; L469-F480 HydrophobicContact CD1-CE2 4.14Å; L469-Y487 HydrophobicContact CB-CD1 4.48Å; L469-K488 WeakPolarHBondContact CA-O 3.25Å; L469-L489 HydrophobicContact CD2-CD2 3.5Å; L469-L489 HydrophobicContact CD2-CG 3.74Å
470	T	77.2	Confident	72.6	Confident	44 Å²	44	65 Å²	65	27%	0.27	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	127.2	172	-50	0	0	0	0	109.2	L472 P475 Y487 K488	T470-L472 PolarHBondContact O-N 2.89Å; T470-P475 HydrophobicContact CG2-CB 3.86Å; T470-Y487 CarbonylContact O-C 3.47Å; T470-Y487 WeakPolarHBondContact O-CA 3.25Å; T470-K488 PolarHBondContact N-O 3.34Å; T470-K488 PolarHBondContact O-N 3.24Å
471	D	80.4	Confident	72.2	Confident	7 Å²	7	68.3 Å²	68.3	4%	0.037	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	126.3	176	-175.5	-32.1	0	0	0	110	Q473 N474 P475 C477 T485 Y487	D471-Q473 WeakPolarHBondContact OD1-CA 3.35Å; D471-Q473 WeakPolarHBondContact OD1-CB 3.41Å; D471-Q473 PolarHBondContact OD1-N 3.03Å; D471-N474 WeakPolarHBondContact CB-O 3.34Å; D471-N474 CarbonylContact O-C 2.94Å; D471-N474 PolarHBondContact OD1-N 2.78Å; D471-P475 VanDerWaalsContact O-CA 3.23Å; D471-P475 WeakPolarHBondContact O-CA 3.16Å; D471-C477 HydrophobicContact CB-CB 4.01Å; D471-T485 VanDerWaalsContact CG-CG2 3.48Å; D471-T485 WeakPolarHBondContact OD1-CG2 3.43Å; D471-T485 VanDerWaalsContact OD2-CG2 3.29Å; D471-T485 WeakPolarHBondContact OD2-CG2 3.46Å; D471-Y487 HydrophobicContact CB-CD1 4.1Å; D471-Y487 HydrophobicContact CB-CE1 3.71Å
472	L	67.3	Low	72	Confident	58 Å²	58	67.9 Å²	67.9	30%	0.304	35%	0.348	S	S	.	.	S	Bend	trans	-77.9	-23.5	-179.7	-84.9	127.7	0	0	0	113.9	Y430 C432 T470 F486 K488	Y430-L472 HydrophobicContact CD1-CD2 3.64Å; Y430-L472 HydrophobicContact CE1-CD2 4.17Å; Y430-L472 HydrophobicContact CG-CD2 4.36Å; C432-L472 HydrophobicContact CB-CD1 3.82Å; C432-L472 WeakPolarHBondContact SG-CD1 3.44Å; T470-L472 PolarHBondContact O-N 2.89Å; L472-F486 HydrophobicContact CB-CB 4.21Å; L472-F486 HydrophobicContact CD1-CB 3.67Å; L472-F486 PolarHBondContact N-O 2.86Å; L472-K488 HydrophobicContact CD1-CB 4.01Å; L472-K488 VanDerWaalsContact CD1-N 3.31Å; L472-K488 HydrophobicContact CG-CB 4.17Å
473	Q	63.3	Low	71.5	Confident	143 Å²	143	64.7 Å²	64.7	67%	0.668	34%	0.337	S	S	*	.	S	Bend	trans	-86.7	-29.7	178.2	-66.8	178.3	-23	0	0	110.9	D471	D471-Q473 WeakPolarHBondContact OD1-CA 3.35Å; D471-Q473 WeakPolarHBondContact OD1-CB 3.41Å; D471-Q473 PolarHBondContact OD1-N 3.03Å
474	N	69.4	Low	70.9	Confident	78 Å²	78	65.6 Å²	65.6	42%	0.417	34%	0.341	S	S	.	.			trans	-144.3	88.1	174.2	179.1	7.6	0	0	0	111.3	D471 N476 C477	D471-N474 WeakPolarHBondContact CB-O 3.34Å; D471-N474 CarbonylContact O-C 2.94Å; D471-N474 PolarHBondContact OD1-N 2.78Å; N474-N476 PolarHBondContact O-N 3.22Å; N474-N476 PolarHBondContact OD1-N 3.17Å; N474-C477 HydrophobicContact CB-CB 4.15Å; N474-C477 WeakPolarHBondContact O-CB 3.35Å; N474-C477 PolarHBondContact O-N 2.94Å
475	P	65.7	Low	70.4	Confident	91 Å²	91	65.3 Å²	65.3	59%	0.591	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-9	-177.7	24.9	-34.8	0	0	0	114.9	T470 D471	T470-P475 HydrophobicContact CG2-CB 3.86Å; D471-P475 VanDerWaalsContact O-CA 3.23Å; D471-P475 WeakPolarHBondContact O-CA 3.16Å
476	N	64.1	Low	70.9	Confident	81 Å²	81	62.4 Å²	62.4	43%	0.433	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	0	170.9	-76.6	-26.5	0	0	0	113.6	N474 K478 C1744	N474-N476 PolarHBondContact O-N 3.22Å; N474-N476 PolarHBondContact OD1-N 3.17Å; N476-K478 PolarHBondContact O-N 3.2Å; N476-C1744 HydrophobicContact CB-CB 3.79Å; N476-C1744 PolarHBondContact ND2-O 3.34Å
477	C	65.7	Low	71.4	Confident	23 Å²	23	56.5 Å²	56.5	16%	0.155	29%	0.292	C	S	.	.			trans	-70.5	119.8	179.1	-165.7	0	0	0	0	110.9	M464 D471 N474 Q479	M464-C477 VanDerWaalsContact SD-O 3.34Å; D471-C477 HydrophobicContact CB-CB 4.01Å; N474-C477 HydrophobicContact CB-CB 4.15Å; N474-C477 WeakPolarHBondContact O-CB 3.35Å; N474-C477 PolarHBondContact O-N 2.94Å; C477-Q479 PolarHBondContact SG-O 3.08Å
478	K	74.3	Confident	71.6	Confident	157 Å²	157	58.1 Å²	58.1	68%	0.683	29%	0.291	S	S	*	.			trans	-99.4	10	176	-60.8	-176.6	-178.4	177.8	0	113.1	Q461 N476	Q461-K478 PolarHBondContact NE2-O 2.84Å; N476-K478 PolarHBondContact O-N 3.2Å
479	Q	74.6	Confident	71.3	Confident	127 Å²	127	58.9 Å²	58.9	59%	0.593	30%	0.295	S	S	*	.	S	Bend	trans	-121.7	129.2	174	-81.3	-168.6	-11	0	0	111.8	M464 C477 H481	M464-Q479 WeakPolarHBondContact CE-O 3.46Å; M464-Q479 PolarHBondContact SD-N 3.47Å; C477-Q479 PolarHBondContact SG-O 3.08Å; Q479-H481 PolarHBondContact O-CD2 2.84Å; Q479-H481 PolarHBondContact O-N 2.91Å
480	F	84.4	Confident	70.4	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	32%	0.323	C	S	.	.			trans	-80.2	122.4	177.8	177.9	-88.7	0	0	0	111.1	L438 V439 R457 C460 Q461 M464 L469 D482 Y487	L438-F480 HydrophobicContact CD2-CE2 4.48Å; V439-F480 HydrophobicContact CG2-CE1 3.5Å; V439-F480 VanDerWaalsContact CG2-CE1 3.5Å; V439-F480 HydrophobicContact CG2-CZ 3.83Å; R457-F480 HydrophobicContact CG-CD1 3.77Å; R457-F480 HydrophobicContact CG-CE1 4.14Å; R457-F480 PolarHBondContact NE-O 3.07Å; R457-F480 VanDerWaalsContact NE-O 3.09Å; R457-F480 PolarHBondContact NH2-O 3.49Å; C460-F480 HydrophobicContact CB-CD1 3.55Å; C460-F480 HydrophobicContact CB-CD2 3.58Å; C460-F480 HydrophobicContact CB-CE1 3.46Å; C460-F480 VanDerWaalsContact CB-CE1 3.46Å; C460-F480 HydrophobicContact CB-CE2 3.47Å; C460-F480 VanDerWaalsContact CB-CE2 3.47Å; C460-F480 HydrophobicContact CB-CG 3.6Å; C460-F480 HydrophobicContact CB-CZ 3.39Å; Q461-F480 HydrophobicContact CB-CB 4.32Å; M464-F480 HydrophobicContact CE-CB 4.16Å; M464-F480 HydrophobicContact CE-CD2 4.49Å; M464-F480 HydrophobicContact SD-CB 4.32Å; L469-F480 HydrophobicContact CD1-CD2 4.23Å; L469-F480 HydrophobicContact CD1-CE2 4.14Å; F480-D482 HydrophobicContact CE1-CB 4.3Å; F480-Y487 HydrophobicContact CD2-CD1 4.35Å; F480-Y487 HydrophobicContact CD2-CD2 4.09Å; F480-Y487 HydrophobicContact CD2-CE1 4.07Å; F480-Y487 AromaticContact CD2-CE2 3.75Å; F480-Y487 HydrophobicContact CD2-CE2 3.75Å; F480-Y487 HydrophobicContact CD2-CG 4.39Å; F480-Y487 AromaticContact CD2-CZ 3.76Å; F480-Y487 AromaticContact CE2-CD2 3.54Å; F480-Y487 HydrophobicContact CE2-CD2 3.54Å; F480-Y487 HydrophobicContact CE2-CE1 4.48Å; F480-Y487 AromaticContact CE2-CE2 3.43Å; F480-Y487 HydrophobicContact CE2-CE2 3.43Å; F480-Y487 VanDerWaalsContact CE2-CE2 3.43Å; F480-Y487 HydrophobicContact CE2-CG 4.12Å; F480-Y487 AromaticContact CE2-CZ 3.96Å; F480-Y487 HydrophobicContact CZ-CD2 4.42Å; F480-Y487 HydrophobicContact CZ-CE2 4.16Å
481	H	72.6	Confident	69.1	Low	68 Å²	68	70.1 Å²	70.1	32%	0.315	34%	0.343	S	S	.	.			trans	-96.4	127.7	176.8	-56.6	-73.8	0	0	0	110.3	Q479 N483 Y487	Q479-H481 PolarHBondContact O-CD2 2.84Å; Q479-H481 PolarHBondContact O-N 2.91Å; H481-N483 VanDerWaalsContact C-N 3.29Å; H481-N483 VanDerWaalsContact CB-OD1 3.32Å; H481-N483 WeakPolarHBondContact CB-OD1 3.5Å; H481-N483 PolarHBondContact O-N 3.38Å; H481-N483 VanDerWaalsContact O-N 3.16Å; H481-N483 PolarHBondContact O-OD1 3.17Å; H481-Y487 WeakPolarHBondContact CB-OH 2.97Å; H481-Y487 PolarHBondContact N-OH 2.91Å
482	D	75	Confident	66.7	Low	31 Å²	31	75.7 Å²	75.7	17%	0.166	37%	0.371	C	S	.	.	S	Bend	trans	-91.7	62.4	-177.5	-176.6	1.4	0	0	0	110.3	R453 R457 F480	R453-D482 IonicContact CZ-OD1 3.74Å; R453-D482 IonicContact CZ-OD2 2.68Å; R453-D482 IonicContact NE-OD1 3.3Å; R453-D482 IonicContact NE-OD2 2.79Å; R453-D482 PolarHBondContact NE-OD2 3.29Å; R453-D482 IonicContact NH2-OD1 3.84Å; R453-D482 PolarHBondContact NH2-OD1 3.13Å; R453-D482 IonicContact NH2-OD2 3.09Å; R453-D482 PolarHBondContact NH2-OD2 3.27Å; R457-D482 HydrophobicContact CG-CB 4.31Å; F480-D482 HydrophobicContact CE1-CB 4.3Å
483	N	62.2	Low	64.8	Low	60 Å²	60	79 Å²	79	32%	0.321	39%	0.389	S	S	.	.	S	Bend	trans	-145.7	-165	-169.9	68.2	-14.8	0	0	0	110.7	G435 L436 H481 T485	G435-N483 PolarHBondContact N-O 2.74Å; L436-N483 VanDerWaalsContact CB-O 3.31Å; L436-N483 WeakPolarHBondContact CB-O 3.45Å; L436-N483 PolarHBondContact N-O 2.79Å; H481-N483 VanDerWaalsContact C-N 3.29Å; H481-N483 VanDerWaalsContact CB-OD1 3.32Å; H481-N483 WeakPolarHBondContact CB-OD1 3.5Å; H481-N483 PolarHBondContact O-N 3.38Å; H481-N483 VanDerWaalsContact O-N 3.16Å; H481-N483 PolarHBondContact O-OD1 3.17Å; N483-T485 PolarHBondContact ND2-OG1 3.1Å; N483-T485 PolarHBondContact O-N 3.07Å; N483-T485 WeakPolarHBondContact OD1-CB 3.41Å; N483-T485 PolarHBondContact OD1-N 2.93Å; N483-T485 PolarHBondContact OD1-OG1 2.89Å; N483-T485 VanDerWaalsContact OD1-OG1 3.07Å
484	F	65.4	Low	63	Low	93 Å²	93	77.1 Å²	77.1	41%	0.408	39%	0.391	S	S	.	.	S	Bend	trans	-80.4	18.6	172.4	-66.4	-75.5	0	0	0	114.5	W368 Y434 F486	W368-F484 HydrophobicContact CE3-CD2 4.36Å; W368-F484 HydrophobicContact CE3-CE2 4.49Å; W368-F484 HydrophobicContact CH2-CB 3.84Å; W368-F484 AromaticContact CH2-CD2 3.56Å; W368-F484 HydrophobicContact CH2-CD2 3.56Å; W368-F484 HydrophobicContact CH2-CE2 4.4Å; W368-F484 AromaticContact CH2-CG 3.93Å; W368-F484 HydrophobicContact CH2-CG 3.93Å; W368-F484 HydrophobicContact CZ2-CD2 4.49Å; W368-F484 AromaticContact CZ3-CD2 3.48Å; W368-F484 HydrophobicContact CZ3-CD2 3.48Å; W368-F484 VanDerWaalsContact CZ3-CD2 3.48Å; W368-F484 AromaticContact CZ3-CE2 3.86Å; W368-F484 HydrophobicContact CZ3-CE2 3.86Å; W368-F484 HydrophobicContact CZ3-CG 4.14Å; Y434-F484 HydrophobicContact CD1-CB 3.98Å; Y434-F484 AromaticContact CD1-CD1 3.86Å; Y434-F484 HydrophobicContact CD1-CD1 3.86Å; Y434-F484 HydrophobicContact CD1-CG 4.44Å; Y434-F484 VanDerWaalsContact CD1-O 3.29Å; Y434-F484 WeakPolarHBondContact CD1-O 3.38Å; Y434-F484 AromaticContact CD2-CD1 3.88Å; Y434-F484 HydrophobicContact CD2-CD1 3.88Å; Y434-F484 HydrophobicContact CD2-CE1 4.3Å; Y434-F484 HydrophobicContact CE1-CB 4.18Å; Y434-F484 HydrophobicContact CE1-CD1 4.04Å; Y434-F484 HydrophobicContact CE2-CD1 4.08Å; Y434-F484 HydrophobicContact CE2-CE1 4.48Å; Y434-F484 AromaticContact CG-CD1 3.76Å; Y434-F484 HydrophobicContact CG-CD1 3.76Å; F484-F486 PolarHBondContact O-N 3.02Å
485	T	68.4	Low	60.8	Low	10 Å²	10	81 Å²	81	6%	0.061	41%	0.413	C	S	.	.			trans	-64.5	130.9	165.3	-66.4	0	0	0	0	108.7	Y434 G435 D471 N483 Y487	Y434-T485 WeakPolarHBondContact CA-O 3.41Å; G435-T485 PolarHBondContact N-O 3.06Å; D471-T485 VanDerWaalsContact CG-CG2 3.48Å; D471-T485 WeakPolarHBondContact OD1-CG2 3.43Å; D471-T485 VanDerWaalsContact OD2-CG2 3.29Å; D471-T485 WeakPolarHBondContact OD2-CG2 3.46Å; N483-T485 PolarHBondContact ND2-OG1 3.1Å; N483-T485 PolarHBondContact O-N 3.07Å; N483-T485 WeakPolarHBondContact OD1-CB 3.41Å; N483-T485 PolarHBondContact OD1-N 2.93Å; N483-T485 PolarHBondContact OD1-OG1 2.89Å; N483-T485 VanDerWaalsContact OD1-OG1 3.07Å; T485-Y487 HydrophobicContact CG2-CE1 4.08Å; T485-Y487 HydrophobicContact CG2-CE2 3.92Å; T485-Y487 WeakPolarHBondContact CG2-OH 3.38Å; T485-Y487 WeakPolarHBondContact O-CD2 3.49Å; T485-Y487 WeakPolarHBondContact O-CE2 3.4Å
486	F	74.7	Confident	58.5	Low	45 Å²	45	81.4 Å²	81.4	20%	0.197	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82	131.6	177	-72.5	-85.1	0	0	0	110.6	F421 C432 Y434 L472 F484	F421-F486 HydrophobicContact CB-CE1 4.13Å; F421-F486 HydrophobicContact CD2-CE1 4.16Å; F421-F486 HydrophobicContact CG-CE1 4.02Å; C432-F486 HydrophobicContact CB-CB 4.49Å; C432-F486 HydrophobicContact CB-CD1 3.92Å; Y434-F486 AromaticContact CD1-CD1 3.89Å; Y434-F486 HydrophobicContact CD1-CD1 3.89Å; Y434-F486 HydrophobicContact CD1-CD2 4.44Å; Y434-F486 AromaticContact CD1-CE1 3.91Å; Y434-F486 HydrophobicContact CD1-CE1 3.91Å; Y434-F486 HydrophobicContact CD1-CE2 4.45Å; Y434-F486 HydrophobicContact CD1-CG 4.19Å; Y434-F486 HydrophobicContact CD1-CZ 4.22Å; Y434-F486 AromaticContact CE1-CD1 3.74Å; Y434-F486 HydrophobicContact CE1-CD1 3.74Å; Y434-F486 HydrophobicContact CE1-CD2 4.01Å; Y434-F486 AromaticContact CE1-CE1 3.31Å; Y434-F486 HydrophobicContact CE1-CE1 3.31Å; Y434-F486 AromaticContact CE1-CE2 3.6Å; Y434-F486 HydrophobicContact CE1-CE2 3.6Å; Y434-F486 HydrophobicContact CE1-CG 4.09Å; Y434-F486 AromaticContact CE1-CZ 3.25Å; Y434-F486 HydrophobicContact CE1-CZ 3.25Å; Y434-F486 HydrophobicContact CE2-CE1 4.47Å; Y434-F486 AromaticContact CZ-CE1 3.63Å; Y434-F486 AromaticContact CZ-CZ 3.58Å; Y434-F486 WeakPolarHBondContact OH-CZ 3.44Å; L472-F486 HydrophobicContact CB-CB 4.21Å; L472-F486 HydrophobicContact CD1-CB 3.67Å; L472-F486 PolarHBondContact N-O 2.86Å; F484-F486 PolarHBondContact O-N 3.02Å
487	Y	77.4	Confident	56.4	Low	0 Å²	0	88.2 Å²	88.2	0%	0	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.9	173	-64.6	-75.6	0	0	0	110.7	C432 T433 M464 L469 T470 D471 F480 H481 T485 L489	C432-Y487 VanDerWaalsContact CA-O 3.32Å; C432-Y487 WeakPolarHBondContact CA-O 3.2Å; T433-Y487 PolarHBondContact N-O 3.44Å; T433-Y487 PolarHBondContact O-N 3.29Å; M464-Y487 HydrophobicContact CE-CD1 3.91Å; M464-Y487 HydrophobicContact CE-CE1 3.3Å; L469-Y487 HydrophobicContact CB-CD1 4.48Å; T470-Y487 CarbonylContact O-C 3.47Å; T470-Y487 WeakPolarHBondContact O-CA 3.25Å; D471-Y487 HydrophobicContact CB-CD1 4.1Å; D471-Y487 HydrophobicContact CB-CE1 3.71Å; F480-Y487 HydrophobicContact CD2-CD1 4.35Å; F480-Y487 HydrophobicContact CD2-CD2 4.09Å; F480-Y487 HydrophobicContact CD2-CE1 4.07Å; F480-Y487 AromaticContact CD2-CE2 3.75Å; F480-Y487 HydrophobicContact CD2-CE2 3.75Å; F480-Y487 HydrophobicContact CD2-CG 4.39Å; F480-Y487 AromaticContact CD2-CZ 3.76Å; F480-Y487 AromaticContact CE2-CD2 3.54Å; F480-Y487 HydrophobicContact CE2-CD2 3.54Å; F480-Y487 HydrophobicContact CE2-CE1 4.48Å; F480-Y487 AromaticContact CE2-CE2 3.43Å; F480-Y487 HydrophobicContact CE2-CE2 3.43Å; F480-Y487 VanDerWaalsContact CE2-CE2 3.43Å; F480-Y487 HydrophobicContact CE2-CG 4.12Å; F480-Y487 AromaticContact CE2-CZ 3.96Å; F480-Y487 HydrophobicContact CZ-CD2 4.42Å; F480-Y487 HydrophobicContact CZ-CE2 4.16Å; H481-Y487 WeakPolarHBondContact CB-OH 2.97Å; H481-Y487 PolarHBondContact N-OH 2.91Å; T485-Y487 HydrophobicContact CG2-CE1 4.08Å; T485-Y487 HydrophobicContact CG2-CE2 3.92Å; T485-Y487 WeakPolarHBondContact CG2-OH 3.38Å; T485-Y487 WeakPolarHBondContact O-CD2 3.49Å; T485-Y487 WeakPolarHBondContact O-CE2 3.4Å; Y487-L489 PolarHBondContact O-N 3.23Å
488	K	73.8	Confident	54.2	Low	60 Å²	60	92.8 Å²	92.8	26%	0.261	46%	0.459	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	115.4	166.9	-172.8	-177.5	-165.9	162.4	0	107.1	E428 Y430 L469 T470 L472	E428-K488 IonicContact OE2-NZ 2.75Å; Y430-K488 HydrophobicContact CD1-CB 4.49Å; Y430-K488 HydrophobicContact CD1-CD 3.4Å; Y430-K488 VanDerWaalsContact CD1-CD 3.4Å; Y430-K488 HydrophobicContact CD1-CG 3.9Å; Y430-K488 HydrophobicContact CE1-CD 3.73Å; Y430-K488 HydrophobicContact CG-CD 4.37Å; L469-K488 WeakPolarHBondContact CA-O 3.25Å; T470-K488 PolarHBondContact N-O 3.34Å; T470-K488 PolarHBondContact O-N 3.24Å; L472-K488 HydrophobicContact CD1-CB 4.01Å; L472-K488 VanDerWaalsContact CD1-N 3.31Å; L472-K488 HydrophobicContact CG-CB 4.17Å
489	L	65.5	Low	51.6	Low	58 Å²	58	94.5 Å²	94.5	30%	0.304	46%	0.463	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	120.4	167.2	-81.6	150	0	0	0	108	L420 Y431 T433 L469 Y487	L420-L489 HydrophobicContact CD2-CD1 3.38Å; Y431-L489 PolarHBondContact O-N 3Å; T433-L489 HydrophobicContact CG2-CD1 3.92Å; T433-L489 HydrophobicContact CG2-CG 4.41Å; L469-L489 HydrophobicContact CD2-CD2 3.5Å; L469-L489 HydrophobicContact CD2-CG 3.74Å; Y487-L489 PolarHBondContact O-N 3.23Å
490	K	57.8	Low	49	Very low	136 Å²	136	94 Å²	94	59%	0.591	46%	0.464	S	S	*	.	P	Polyproline II helix	trans	-84.2	120.3	175.9	-167.3	179.5	-179.3	-179.9	0	109.1	G467 L468	G467-K490 WeakPolarHBondContact O-CD 3.34Å; L468-K490 PolarHBondContact O-N 3.04Å
491	Q	48.5	Very low	46	Very low	147 Å²	147	100.9 Å²	100.9	69%	0.687	50%	0.496	S	S	*	.	P	Polyproline II helix	trans	-61.8	138.2	176.5	-173.5	164.2	-19.3	0	0	110.6
492	I	29.7	Very low	43.4	Very low	123 Å²	123	103 Å²	103	63%	0.631	51%	0.514	S	S	*	.			trans	-97.1	107.8	173.2	-59.5	176.7	0	0	0	106.3	L468 S494	L468-I492 HydrophobicContact CD1-CD1 4.19Å; L468-I492 HydrophobicContact CD2-CD1 3.85Å; L468-I492 HydrophobicContact CD2-CG1 3.66Å; I492-S494 VanDerWaalsContact C-N 3.31Å; I492-S494 PolarHBondContact O-N 2.82Å
493	D	28.3	Very low	40.8	Very low	127 Å²	127	108.7 Å²	108.7	68%	0.679	54%	0.544	S	S	*	.			trans	-74.8	79.1	-173.7	-68.6	-33.3	0	0	0	112.2	N495	D493-N495 PolarHBondContact O-N 3.44Å
494	S	25.1	Very low	38.7	Very low	104 Å²	104	109.9 Å²	109.9	73%	0.727	56%	0.558	S	S	*	*	S	Bend	trans	-80.5	45.4	172.2	65.2	0	0	0	0	112.9	I492	I492-S494 VanDerWaalsContact C-N 3.31Å; I492-S494 PolarHBondContact O-N 2.82Å
495	N	23	Very low	36.5	Very low	161 Å²	161	112.3 Å²	112.3	86%	0.861	56%	0.564	S	S	*	*			trans	177.2	106	148.9	-93.7	-22.3	0	0	0	110.8	D493	D493-N495 PolarHBondContact O-N 3.44Å
496	S	18.7	Very low	34.1	Very low	98 Å²	98	119.5 Å²	119.5	69%	0.685	59%	0.59	S	S	*	*			trans	-84.5	126	171.3	62.9	0	0	0	0	111.4
497	R	19.9	Very low	31.5	Very low	225 Å²	225	122.4 Å²	122.4	85%	0.849	60%	0.602	S	S	*	*			trans	74.9	148.3	159.7	-59.5	178.9	176.9	-172.2	-2.4	115.7
498	L	19	Very low	28.7	Very low	119 Å²	119	127.9 Å²	127.9	62%	0.623	64%	0.636	S	S	*	*			cis	-163.4	159.7	-1.8	-120.3	169	0	0	0	111.3
499	Y	20.2	Very low	26.1	Very low	193 Å²	193	131.1 Å²	131.1	76%	0.757	66%	0.661	S	S	*	*			trans	66	150.3	167.3	-63.4	-70	0	0	0	118.8
500	D	19.7	Very low	23.9	Very low	117 Å²	117	135.2 Å²	135.2	63%	0.626	68%	0.683	S	S	*	*			cis	-169.1	172.8	-35.2	-145.3	-13.4	0	0	0	113.1
501	Q	20.3	Very low	21.9	Very low	144 Å²	144	135.6 Å²	135.6	67%	0.673	69%	0.685	S	S	*	*			trans	70.3	90.9	145.8	-81.6	166.6	55.6	0	0	123.8
502	T	19.2	Very low	20.5	Very low	111 Å²	111	134.1 Å²	134.1	68%	0.681	69%	0.686	S	S	*	*				68.4	146.3	120.2	60.3	0	0	0	0	124.5
503	N	19.2	Very low	20	Very low	151 Å²	151	133.5 Å²	133.5	81%	0.807	69%	0.692	S	S	*	*			trans	72.2	160.6	156.1	-67.1	-37.5	0	0	0	118.5
504	S	19.6	Very low	19.6	Very low	86 Å²	86	137.2 Å²	137.2	60%	0.601	70%	0.703	S	S	*	*			cis	-166.4	101.8	-38.9	-163.8	0	0	0	0	108.6
505	R	18.7	Very low	19.2	Very low	143 Å²	143	142.1 Å²	142.1	54%	0.54	71%	0.707	S	S	.	*				74.9	109.7	98.4	-138.1	-158.1	176.2	-160.8	-4	113	T394 G395 P396	T394-R505 VanDerWaalsContact O-CG 3.26Å; T394-R505 WeakPolarHBondContact O-CG 3.43Å; T394-R505 PolarHBondContact O-NE 2.75Å; T394-R505 PolarHBondContact O-NH2 3.1Å; G395-R505 VanDerWaalsContact C-CG 3.49Å; G395-R505 CarbonylContact O-C 3.42Å; G395-R505 WeakPolarHBondContact O-CA 3.36Å; G395-R505 VanDerWaalsContact O-CG 3.31Å; G395-R505 WeakPolarHBondContact O-CG 3.46Å; P396-R505 WeakPolarHBondContact CD-O 3.4Å; P396-R505 HydrophobicContact CG-CB 4.35Å; P396-R505 HydrophobicContact CG-CG 4.34Å
506	R	18.9	Very low	19	Very low	161 Å²	161	139.8 Å²	139.8	61%	0.608	70%	0.695	S	S	*	*			trans	-159.3	170.2	153.2	-126.9	96.2	-141.4	-176.9	176.5	113.5	G395 L397	G395-R506 CarbonylContact O-C 3.51Å; G395-R506 WeakPolarHBondContact O-CA 3.35Å; G395-R506 PolarHBondContact O-N 3.14Å; L397-R506 HydrophobicContact CB-CG 4.22Å
507	K	19.4	Very low	19	Very low	106 Å²	106	141 Å²	141	46%	0.461	69%	0.693	S	S	.	*			trans	-110.9	174.2	-161	-135.1	-167.4	-178.5	-159.9	0	116.9	E549	K507-E549 IonicContact NZ-OE1 2.76Å; K507-E549 PolarHBondContact NZ-OE1 3.47Å
508	T	19.3	Very low	18.9	Very low	116 Å²	116	138.8 Å²	138.8	71%	0.712	69%	0.69	S	S	*	*			trans	76.7	101.7	157.9	42.1	0	0	0	0	123.4
509	V	18.3	Very low	18.9	Very low	128 Å²	128	139.2 Å²	139.2	78%	0.776	69%	0.693	S	S	*	*				41.2	121.2	109.2	-179.9	0	0	0	0	119.1
510	D	18.4	Very low	18.9	Very low	143 Å²	143	135.7 Å²	135.7	77%	0.765	69%	0.692	S	S	*	*				-169.9	175.8	99.7	-136.3	-24.8	0	0	0	115.6
511	F	17.1	Very low	18.8	Very low	145 Å²	145	136.6 Å²	136.6	64%	0.636	70%	0.696	S	S	*	*			trans	-59.8	148.5	-169.1	-95.4	-119.5	0	0	0	119.3
512	T	19.2	Very low	18.7	Very low	115 Å²	115	135.2 Å²	135.2	71%	0.706	70%	0.703	S	S	*	*			trans	25	124.5	145.7	65.9	0	0	0	0	118.8
513	S	19.3	Very low	18.7	Very low	110 Å²	110	136.3 Å²	136.3	77%	0.769	71%	0.709	S	S	*	*				179.2	167.4	58.8	44.1	0	0	0	0	112.6	Y515	S513-Y515 PolarHBondContact O-N 2.88Å
514	F	18.4	Very low	18.7	Very low	205 Å²	205	134 Å²	134	90%	0.899	71%	0.705	S	S	*	*			trans	-26.8	108.4	168.7	-81.1	-105.5	0	0	0	116.5
515	Y	18	Very low	18.6	Very low	208 Å²	208	136.2 Å²	136.2	82%	0.816	72%	0.715	S	S	*	*			trans	-157.8	136.3	144.3	-119.1	-55.8	0	0	0	113.2	S513	S513-Y515 PolarHBondContact O-N 2.88Å
516	N	18.8	Very low	18.6	Very low	112 Å²	112	136.9 Å²	136.9	60%	0.599	73%	0.727	S	S	*	*			trans	58.3	120.9	156.6	-71.7	-26.7	0	0	0	121.2
517	N	18.9	Very low	18.6	Very low	123 Å²	123	135.4 Å²	135.4	66%	0.658	73%	0.732	S	S	*	*				49.4	128.9	122.3	-38.6	-28.6	0	0	0	117.9
518	F	17.9	Very low	18.5	Very low	179 Å²	179	135.9 Å²	135.9	79%	0.785	74%	0.744	S	S	*	*			cis	-149.4	138.4	48.1	-95.1	-108.9	0	0	0	109
519	N	18.9	Very low	18.5	Very low	127 Å²	127	135.9 Å²	135.9	68%	0.679	74%	0.744	S	S	*	*				85.1	165	69.9	-161.4	12.3	0	0	0	113.7
520	V	18.8	Very low	18.5	Very low	120 Å²	120	140.4 Å²	140.4	73%	0.727	75%	0.748	S	S	*	*			trans	86.8	74.7	171.8	-162.2	0	0	0	0	117.9
521	N	18.3	Very low	18.5	Very low	136 Å²	136	139 Å²	139	73%	0.727	75%	0.75	S	S	*	*			trans	0.1	129.5	134.9	-54.3	-28.2	0	0	0	120.2
522	S	18.9	Very low	18.7	Very low	115 Å²	115	137.1 Å²	137.1	80%	0.804	75%	0.754	S	S	*	*				-174.3	138.6	124.6	41.3	0	0	0	0	109.2
523	T	17.8	Very low	18.8	Very low	133 Å²	133	139 Å²	139	82%	0.816	76%	0.758	S	S	*	*			cis	89.3	61.6	7.5	80.3	0	0	0	0	120.1
524	S	19	Very low	18.8	Very low	102 Å²	102	141.9 Å²	141.9	71%	0.713	77%	0.765	S	S	*	*			trans	-168.8	123.3	139.3	51.2	0	0	0	0	108.4
525	T	18.5	Very low	18.9	Very low	133 Å²	133	135.9 Å²	135.9	82%	0.816	76%	0.76	S	S	*	*				57.6	98.4	58.8	68.9	0	0	0	0	115
526	I	18.6	Very low	19	Very low	157 Å²	157	133.7 Å²	133.7	81%	0.805	76%	0.761	S	S	*	*			trans	-156.4	116.6	146	-100.2	150.8	0	0	0	109.4
527	D	17.8	Very low	19	Very low	130 Å²	130	137.2 Å²	137.2	70%	0.695	77%	0.773	S	S	*	*			trans	39.7	123.3	141.2	-51.8	-34.6	0	0	0	125.4
528	T	18.9	Very low	19.3	Very low	117 Å²	117	139.4 Å²	139.4	72%	0.718	78%	0.78	S	S	*	*			trans	55	120.8	130.8	65.4	0	0	0	0	122.7
529	T	19.1	Very low	19.9	Very low	115 Å²	115	136.3 Å²	136.3	71%	0.706	78%	0.777	S	S	*	*			trans	52.9	113.9	138.6	59	0	0	0	0	119.5
530	Y	17.3	Very low	20	Very low	224 Å²	224	136.7 Å²	136.7	88%	0.878	78%	0.779	S	S	*	*				-161	171.4	88.2	-119.1	-91.8	0	0	0	112.1
531	S	19.3	Very low	20.2	Very low	113 Å²	113	142 Å²	142	79%	0.79	79%	0.786	S	S	*	*			trans	-100.2	97.8	-169	-56.6	0	0	0	0	114.6
532	S	20.4	Very low	20.4	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	77%	0.768	S	S	*	*			trans	-157.9	100.5	157	52.6	0	0	0	0	107.9
533	I	21.4	Very low	20.6	Very low	154 Å²	154	139.3 Å²	139.3	79%	0.79	76%	0.762	S	S	*	*				51.1	115.4	77.5	-58.4	-179.5	0	0	0	110.7
534	L	19.9	Very low	20.7	Very low	172 Å²	172	140.2 Å²	140.2	90%	0.901	76%	0.757	S	S	*	*			trans	76.1	78.1	-175.5	-58.5	163.9	0	0	0	115.6
535	G	19.6	Very low	20.8	Very low	78 Å²	78	142.4 Å²	142.4	80%	0.804	76%	0.759	S	S	*	*			trans	-128.3	119	157.9	0	0	0	0	0	109.2
536	I	21.2	Very low	20.9	Very low	163 Å²	163	138.3 Å²	138.3	84%	0.836	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-86.5	137.8	-179.7	-65.5	169	0	0	0	108.8
537	H	19.4	Very low	21	Very low	185 Å²	185	133.8 Å²	133.8	86%	0.856	72%	0.715	S	S	*	*	P	Polyproline II helix	trans	-92.7	119.9	170.1	-121.2	-70.2	0	0	0	109.5
538	E	23.8	Very low	21.1	Very low	170 Å²	170	131.5 Å²	131.5	79%	0.794	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-77.3	152.8	165.3	-85.9	-168.9	125.1	0	0	111.7
539	P	32.1	Very low	21.2	Very low	113 Å²	113	130.6 Å²	130.6	73%	0.734	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-89.4	140.3	-173.3	35.3	-34.1	0	0	0	112.5
540	N	19.4	Very low	21.3	Very low	135 Å²	135	130.8 Å²	130.8	72%	0.722	69%	0.693	S	S	*	*			trans	-124.1	25.6	-165.4	-131.3	1.6	0	0	0	115
541	W	23.1	Very low	21.3	Very low	231 Å²	231	124.5 Å²	124.5	88%	0.875	67%	0.672	S	S	*	*	S	Bend	trans	-132.5	19.5	173	71.2	-89.3	0	0	0	115
542	L	23.7	Very low	21.3	Very low	63 Å²	63	123.8 Å²	123.8	33%	0.33	67%	0.667	S	S	.	*			trans	-111.4	58.2	141.2	-159.2	99.4	0	0	0	111.8	T390	T390-L542 VanDerWaalsContact C-CD2 3.49Å; T390-L542 VanDerWaalsContact CA-CD2 3.45Å; T390-L542 HydrophobicContact CG2-CB 4.14Å; T390-L542 HydrophobicContact CG2-CD2 4.16Å; T390-L542 WeakPolarHBondContact O-CD1 3.39Å
543	L	21.6	Very low	21.2	Very low	132 Å²	132	123.3 Å²	123.3	69%	0.691	66%	0.664	S	S	*	*	S	Bend	trans	-110.8	25.2	152.7	-74.4	177	0	0	0	111.7
544	E	20.4	Very low	21	Very low	153 Å²	153	127.2 Å²	127.2	72%	0.715	67%	0.669	S	S	*	*	S	Bend	trans	-174.3	173.1	153.1	-104.9	148.5	-151.3	0	0	113.1
545	I	21.3	Very low	20.9	Very low	148 Å²	148	123.4 Å²	123.4	76%	0.759	66%	0.656	S	S	*	*			trans	64.6	99.7	-179.2	-44.6	173.8	0	0	0	114.8
546	N	20.9	Very low	20.8	Very low	47 Å²	47	123.9 Å²	123.9	25%	0.251	65%	0.647	S	S	.	*			cis	96.8	78.2	3.1	-138	23.3	0	0	0	119	S393 T394	S393-N546 WeakPolarHBondContact CA-OD1 3.43Å; S393-N546 PolarHBondContact N-OD1 3.35Å; S393-N546 PolarHBondContact O-ND2 3.46Å; S393-N546 PolarHBondContact O-OD1 2.88Å; S393-N546 PolarHBondContact OG-ND2 3.46Å; S393-N546 VanDerWaalsContact OG-ND2 3.17Å; S393-N546 PolarHBondContact OG-OD1 2.9Å; T394-N546 WeakPolarHBondContact CA-OD1 3.25Å; T394-N546 PolarHBondContact N-OD1 3.46Å
547	S	19.9	Very low	20.7	Very low	61 Å²	61	122.3 Å²	122.3	43%	0.427	65%	0.645	S	S	.	*			trans	63.5	120.2	137.7	67.5	0	0	0	0	124.4
548	S	21.5	Very low	21.1	Very low	83 Å²	83	117.9 Å²	117.9	58%	0.58	63%	0.633	S	S	*	*			trans	67.7	120.3	130.3	72.2	0	0	0	0	122.1
549	E	19.6	Very low	20.8	Very low	98 Å²	98	119.6 Å²	119.6	46%	0.458	63%	0.634	S	S	.	*				179.1	94.1	95.6	-92.1	175.7	-123.7	0	0	113	K507	K507-E549 IonicContact NZ-OE1 2.76Å; K507-E549 PolarHBondContact NZ-OE1 3.47Å
550	N	21.1	Very low	20	Very low	119 Å²	119	120.4 Å²	120.4	64%	0.636	63%	0.631	S	S	*	*			trans	52	-169.9	143.7	-48.2	-7	0	0	0	117.5	N405	N405-N550 WeakPolarHBondContact CA-O 3.29Å; N405-N550 WeakPolarHBondContact CB-O 3.47Å; N405-N550 PolarHBondContact N-O 3.37Å
551	E	18.7	Very low	19.9	Very low	91 Å²	91	117.9 Å²	117.9	43%	0.425	62%	0.617	S	S	.	*			cis	-135.2	-117.3	-2.1	-67.3	173.8	-154.4	0	0	110.5	H403	H403-E551 IonicContact CE1-OE1 3.18Å; H403-E551 IonicContact CE1-OE2 2.78Å; H403-E551 PolarHBondContact CE1-OE2 2.86Å; H403-E551 VanDerWaalsContact CE1-OE2 3.25Å; H403-E551 IonicContact CG-OE1 2.87Å; H403-E551 IonicContact CG-OE2 2.96Å; H403-E551 IonicContact ND1-OE1 2.72Å; H403-E551 PolarHBondContact ND1-OE1 3.5Å; H403-E551 IonicContact ND1-OE2 3.64Å; H403-E551 PolarHBondContact ND1-OE2 3.13Å
552	S	18.8	Very low	19.6	Very low	98 Å²	98	111.1 Å²	111.1	69%	0.685	60%	0.595	S	S	*	*			trans	-163.7	158.3	179.2	69	0	0	0	0	115
553	S	18.4	Very low	19.4	Very low	96 Å²	96	109 Å²	109	67%	0.671	59%	0.589	S	S	*	*			trans	114.2	140.9	135.2	84.6	0	0	0	0	120.1
554	R	17.6	Very low	19.1	Very low	236 Å²	236	107.4 Å²	107.4	89%	0.891	58%	0.576	S	S	*	*			trans	62.6	156.3	157.3	-70.6	174.4	179.1	174.3	0.2	118.3
555	S	17.3	Very low	19.1	Very low	91 Å²	91	104.6 Å²	104.6	64%	0.636	57%	0.566	S	S	*	*			cis	-174.4	179.6	-35.5	52.3	0	0	0	0	107.5
556	S	17.7	Very low	19	Very low	89 Å²	89	101.3 Å²	101.3	62%	0.622	55%	0.55	S	S	*	*			trans	52.2	101.9	144.6	58.2	0	0	0	0	119.8
557	T	17.4	Very low	18.9	Very low	129 Å²	129	104.8 Å²	104.8	79%	0.791	56%	0.563	S	S	*	*				40	159.6	113.6	61.8	0	0	0	0	121.4
558	P	28.6	Very low	18.8	Very low	92 Å²	92	109 Å²	109	60%	0.597	57%	0.574	S	S	*	*			cis	-129	-141.9	-41.3	41	-27.1	0	0	0	110.9
559	Y	17.2	Very low	18.8	Very low	206 Å²	206	108.1 Å²	108.1	81%	0.808	57%	0.568	S	S	*	*			trans	86.2	158.8	163.7	-52.5	-74	0	0	0	121.3
560	L	16.2	Very low	18.8	Very low	130 Å²	130	112.4 Å²	112.4	68%	0.681	59%	0.585	S	S	*	*			trans	83.7	122.1	155.7	-67.9	148.7	0	0	0	122.6	L609 T610	L560-L609 HydrophobicContact CD2-CD2 3.52Å; L560-T610 HydrophobicContact CD2-CG2 4.15Å
561	I	16.5	Very low	18.9	Very low	83 Å²	83	112.8 Å²	112.8	43%	0.426	59%	0.594	S	S	.	*				-155.9	-49.3	-80.3	-169.6	144.1	0	0	0	122.6	T610 N611	I561-T610 HydrophobicContact CG2-CG2 3.95Å; I561-N611 VanDerWaalsContact CD1-O 3.3Å; I561-N611 WeakPolarHBondContact CD1-O 3.4Å; I561-N611 HydrophobicContact CG1-CB 4.47Å; I561-N611 WeakPolarHBondContact CG1-OD1 2.93Å; I561-N611 PolarHBondContact O-OD1 3.4Å
562	E	17.2	Very low	19	Very low	89 Å²	89	114.3 Å²	114.3	42%	0.416	61%	0.612	S	S	.	*			trans	-139	-147.7	-169.1	-149.7	-135.9	-117.7	0	0	121.1	F564 T608 L609 N611	E562-F564 WeakPolarHBondContact OE2-CD2 3.39Å; E562-F564 VanDerWaalsContact OE2-CE2 3.31Å; E562-F564 WeakPolarHBondContact OE2-CE2 3.47Å; E562-T608 CarbonylContact O-C 3.51Å; E562-T608 PolarHBondContact O-N 3.49Å; E562-L609 PolarHBondContact O-N 3.37Å; E562-N611 HydrophobicContact CB-CB 3.71Å; E562-N611 WeakPolarHBondContact CB-OD1 3.47Å; E562-N611 HydrophobicContact CG-CB 3.58Å; E562-N611 VanDerWaalsContact CG-OD1 3.29Å; E562-N611 WeakPolarHBondContact CG-OD1 3.32Å; E562-N611 WeakPolarHBondContact OE1-CB 3.28Å
563	G	18.6	Very low	19.1	Very low	19 Å²	19	113.2 Å²	113.2	20%	0.196	62%	0.615	C	S	.	*			trans	58	-170.4	158	0	0	0	0	0	121.3	P607 T608	G563-P607 CarbonylContact O-C 3.56Å; G563-P607 WeakPolarHBondContact O-CA 3.5Å; G563-T608 VanDerWaalsContact CA-OG1 3.26Å; G563-T608 WeakPolarHBondContact CA-OG1 3.43Å; G563-T608 PolarHBondContact O-N 3.03Å
564	F	16.5	Very low	19.1	Very low	98 Å²	98	114.3 Å²	114.3	43%	0.43	62%	0.618	S	S	.	*			cis	-171.2	142.8	-37.2	-115.8	-68.2	0	0	0	111.3	E562 P607 T608	E562-F564 WeakPolarHBondContact OE2-CD2 3.39Å; E562-F564 VanDerWaalsContact OE2-CE2 3.31Å; E562-F564 WeakPolarHBondContact OE2-CE2 3.47Å; F564-P607 VanDerWaalsContact N-N 3.11Å; F564-P607 CarbonylContact O-C 3.06Å; F564-P607 WeakPolarHBondContact O-CD 3.46Å; F564-P607 VanDerWaalsContact O-N 3.1Å; F564-P607 VanDerWaalsContact O-O 3.1Å; F564-T608 HydrophobicContact CB-CG2 4.28Å; F564-T608 WeakPolarHBondContact CB-OG1 3.37Å; F564-T608 VanDerWaalsContact N-N 3.14Å
565	N	19.6	Very low	19.2	Very low	93 Å²	93	114.3 Å²	114.3	50%	0.497	62%	0.618	S	S	.	*			trans	80.5	103	175.7	-42.7	-50.3	0	0	0	117.9	Q606 P607	N565-Q606 VanDerWaalsContact C-CA 3.46Å; N565-Q606 VanDerWaalsContact CA-NE2 3.27Å; N565-Q606 VanDerWaalsContact N-CG 3.34Å; N565-Q606 VanDerWaalsContact O-CA 3.28Å; N565-Q606 WeakPolarHBondContact O-CA 3.32Å; N565-Q606 PolarHBondContact O-N 3.03Å; N565-P607 WeakPolarHBondContact O-CD 3.5Å
566	D	18.6	Very low	19.6	Very low	80 Å²	80	115.3 Å²	115.3	43%	0.428	62%	0.622	S	S	.	*	S	Bend	cis	-135.2	-58.3	5.7	-62.4	-50.3	0	0	0	116.9	T605 Q606	D566-T605 CarbonylContact C-O 3.33Å; D566-T605 VanDerWaalsContact C-O 3.24Å; D566-T605 PolarHBondContact N-OG1 3.33Å; D566-Q606 WeakPolarHBondContact O-CG 3.49Å; D566-Q606 PolarHBondContact O-NE2 3.19Å
567	F	19.5	Very low	19.7	Very low	120 Å²	120	116.1 Å²	116.1	53%	0.526	63%	0.628	S	S	.	*			trans	-113.3	105.6	-150.3	-62.2	-67.7	0	0	0	119.2	Y603 T604 T605	F567-Y603 CarbonylContact O-C 3.58Å; F567-T604 HydrophobicContact CB-CG2 3.9Å; F567-T604 HydrophobicContact CD2-CG2 4.31Å; F567-T604 CarbonylContact O-C 3.31Å; F567-T604 WeakPolarHBondContact O-CA 3.49Å; F567-T604 WeakPolarHBondContact O-CB 3.48Å; F567-T604 PolarHBondContact O-N 3.19Å; F567-T605 CarbonylContact C-O 3.11Å; F567-T605 PolarHBondContact N-O 2.98Å; F567-T605 PolarHBondContact N-OG1 3.18Å; F567-T605 VanDerWaalsContact N-OG1 3.08Å; F567-T605 PolarHBondContact O-N 3.01Å
568	K	18.3	Very low	19.7	Very low	148 Å²	148	118.8 Å²	118.8	64%	0.643	63%	0.629	S	S	*	*			trans	-61.4	151.7	151	-44.8	92.6	-178	165.9	0	111.2
569	S	20.5	Very low	19.3	Very low	65 Å²	65	122.7 Å²	122.7	46%	0.455	64%	0.639	S	S	.	*			trans	-150.6	107.6	133.2	82.9	0	0	0	0	115.4	Y603	S569-Y603 PolarHBondContact N-O 2.94Å; S569-Y603 VanDerWaalsContact N-O 3.16Å; S569-Y603 WeakPolarHBondContact OG-CB 3.41Å
570	K	20	Very low	19.4	Very low	189 Å²	189	117.7 Å²	117.7	82%	0.822	63%	0.63	S	S	*	*			trans	-46.5	155.9	159.8	-81.2	177.3	176.9	177.2	0	113
571	P	24.1	Very low	19.8	Very low	126 Å²	126	114.6 Å²	114.6	82%	0.818	63%	0.629	S	S	*	*				-140.7	160	68.9	36.9	-18.7	0	0	0	118.3
572	P	20.8	Very low	20	Very low	124 Å²	124	120.7 Å²	120.7	81%	0.805	65%	0.653	S	S	*	*			trans	-90.6	162.1	174.3	37.4	-35.6	0	0	0	113.8
573	G	20.3	Very low	20.2	Very low	74 Å²	74	123.9 Å²	123.9	76%	0.763	67%	0.673	S	S	*	*			trans	-166.5	36.8	-172.9	0	0	0	0	0	120.5
574	V	19.7	Very low	20.5	Very low	119 Å²	119	128.1 Å²	128.1	72%	0.721	70%	0.695	S	S	*	*			trans	43.6	100.2	150.9	-171.2	0	0	0	0	120.7
575	R	19.7	Very low	20.8	Very low	236 Å²	236	129 Å²	129	89%	0.891	71%	0.713	S	S	*	*			trans	65.8	159	143.1	-60.4	174.1	-177.3	-179.8	-0.3	119.9
576	P	25.4	Very low	20.8	Very low	113 Å²	113	131.3 Å²	131.3	73%	0.734	71%	0.714	S	S	*	*			cis	-125.8	-163.9	-14.1	40.6	-23.9	0	0	0	113.2
577	S	18.6	Very low	21.3	Very low	106 Å²	106	135 Å²	135	74%	0.741	73%	0.731	S	S	*	*			trans	54.3	98.6	164.7	50	0	0	0	0	117.2
578	F	17.4	Very low	21.3	Very low	185 Å²	185	140.1 Å²	140.1	81%	0.811	75%	0.747	S	S	*	*				73.9	81.8	59.2	-158.6	-85.1	0	0	0	114	V580	F578-V580 HydrophobicContact CE1-CG2 3.87Å; F578-V580 HydrophobicContact CE2-CG2 4.37Å; F578-V580 HydrophobicContact CZ-CG2 3.78Å
579	E	19.7	Very low	21.4	Very low	173 Å²	173	138.3 Å²	138.3	81%	0.808	75%	0.745	S	S	*	*			trans	-126.1	143.2	151.2	-76.9	-154	120.8	0	0	109.2
580	V	20.8	Very low	21.4	Very low	101 Å²	101	141.4 Å²	141.4	61%	0.612	77%	0.765	S	S	*	*			trans	-111.1	135.1	-173.3	169.4	0	0	0	0	110.7	F578	F578-V580 HydrophobicContact CE1-CG2 3.87Å; F578-V580 HydrophobicContact CE2-CG2 4.37Å; F578-V580 HydrophobicContact CZ-CG2 3.78Å
581	G	23	Very low	21.3	Very low	65 Å²	65	136.5 Å²	136.5	67%	0.67	75%	0.754	S	S	*	*			trans	59	70.5	141.2	0	0	0	0	0	118.4	D583	G581-D583 VanDerWaalsContact C-N 3.34Å; G581-D583 PolarHBondContact O-N 3.16Å
582	K	21.6	Very low	21.1	Very low	211 Å²	211	136.9 Å²	136.9	92%	0.917	75%	0.748	S	S	*	*			trans	-89.4	71.7	150.8	-91.6	-168.1	174.8	-179.6	0	111
583	D	21.9	Very low	21.1	Very low	157 Å²	157	138.2 Å²	138.2	84%	0.84	74%	0.744	S	S	*	*			trans	-136.5	21.4	168.3	-104.2	-38.1	0	0	0	114	G581	G581-D583 VanDerWaalsContact C-N 3.34Å; G581-D583 PolarHBondContact O-N 3.16Å
584	V	24.6	Very low	21.1	Very low	108 Å²	108	139.9 Å²	139.9	66%	0.655	74%	0.744	S	S	*	*	S	Bend	trans	-124.2	50	170.3	-163	0	0	0	0	111.1	M587	V584-M587 HydrophobicContact CG1-CB 4.42Å; V584-M587 HydrophobicContact CG1-SD 4.04Å
585	S	22.5	Very low	21.1	Very low	116 Å²	116	142.3 Å²	142.3	81%	0.811	75%	0.752	S	S	*	*	S	Bend	trans	-157.2	37.6	161.6	-81.3	0	0	0	0	114.1
586	R	19.5	Very low	21	Very low	141 Å²	141	134 Å²	134	53%	0.532	74%	0.74	S	S	.	*	S	Bend	trans	-105.1	19	134.8	-83.3	-167.1	164.7	121	5.7	111.8	R588 D589 S591	R586-R588 CarbonylContact O-C 3.55Å; R586-R588 PolarHBondContact O-N 3.13Å; R586-D589 VanDerWaalsContact C-N 3.3Å; R586-D589 WeakPolarHBondContact CD-O 3.28Å; R586-D589 VanDerWaalsContact CG-O 3.24Å; R586-D589 WeakPolarHBondContact CG-O 3.31Å; R586-D589 PolarHBondContact NE-O 3.38Å; R586-D589 PolarHBondContact O-N 3.45Å; R586-S591 PolarHBondContact NE-O 3.17Å; R586-S591 PolarHBondContact NH2-O 2.91Å
587	M	30.3	Very low	20.7	Very low	159 Å²	159	133.7 Å²	133.7	78%	0.783	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	2.4	176.6	-141	174.5	-168.8	0	0	114	V584	V584-M587 HydrophobicContact CG1-CB 4.42Å; V584-M587 HydrophobicContact CG1-SD 4.04Å
588	R	19.3	Very low	20.8	Very low	226 Å²	226	134.3 Å²	134.3	85%	0.853	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn		-134.7	105.5	114.8	-69	-164.4	-174.6	128	6.9	109.1	R586	R586-R588 CarbonylContact O-C 3.55Å; R586-R588 PolarHBondContact O-N 3.13Å
589	D	20.6	Very low	20.9	Very low	111 Å²	111	132.8 Å²	132.8	59%	0.594	74%	0.735	S	S	*	*				162.9	106.8	121.6	-78.7	-10.4	0	0	0	109.4	R586 S591	R586-D589 VanDerWaalsContact C-N 3.3Å; R586-D589 WeakPolarHBondContact CD-O 3.28Å; R586-D589 VanDerWaalsContact CG-O 3.24Å; R586-D589 WeakPolarHBondContact CG-O 3.31Å; R586-D589 PolarHBondContact NE-O 3.38Å; R586-D589 PolarHBondContact O-N 3.45Å; D589-S591 PolarHBondContact O-N 2.86Å
590	C	19.4	Very low	20.9	Very low	130 Å²	130	131.5 Å²	131.5	88%	0.878	73%	0.727	S	S	*	*			trans	-74.8	75.2	164.1	-84.2	0	0	0	0	109.7
591	S	18.7	Very low	20.7	Very low	85 Å²	85	136.6 Å²	136.6	59%	0.594	74%	0.735	S	S	*	*			trans	-147	138.7	160.8	-77.7	0	0	0	0	110.6	R586 D589	R586-S591 PolarHBondContact NE-O 3.17Å; R586-S591 PolarHBondContact NH2-O 2.91Å; D589-S591 PolarHBondContact O-N 2.86Å
592	L	20.1	Very low	20.5	Very low	134 Å²	134	141.5 Å²	141.5	70%	0.702	74%	0.738	S	S	*	*			trans	-45.7	154.4	160.5	-82.3	47.6	0	0	0	110
593	E	19.8	Very low	20.4	Very low	152 Å²	152	138.3 Å²	138.3	71%	0.71	72%	0.721	S	S	*	*			cis	-164.5	-168.1	18.3	-136.1	157.3	-141.9	0	0	113.1
594	S	20.3	Very low	20.2	Very low	109 Å²	109	134.9 Å²	134.9	76%	0.762	71%	0.706	S	S	*	*			trans	78.5	137	-179.2	81.1	0	0	0	0	115.2
595	L	19.4	Very low	20	Very low	171 Å²	171	133.2 Å²	133.2	90%	0.895	70%	0.696	S	S	*	*			cis	-155.5	146.9	13.8	-168.4	76.2	0	0	0	111.6
596	G	18.7	Very low	19.8	Very low	61 Å²	61	130.8 Å²	130.8	63%	0.629	67%	0.672	S	S	*	*			trans	93.6	102.1	139.3	0	0	0	0	0	122.3
597	S	19.5	Very low	20.4	Very low	106 Å²	106	128.6 Å²	128.6	74%	0.741	68%	0.676	S	S	*	*				72.3	131.3	125.7	57	0	0	0	0	124.9
598	T	19.8	Very low	19.8	Very low	119 Å²	119	125.1 Å²	125.1	73%	0.73	66%	0.664	S	S	*	*			trans	68.9	120.3	148.5	48.6	0	0	0	0	119.8
599	Q	19.8	Very low	19.7	Very low	153 Å²	153	118.6 Å²	118.6	72%	0.715	65%	0.645	S	S	*	*				66.6	134.7	60.6	-69.4	-169.6	8.2	0	0	113.8
600	K	18.6	Very low	19.6	Very low	146 Å²	146	117.3 Å²	117.3	64%	0.635	64%	0.642	S	S	*	*			cis	-142.7	177	4.3	-89.6	130.2	170.9	152.4	0	108.1
601	W	16.9	Very low	19.6	Very low	209 Å²	209	114.3 Å²	114.3	79%	0.792	62%	0.617	S	S	*	*			cis	-128.3	-150.2	18.1	-68.5	89.5	0	0	0	109.8
602	K	18.4	Very low	19.7	Very low	168 Å²	168	117.5 Å²	117.5	73%	0.73	62%	0.622	S	S	*	*			cis	64.1	147.1	13.7	-55.1	-168.2	178.6	-173.8	0	117.3
603	Y	19.8	Very low	19.6	Very low	144 Å²	144	119 Å²	119	57%	0.565	63%	0.625	S	S	*	*			cis	-119.4	158.5	-0.7	-75.4	-115.7	0	0	0	109.3	F567 S569	F567-Y603 CarbonylContact O-C 3.58Å; S569-Y603 PolarHBondContact N-O 2.94Å; S569-Y603 VanDerWaalsContact N-O 3.16Å; S569-Y603 WeakPolarHBondContact OG-CB 3.41Å
604	T	19.4	Very low	19.7	Very low	85 Å²	85	120 Å²	120	52%	0.521	63%	0.63	S	S	.	*			cis	176.2	-116.1	-2.8	-74.5	0	0	0	0	106.2	F567	F567-T604 HydrophobicContact CB-CG2 3.9Å; F567-T604 HydrophobicContact CD2-CG2 4.31Å; F567-T604 CarbonylContact O-C 3.31Å; F567-T604 WeakPolarHBondContact O-CA 3.49Å; F567-T604 WeakPolarHBondContact O-CB 3.48Å; F567-T604 PolarHBondContact O-N 3.19Å
605	T	18.9	Very low	19.7	Very low	72 Å²	72	120.9 Å²	120.9	44%	0.442	63%	0.633	S	S	.	*			trans	-117.5	172.5	-157.1	47.8	0	0	0	0	120.1	D566 F567	D566-T605 CarbonylContact C-O 3.33Å; D566-T605 VanDerWaalsContact C-O 3.24Å; D566-T605 PolarHBondContact N-OG1 3.33Å; F567-T605 CarbonylContact C-O 3.11Å; F567-T605 PolarHBondContact N-O 2.98Å; F567-T605 PolarHBondContact N-OG1 3.18Å; F567-T605 VanDerWaalsContact N-OG1 3.08Å; F567-T605 PolarHBondContact O-N 3.01Å
606	Q	19.4	Very low	19.6	Very low	66 Å²	66	119.2 Å²	119.2	31%	0.308	62%	0.624	S	S	.	*			trans	157	105.1	155.2	-70.7	-131.3	-66.8	0	0	113.2	N565 D566	N565-Q606 VanDerWaalsContact C-CA 3.46Å; N565-Q606 VanDerWaalsContact CA-NE2 3.27Å; N565-Q606 VanDerWaalsContact N-CG 3.34Å; N565-Q606 VanDerWaalsContact O-CA 3.28Å; N565-Q606 WeakPolarHBondContact O-CA 3.32Å; N565-Q606 PolarHBondContact O-N 3.03Å; D566-Q606 WeakPolarHBondContact O-CG 3.49Å; D566-Q606 PolarHBondContact O-NE2 3.19Å
607	P	31.5	Very low	19.7	Very low	94 Å²	94	124.1 Å²	124.1	61%	0.61	64%	0.635	S	S	*	*			trans	-132.9	130.6	171.5	38.9	-27.6	0	0	0	118.8	G563 F564 N565	G563-P607 CarbonylContact O-C 3.56Å; G563-P607 WeakPolarHBondContact O-CA 3.5Å; F564-P607 VanDerWaalsContact N-N 3.11Å; F564-P607 CarbonylContact O-C 3.06Å; F564-P607 WeakPolarHBondContact O-CD 3.46Å; F564-P607 VanDerWaalsContact O-N 3.1Å; F564-P607 VanDerWaalsContact O-O 3.1Å; N565-P607 WeakPolarHBondContact O-CD 3.5Å
608	T	17.9	Very low	19.6	Very low	86 Å²	86	128 Å²	128	53%	0.528	64%	0.639	S	S	.	*			trans	-161.2	-91.3	163.2	54.5	0	0	0	0	118.4	E562 G563 F564	E562-T608 CarbonylContact O-C 3.51Å; E562-T608 PolarHBondContact O-N 3.49Å; G563-T608 VanDerWaalsContact CA-OG1 3.26Å; G563-T608 WeakPolarHBondContact CA-OG1 3.43Å; G563-T608 PolarHBondContact O-N 3.03Å; F564-T608 HydrophobicContact CB-CG2 4.28Å; F564-T608 WeakPolarHBondContact CB-OG1 3.37Å; F564-T608 VanDerWaalsContact N-N 3.14Å
609	L	17.8	Very low	19.8	Very low	90 Å²	90	127.9 Å²	127.9	47%	0.471	64%	0.644	S	S	.	*			trans	140.7	125.6	-130.6	170.9	-73.6	0	0	0	105.4	L560 E562	L560-L609 HydrophobicContact CD2-CD2 3.52Å; E562-L609 PolarHBondContact O-N 3.37Å
610	T	18.8	Very low	19.8	Very low	84 Å²	84	125.9 Å²	125.9	52%	0.515	64%	0.642	S	S	.	*			cis	-141.6	146.1	13.8	39.7	0	0	0	0	114.2	L560 I561	L560-T610 HydrophobicContact CD2-CG2 4.15Å; I561-T610 HydrophobicContact CG2-CG2 3.95Å
611	N	18.7	Very low	19.8	Very low	67 Å²	67	128.3 Å²	128.3	36%	0.358	66%	0.655	S	S	.	*			trans	-138.1	-152.2	161.5	77.2	-64.7	0	0	0	112.1	I561 E562	I561-N611 VanDerWaalsContact CD1-O 3.3Å; I561-N611 WeakPolarHBondContact CD1-O 3.4Å; I561-N611 HydrophobicContact CG1-CB 4.47Å; I561-N611 WeakPolarHBondContact CG1-OD1 2.93Å; I561-N611 PolarHBondContact O-OD1 3.4Å; E562-N611 HydrophobicContact CB-CB 3.71Å; E562-N611 WeakPolarHBondContact CB-OD1 3.47Å; E562-N611 HydrophobicContact CG-CB 3.58Å; E562-N611 VanDerWaalsContact CG-OD1 3.29Å; E562-N611 WeakPolarHBondContact CG-OD1 3.32Å; E562-N611 WeakPolarHBondContact OE1-CB 3.28Å
612	H	19.6	Very low	19.9	Very low	151 Å²	151	122.8 Å²	122.8	70%	0.699	64%	0.64	S	S	*	*			trans	-158.4	171.9	-169.5	-117.5	-100	0	0	0	113.3
613	Q	19.8	Very low	19.9	Very low	165 Å²	165	117.6 Å²	117.6	77%	0.771	62%	0.621	S	S	*	*			trans	74	103.7	152.3	-73.9	168.6	-8.9	0	0	122.6
614	Q	20.9	Very low	20.1	Very low	174 Å²	174	116.6 Å²	116.6	81%	0.813	63%	0.63	S	S	*	*			trans	54.4	154.9	130.8	-75	-179.6	-13.5	0	0	122.2
615	P	20.8	Very low	20.3	Very low	127 Å²	127	117 Å²	117	83%	0.825	64%	0.636	S	S	*	*			cis	-100	-171.8	6.5	40.5	-35.7	0	0	0	114.4
616	I	17.4	Very low	20.6	Very low	136 Å²	136	119.4 Å²	119.4	70%	0.697	65%	0.645	S	S	*	*			trans	-121.5	136.8	-176.9	-62.3	167	0	0	0	108.9	F618	I616-F618 HydrophobicContact CG2-CD2 4.38Å
617	D	20.1	Very low	20.8	Very low	164 Å²	164	124.9 Å²	124.9	88%	0.877	67%	0.671	S	S	*	*			trans	-145.7	134.5	160.5	-119.8	-34.4	0	0	0	109.6
618	F	18.5	Very low	20.8	Very low	188 Å²	188	125.4 Å²	125.4	83%	0.825	67%	0.667	S	S	*	*			trans	-101.9	114.7	-177	-110	-90.6	0	0	0	110.3	I616	I616-F618 HydrophobicContact CG2-CD2 4.38Å
619	S	22.5	Very low	22	Very low	117 Å²	117	126.3 Å²	126.3	82%	0.818	67%	0.668	S	S	*	*			trans	-135.4	122.2	163	52.4	0	0	0	0	110.2
620	V	20	Very low	23.4	Very low	111 Å²	111	126 Å²	126	67%	0.673	67%	0.67	S	S	*	*			trans	-85.8	125.7	-172.4	171.3	0	0	0	0	110.3	L622	V620-L622 HydrophobicContact CG1-CD1 4.08Å; V620-L622 HydrophobicContact CG1-CG 4.1Å; V620-L622 PolarHBondContact O-N 3.09Å; V620-L622 VanDerWaalsContact O-N 3.17Å
621	Q	19.1	Very low	25	Very low	196 Å²	196	127.4 Å²	127.4	92%	0.916	67%	0.674	S	S	*	*			trans	-62.3	111.5	165.2	-67.8	176.3	-31.1	0	0	109.7
622	L	18.1	Very low	26.8	Very low	93 Å²	93	128.8 Å²	128.8	49%	0.487	68%	0.679	S	S	.	*			trans	-141.8	119	170.2	-101.7	170.2	0	0	0	112.3	V620	V620-L622 HydrophobicContact CG1-CD1 4.08Å; V620-L622 HydrophobicContact CG1-CG 4.1Å; V620-L622 PolarHBondContact O-N 3.09Å; V620-L622 VanDerWaalsContact O-N 3.17Å
623	N	19.7	Very low	28.5	Very low	60 Å²	60	123.6 Å²	123.6	32%	0.321	65%	0.654	S	S	.	*			trans	67.2	86.7	160.6	-60	-30.4	0	0	0	117.2	S625 S991 R992	N623-S625 PolarHBondContact O-N 3.06Å; N623-S991 WeakPolarHBondContact OD1-CB 3.24Å; N623-S991 PolarHBondContact OD1-OG 2.89Å; N623-R992 HydrophobicContact CB-CB 4.32Å; N623-R992 WeakPolarHBondContact ND2-CB 3.48Å
624	T	22.6	Very low	30.6	Very low	123 Å²	123	117.8 Å²	117.8	76%	0.755	63%	0.627	S	S	*	*			trans	-31.2	114.8	137.1	48.5	0	0	0	0	113
625	S	24.3	Very low	32.8	Very low	92 Å²	92	112.6 Å²	112.6	64%	0.643	61%	0.609	S	S	*	*			trans	-68.3	135.7	160.9	-60.3	0	0	0	0	109.6	N623 E627	N623-S625 PolarHBondContact O-N 3.06Å; S625-E627 PolarHBondContact O-N 3.45Å
626	L	24.3	Very low	35.2	Very low	123 Å²	123	109.3 Å²	109.3	64%	0.644	58%	0.584	S	S	*	*			trans	-79.8	99.9	165.5	-92.3	82.9	0	0	0	109.2	M628	L626-M628 PolarHBondContact O-N 3.37Å
627	E	25.5	Very low	37.8	Very low	181 Å²	181	103.6 Å²	103.6	85%	0.846	56%	0.555	S	S	*	*			trans	-73.5	112.6	162.9	-62.3	-172.1	146.2	0	0	108.7	S625 N629	S625-E627 PolarHBondContact O-N 3.45Å; E627-N629 PolarHBondContact O-N 3.29Å
628	M	30.4	Very low	40.7	Very low	105 Å²	105	100.8 Å²	100.8	52%	0.517	54%	0.535	S	S	.	.			trans	-66.6	118.9	167.2	-73.4	-156.9	79.4	0	0	108.8	L626 E632	L626-M628 PolarHBondContact O-N 3.37Å; M628-E632 VanDerWaalsContact CE-CD 3.43Å; M628-E632 VanDerWaalsContact CE-OE1 3.28Å; M628-E632 WeakPolarHBondContact CE-OE1 3.26Å; M628-E632 VanDerWaalsContact CE-OE2 3.3Å; M628-E632 WeakPolarHBondContact CE-OE2 3.26Å
629	N	44.3	Very low	43.7	Very low	106 Å²	106	95.7 Å²	95.7	57%	0.567	52%	0.516	S	S	*	.			trans	-66.8	138.3	-172.3	-158.8	-2.3	0	0	0	110.7	E627 D631 E632	E627-N629 PolarHBondContact O-N 3.29Å; N629-D631 PolarHBondContact O-N 3.26Å; N629-E632 PolarHBondContact O-N 2.98Å
630	T	46.1	Very low	46.6	Very low	82 Å²	82	94.3 Å²	94.3	50%	0.503	50%	0.499	S	S	.	.	H	α-helix	trans	-57.5	-31.2	-170.9	46.5	0	0	0	0	113.3	E632 M634	T630-E632 VanDerWaalsContact C-N 3.26Å; T630-E632 PolarHBondContact O-N 3.48Å; T630-M634 WeakPolarHBondContact O-CB 3.45Å; T630-M634 WeakPolarHBondContact O-CG 3.28Å; T630-M634 PolarHBondContact O-N 2.77Å
631	D	53.2	Low	49.8	Very low	114 Å²	114	89.2 Å²	89.2	61%	0.61	47%	0.468	S	S	*	.	H	α-helix	trans	-64.3	-27.4	179.3	-65.3	-19.1	0	0	0	113	N629 C635	N629-D631 PolarHBondContact O-N 3.26Å; D631-C635 WeakPolarHBondContact O-CB 3.44Å; D631-C635 PolarHBondContact O-N 3.25Å
632	E	56.1	Low	53	Low	97 Å²	97	81.8 Å²	81.8	45%	0.453	43%	0.434	S	S	.	.	H	α-helix	trans	-77.9	-46.3	-179.3	-161.7	-167.1	145	0	0	111.7	M628 N629 T630 M634 C635 N636	M628-E632 VanDerWaalsContact CE-CD 3.43Å; M628-E632 VanDerWaalsContact CE-OE1 3.28Å; M628-E632 WeakPolarHBondContact CE-OE1 3.26Å; M628-E632 VanDerWaalsContact CE-OE2 3.3Å; M628-E632 WeakPolarHBondContact CE-OE2 3.26Å; N629-E632 PolarHBondContact O-N 2.98Å; T630-E632 VanDerWaalsContact C-N 3.26Å; T630-E632 PolarHBondContact O-N 3.48Å; E632-M634 PolarHBondContact O-N 2.95Å; E632-C635 WeakPolarHBondContact O-CB 3.29Å; E632-C635 PolarHBondContact O-N 3.3Å; E632-C635 VanDerWaalsContact O-N 3.16Å; E632-N636 PolarHBondContact O-N 3.41Å; E632-N636 PolarHBondContact O-ND2 3.49Å; E632-N636 VanDerWaalsContact O-ND2 3.09Å
633	Y	54.6	Low	56.4	Low	42 Å²	42	83.6 Å²	83.6	17%	0.165	44%	0.438	C	S	.	.	H	α-helix	trans	-55.6	-42.7	169	173.7	-95.5	0	0	0	110.7	N636 M637 L978 H980	Y633-N636 PolarHBondContact O-N 3.45Å; Y633-M637 HydrophobicContact CD1-CG 4.38Å; Y633-M637 HydrophobicContact CE1-CG 3.91Å; Y633-M637 HydrophobicContact CE2-CG 4.17Å; Y633-M637 PolarHBondContact O-N 3Å; Y633-L978 HydrophobicContact CE2-CB 3.96Å; Y633-L978 PolarHBondContact OH-N 3.49Å; Y633-L978 VanDerWaalsContact OH-N 3.15Å; Y633-H980 AromaticContact CD2-CD2 3.88Å; Y633-H980 AromaticContact CD2-NE2 3.56Å
634	M	63.5	Low	59.7	Low	42 Å²	42	81.9 Å²	81.9	21%	0.207	43%	0.428	C	S	.	.	H	α-helix	trans	-62.4	-42.5	175.9	-84	-51	-42.2	0	0	113.3	T630 E632 K638 N971	T630-M634 WeakPolarHBondContact O-CB 3.45Å; T630-M634 WeakPolarHBondContact O-CG 3.28Å; T630-M634 PolarHBondContact O-N 2.77Å; E632-M634 PolarHBondContact O-N 2.95Å; M634-K638 VanDerWaalsContact O-CB 3.27Å; M634-K638 WeakPolarHBondContact O-CB 3.31Å; M634-K638 PolarHBondContact O-N 3.5Å; M634-N971 VanDerWaalsContact CE-CG 3.5Å; M634-N971 WeakPolarHBondContact CE-ND2 3.37Å; M634-N971 HydrophobicContact SD-CB 4.05Å; M634-N971 PolarHBondContact SD-OD1 3.01Å
635	C	68.9	Low	63	Low	65 Å²	65	76.1 Å²	76.1	44%	0.439	39%	0.393	S	S	.	.	H	α-helix	trans	-60.1	-48.3	173.3	-168	0	0	0	0	110.7	D631 E632 K638 N639	D631-C635 WeakPolarHBondContact O-CB 3.44Å; D631-C635 PolarHBondContact O-N 3.25Å; E632-C635 WeakPolarHBondContact O-CB 3.29Å; E632-C635 PolarHBondContact O-N 3.3Å; E632-C635 VanDerWaalsContact O-N 3.16Å; C635-K638 PolarHBondContact O-N 2.9Å; C635-N639 WeakPolarHBondContact O-CB 3.25Å; C635-N639 PolarHBondContact O-N 3.13Å; C635-N639 PolarHBondContact O-ND2 3.42Å; C635-N639 VanDerWaalsContact O-ND2 3.13Å
636	N	71	Confident	66.2	Low	58 Å²	58	77.1 Å²	77.1	31%	0.31	38%	0.383	S	S	.	.	H	α-helix	trans	-62.8	-46.9	-179.3	-74.4	-43.9	0	0	0	113.1	E632 Y633 K638 N639 I640	E632-N636 PolarHBondContact O-N 3.41Å; E632-N636 PolarHBondContact O-ND2 3.49Å; E632-N636 VanDerWaalsContact O-ND2 3.09Å; Y633-N636 PolarHBondContact O-N 3.45Å; N636-K638 PolarHBondContact O-N 3.47Å; N636-N639 PolarHBondContact O-N 3.34Å; N636-I640 WeakPolarHBondContact O-CG1 3.47Å; N636-I640 PolarHBondContact O-N 3.13Å
637	M	70.8	Confident	69.4	Low	17 Å²	17	78.3 Å²	78.3	8%	0.084	38%	0.379	C	S	.	.	H	α-helix	trans	-60.9	-44	174.6	-82.1	-65.3	-72.8	0	0	111.9	Y633 N639 I640 F641 L967 L978	Y633-M637 HydrophobicContact CD1-CG 4.38Å; Y633-M637 HydrophobicContact CE1-CG 3.91Å; Y633-M637 HydrophobicContact CE2-CG 4.17Å; Y633-M637 PolarHBondContact O-N 3Å; M637-N639 PolarHBondContact O-N 3.31Å; M637-I640 PolarHBondContact O-N 2.91Å; M637-I640 HydrophobicContact SD-CD1 4.43Å; M637-F641 HydrophobicContact CE-CE2 4.14Å; M637-F641 WeakPolarHBondContact O-CD2 3.39Å; M637-F641 PolarHBondContact O-N 3.28Å; M637-L967 HydrophobicContact CB-CD2 4.19Å; M637-L978 HydrophobicContact SD-CD2 3.96Å
638	K	81.3	Confident	72.5	Confident	104 Å²	104	69.7 Å²	69.7	45%	0.452	34%	0.339	S	S	.	.	H	α-helix	trans	-61.2	-43.6	175.5	-173.6	-169.1	170.3	-158.5	0	111.6	M634 C635 N636 I640 F641 D642	M634-K638 VanDerWaalsContact O-CB 3.27Å; M634-K638 WeakPolarHBondContact O-CB 3.31Å; M634-K638 PolarHBondContact O-N 3.5Å; C635-K638 PolarHBondContact O-N 2.9Å; N636-K638 PolarHBondContact O-N 3.47Å; K638-I640 VanDerWaalsContact C-N 3.28Å; K638-I640 PolarHBondContact O-N 3.25Å; K638-F641 PolarHBondContact O-N 2.85Å; K638-F641 VanDerWaalsContact O-N 3.13Å; K638-D642 VanDerWaalsContact CE-OD2 3.29Å; K638-D642 WeakPolarHBondContact CE-OD2 3.44Å; K638-D642 PolarHBondContact O-N 3.16Å
639	N	82.1	Confident	75.5	Confident	81 Å²	81	64.7 Å²	64.7	43%	0.433	32%	0.315	S	S	.	.	H	α-helix	trans	-60.4	-35.5	177.9	-69.2	-25.6	0	0	0	112.3	C635 N636 M637 K643	C635-N639 WeakPolarHBondContact O-CB 3.25Å; C635-N639 PolarHBondContact O-N 3.13Å; C635-N639 PolarHBondContact O-ND2 3.42Å; C635-N639 VanDerWaalsContact O-ND2 3.13Å; N636-N639 PolarHBondContact O-N 3.34Å; M637-N639 PolarHBondContact O-N 3.31Å; N639-K643 WeakPolarHBondContact O-CB 3.3Å; N639-K643 PolarHBondContact O-N 3.09Å
640	I	82.4	Confident	77.7	Confident	88 Å²	88	61.4 Å²	61.4	45%	0.451	30%	0.297	S	S	.	.	H	α-helix	trans	-64.1	-47.9	173.2	-67.5	164.9	0	0	0	110.8	N636 M637 K638 K643 H644 P1065	N636-I640 WeakPolarHBondContact O-CG1 3.47Å; N636-I640 PolarHBondContact O-N 3.13Å; M637-I640 PolarHBondContact O-N 2.91Å; M637-I640 HydrophobicContact SD-CD1 4.43Å; K638-I640 VanDerWaalsContact C-N 3.28Å; K638-I640 PolarHBondContact O-N 3.25Å; I640-K643 PolarHBondContact O-N 3.35Å; I640-H644 PolarHBondContact O-N 2.96Å; I640-P1065 HydrophobicContact CG2-CB 4.27Å; I640-P1065 HydrophobicContact CG2-CG 4.43Å
641	F	86.8	Confident	79.7	Confident	4 Å²	4	58 Å²	58	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-63.8	-46.6	177.4	-87	-99.2	0	0	0	112.4	M637 K638 K643 H644 I645 A963 E966 L967 P1065	M637-F641 HydrophobicContact CE-CE2 4.14Å; M637-F641 WeakPolarHBondContact O-CD2 3.39Å; M637-F641 PolarHBondContact O-N 3.28Å; K638-F641 PolarHBondContact O-N 2.85Å; K638-F641 VanDerWaalsContact O-N 3.13Å; F641-K643 VanDerWaalsContact C-N 3.32Å; F641-K643 PolarHBondContact O-N 3.34Å; F641-H644 PolarHBondContact O-N 3.06Å; F641-I645 VanDerWaalsContact O-CG1 3.25Å; F641-I645 WeakPolarHBondContact O-CG1 3.48Å; F641-I645 PolarHBondContact O-N 3.22Å; F641-A963 HydrophobicContact CD1-CB 3.61Å; F641-A963 HydrophobicContact CE1-CB 4.24Å; F641-A963 HydrophobicContact CG-CB 4.48Å; F641-E966 HydrophobicContact CE1-CB 4.3Å; F641-E966 HydrophobicContact CE1-CG 4.16Å; F641-E966 HydrophobicContact CZ-CB 4.46Å; F641-E966 HydrophobicContact CZ-CG 3.98Å; F641-E966 WeakPolarHBondContact CZ-OE1 3.28Å; F641-L967 HydrophobicContact CB-CD1 4.33Å; F641-L967 HydrophobicContact CD2-CD1 4.36Å; F641-L967 HydrophobicContact CD2-CD2 3.66Å; F641-L967 HydrophobicContact CD2-CG 4Å; F641-L967 HydrophobicContact CE2-CD2 3.73Å; F641-L967 HydrophobicContact CE2-CG 4.1Å; F641-L967 HydrophobicContact CG-CD1 4.22Å; F641-L967 HydrophobicContact CG-CD2 4.33Å; F641-L967 HydrophobicContact CG-CG 4.21Å; F641-L967 HydrophobicContact CZ-CD2 4.45Å; F641-L967 HydrophobicContact CZ-CG 4.4Å; F641-P1065 HydrophobicContact CD1-CG 3.83Å; F641-P1065 HydrophobicContact CD2-CG 3.83Å; F641-P1065 HydrophobicContact CE1-CG 3.72Å; F641-P1065 HydrophobicContact CE2-CG 3.7Å; F641-P1065 HydrophobicContact CG-CG 3.91Å; F641-P1065 HydrophobicContact CZ-CG 3.65Å
642	D	87.6	Confident	81.4	Confident	41 Å²	41	52.5 Å²	52.5	22%	0.219	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-38.6	178.3	-84.6	-40.6	0	0	0	111.7	K638 I645 Y646 W671	K638-D642 VanDerWaalsContact CE-OD2 3.29Å; K638-D642 WeakPolarHBondContact CE-OD2 3.44Å; K638-D642 PolarHBondContact O-N 3.16Å; D642-I645 PolarHBondContact O-N 2.87Å; D642-Y646 VanDerWaalsContact O-CB 3.32Å; D642-Y646 WeakPolarHBondContact O-CB 3.26Å; D642-Y646 PolarHBondContact O-N 3.5Å; D642-W671 PolarHBondContact OD1-NE1 3.21Å
643	K	88.2	Confident	83	Confident	130 Å²	130	48 Å²	48	57%	0.565	23%	0.225	S	C	*	.	H	α-helix	trans	-65.9	-36.2	174	-173	174.6	-176.5	175.6	0	112.7	N639 I640 F641 R647	N639-K643 WeakPolarHBondContact O-CB 3.3Å; N639-K643 PolarHBondContact O-N 3.09Å; I640-K643 PolarHBondContact O-N 3.35Å; F641-K643 VanDerWaalsContact C-N 3.32Å; F641-K643 PolarHBondContact O-N 3.34Å; K643-R647 WeakPolarHBondContact O-CG 3.32Å; K643-R647 PolarHBondContact O-N 2.98Å
644	H	89.6	Confident	84.4	Confident	24 Å²	24	53.4 Å²	53.4	11%	0.111	25%	0.245	C	C	.	.	H	α-helix	trans	-69.2	-48.1	174.7	-170.3	67.7	0	0	0	111.7	I640 F641 Y646 R647 L648 S1062 P1065	I640-H644 PolarHBondContact O-N 2.96Å; F641-H644 PolarHBondContact O-N 3.06Å; H644-Y646 VanDerWaalsContact C-N 3.33Å; H644-Y646 PolarHBondContact O-N 2.79Å; H644-R647 PolarHBondContact O-N 3.23Å; H644-L648 PolarHBondContact O-N 3.49Å; H644-S1062 PolarHBondContact CE1-OG 3.24Å; H644-S1062 PolarHBondContact NE2-O 2.88Å; H644-S1062 PolarHBondContact NE2-OG 3.09Å; H644-P1065 HydrophobicContact CB-CB 4.17Å
645	I	91.8	Very high	85.3	Confident	2 Å²	2	54.8 Å²	54.8	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-58.2	-45.5	175.8	-66	164.3	0	0	0	110.5	F641 D642 R647 L648 V649 I667 W671 L959 A963	F641-I645 VanDerWaalsContact O-CG1 3.25Å; F641-I645 WeakPolarHBondContact O-CG1 3.48Å; F641-I645 PolarHBondContact O-N 3.22Å; D642-I645 PolarHBondContact O-N 2.87Å; I645-R647 VanDerWaalsContact C-N 3.34Å; I645-R647 PolarHBondContact O-N 3.36Å; I645-L648 PolarHBondContact O-N 3.24Å; I645-V649 HydrophobicContact CG2-CG2 4.08Å; I645-V649 WeakPolarHBondContact O-CB 3.44Å; I645-V649 VanDerWaalsContact O-CG2 3.26Å; I645-V649 WeakPolarHBondContact O-CG2 3.4Å; I645-V649 PolarHBondContact O-N 2.88Å; I645-I667 HydrophobicContact CG2-CD1 4.39Å; I645-I667 HydrophobicContact CG2-CG1 4.24Å; I645-W671 HydrophobicContact CD1-CZ2 4.25Å; I645-L959 HydrophobicContact CG1-CB 4.37Å; I645-L959 HydrophobicContact CG2-CB 4.39Å; I645-L959 HydrophobicContact CG2-CD1 4.35Å; I645-A963 HydrophobicContact CD1-CB 3.76Å
646	Y	92.9	Very high	85.9	Confident	114 Å²	114	52.8 Å²	52.8	45%	0.447	24%	0.238	S	C	.	.	H	α-helix	trans	-58	-44.1	178.6	-177.3	-111.3	0	0	0	112.5	D642 H644 V649 L650 I667	D642-Y646 VanDerWaalsContact O-CB 3.32Å; D642-Y646 WeakPolarHBondContact O-CB 3.26Å; D642-Y646 PolarHBondContact O-N 3.5Å; H644-Y646 VanDerWaalsContact C-N 3.33Å; H644-Y646 PolarHBondContact O-N 2.79Å; Y646-V649 PolarHBondContact O-N 3.25Å; Y646-L650 HydrophobicContact CD1-CD1 3.89Å; Y646-L650 HydrophobicContact CE1-CD1 3.38Å; Y646-L650 HydrophobicContact CE1-CG 4.26Å; Y646-L650 HydrophobicContact CE2-CD1 4.22Å; Y646-L650 HydrophobicContact CE2-CG 4.27Å; Y646-L650 WeakPolarHBondContact O-CB 3.4Å; Y646-L650 WeakPolarHBondContact O-CG 3.4Å; Y646-L650 PolarHBondContact O-N 3.34Å; Y646-I667 HydrophobicContact CD2-CD1 3.8Å
647	R	90.3	Very high	86.6	Confident	147 Å²	147	54.9 Å²	54.9	56%	0.555	25%	0.252	S	S	*	.	H	α-helix	trans	-65.9	-42.5	176.7	-71.6	173.9	165.8	-167.7	-6.8	112.6	K643 H644 I645 L650 Q651 L1060	K643-R647 WeakPolarHBondContact O-CG 3.32Å; K643-R647 PolarHBondContact O-N 2.98Å; H644-R647 PolarHBondContact O-N 3.23Å; I645-R647 VanDerWaalsContact C-N 3.34Å; I645-R647 PolarHBondContact O-N 3.36Å; R647-L650 PolarHBondContact O-N 3.13Å; R647-Q651 PolarHBondContact O-N 2.99Å; R647-L1060 HydrophobicContact CB-CD1 3.38Å; R647-L1060 HydrophobicContact CG-CD1 4.44Å
648	L	90.5	Very high	87.4	Confident	1 Å²	1	55 Å²	55	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-60.8	-45.7	174.9	-78.9	166.1	0	0	0	112.4	H644 I645 Q651 D652 L959 L1060 S1062	H644-L648 PolarHBondContact O-N 3.49Å; I645-L648 PolarHBondContact O-N 3.24Å; L648-Q651 WeakPolarHBondContact O-CB 3.5Å; L648-Q651 PolarHBondContact O-N 3.39Å; L648-D652 PolarHBondContact O-N 3.01Å; L648-L959 HydrophobicContact CB-CD1 3.86Å; L648-L959 HydrophobicContact CD1-CD1 3.98Å; L648-L959 HydrophobicContact CD1-CD2 4.12Å; L648-L1060 HydrophobicContact CD2-CB 3.59Å; L648-L1060 HydrophobicContact CG-CB 4.16Å; L648-L1060 HydrophobicContact CG-CD1 4.26Å; L648-S1062 WeakPolarHBondContact CD1-O 3.32Å
649	V	92.6	Very high	87.6	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-70	-38.1	-179	176.3	0	0	0	0	110.7	I645 Y646 Q651 D652 V653 A663 L666 I667 T956 L959	I645-V649 HydrophobicContact CG2-CG2 4.08Å; I645-V649 WeakPolarHBondContact O-CB 3.44Å; I645-V649 VanDerWaalsContact O-CG2 3.26Å; I645-V649 WeakPolarHBondContact O-CG2 3.4Å; I645-V649 PolarHBondContact O-N 2.88Å; Y646-V649 PolarHBondContact O-N 3.25Å; V649-Q651 VanDerWaalsContact C-N 3.32Å; V649-Q651 PolarHBondContact O-N 3.21Å; V649-D652 PolarHBondContact O-N 3.4Å; V649-V653 HydrophobicContact CG1-CG2 4.33Å; V649-V653 VanDerWaalsContact O-CB 3.32Å; V649-V653 WeakPolarHBondContact O-CB 3.26Å; V649-V653 VanDerWaalsContact O-CG2 3.26Å; V649-V653 WeakPolarHBondContact O-CG2 3.4Å; V649-V653 PolarHBondContact O-N 3.29Å; V649-A663 HydrophobicContact CG1-CB 3.95Å; V649-L666 HydrophobicContact CG1-CB 4.5Å; V649-L666 HydrophobicContact CG1-CD1 4.43Å; V649-I667 HydrophobicContact CB-CD1 4.05Å; V649-I667 HydrophobicContact CB-CG1 4.27Å; V649-I667 HydrophobicContact CG1-CD1 4.25Å; V649-I667 HydrophobicContact CG1-CG1 4.21Å; V649-I667 HydrophobicContact CG2-CD1 4.15Å; V649-I667 HydrophobicContact CG2-CG1 3.97Å; V649-T956 HydrophobicContact CG2-CG2 3.8Å; V649-L959 HydrophobicContact CG2-CD1 3.91Å
650	L	91.6	Very high	87.9	Confident	37 Å²	37	54.1 Å²	54.1	19%	0.194	26%	0.26	C	S	.	.	H	α-helix	trans	-61.4	-39	170.5	-81	177.3	0	0	0	112.5	Y646 R647 R654 A663	Y646-L650 HydrophobicContact CD1-CD1 3.89Å; Y646-L650 HydrophobicContact CE1-CD1 3.38Å; Y646-L650 HydrophobicContact CE1-CG 4.26Å; Y646-L650 HydrophobicContact CE2-CD1 4.22Å; Y646-L650 HydrophobicContact CE2-CG 4.27Å; Y646-L650 WeakPolarHBondContact O-CB 3.4Å; Y646-L650 WeakPolarHBondContact O-CG 3.4Å; Y646-L650 PolarHBondContact O-N 3.34Å; R647-L650 PolarHBondContact O-N 3.13Å; L650-R654 WeakPolarHBondContact O-CG 3.32Å; L650-R654 PolarHBondContact O-N 3.37Å; L650-R654 VanDerWaalsContact O-N 3.13Å; L650-R654 PolarHBondContact O-NH1 3.49Å; L650-A663 HydrophobicContact CD2-CB 3.71Å; L650-A663 HydrophobicContact CG-CB 4.16Å
651	Q	88	Confident	88.2	Confident	9 Å²	9	51.7 Å²	51.7	4%	0.042	25%	0.251	C	S	.	.	H	α-helix	trans	-63.5	-47.9	174	-168.3	-171.6	-62.5	0	0	110.7	R647 L648 V649 V653 R654 D655	R647-Q651 PolarHBondContact O-N 2.99Å; L648-Q651 WeakPolarHBondContact O-CB 3.5Å; L648-Q651 PolarHBondContact O-N 3.39Å; V649-Q651 VanDerWaalsContact C-N 3.32Å; V649-Q651 PolarHBondContact O-N 3.21Å; Q651-V653 VanDerWaalsContact C-N 3.32Å; Q651-V653 PolarHBondContact O-N 3.37Å; Q651-R654 PolarHBondContact O-N 2.93Å; Q651-R654 VanDerWaalsContact O-N 3.16Å; Q651-D655 PolarHBondContact NE2-OD2 2.83Å; Q651-D655 WeakPolarHBondContact O-CB 3.29Å; Q651-D655 PolarHBondContact O-N 2.78Å
652	D	88.3	Confident	88.4	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-65.9	-32	-179.7	-169.3	50.2	0	0	0	113.7	L648 V649 N656 C952 F955 R1295	L648-D652 PolarHBondContact O-N 3.01Å; V649-D652 PolarHBondContact O-N 3.4Å; D652-N656 WeakPolarHBondContact O-CB 3.15Å; D652-N656 PolarHBondContact O-N 2.9Å; D652-N656 VanDerWaalsContact O-N 3.11Å; D652-N656 PolarHBondContact O-ND2 3.31Å; D652-N656 PolarHBondContact OD1-ND2 2.94Å; D652-N656 VanDerWaalsContact OD1-ND2 3.12Å; D652-C952 VanDerWaalsContact OD2-CA 3.31Å; D652-C952 WeakPolarHBondContact OD2-CA 3.26Å; D652-C952 WeakPolarHBondContact OD2-CB 3.29Å; D652-C952 PolarHBondContact OD2-SG 3.18Å; D652-F955 HydrophobicContact CB-CD1 4.06Å; D652-F955 HydrophobicContact CB-CE1 4.15Å; D652-R1295 IonicContact OD1-CZ 3.12Å; D652-R1295 IonicContact OD1-NH1 2.7Å; D652-R1295 PolarHBondContact OD1-NH1 3.21Å; D652-R1295 IonicContact OD1-NH2 2.74Å; D652-R1295 PolarHBondContact OD1-NH2 3.23Å; D652-R1295 IonicContact OD2-CZ 2.67Å; D652-R1295 IonicContact OD2-NH2 3.07Å; D652-R1295 PolarHBondContact OD2-NH2 2.99Å
653	V	90.4	Very high	88.6	Confident	2 Å²	2	49.8 Å²	49.8	1%	0.012	24%	0.24	C	C	.	.	H	α-helix	trans	-66.2	-41.9	172.6	160.4	0	0	0	0	110.9	V649 Q651 N656 V657 L658 D659 W662 A663 L666	V649-V653 HydrophobicContact CG1-CG2 4.33Å; V649-V653 VanDerWaalsContact O-CB 3.32Å; V649-V653 WeakPolarHBondContact O-CB 3.26Å; V649-V653 VanDerWaalsContact O-CG2 3.26Å; V649-V653 WeakPolarHBondContact O-CG2 3.4Å; V649-V653 PolarHBondContact O-N 3.29Å; Q651-V653 VanDerWaalsContact C-N 3.32Å; Q651-V653 PolarHBondContact O-N 3.37Å; V653-N656 PolarHBondContact O-N 2.83Å; V653-V657 PolarHBondContact O-N 3.48Å; V653-L658 HydrophobicContact CG1-CB 3.89Å; V653-L658 VanDerWaalsContact CG1-O 3.31Å; V653-L658 WeakPolarHBondContact CG1-O 3.39Å; V653-L658 PolarHBondContact O-N 3.17Å; V653-D659 WeakPolarHBondContact CG1-O 3.27Å; V653-W662 HydrophobicContact CG2-CB 4.44Å; V653-A663 HydrophobicContact CG2-CB 4.3Å; V653-L666 HydrophobicContact CG2-CD1 4.13Å
654	R	84.3	Confident	88.7	Confident	156 Å²	156	47 Å²	47	59%	0.589	24%	0.237	S	C	*	.	H	α-helix	trans	-66.7	-49.6	172.3	-68.3	-171.7	-51.7	-90	4.4	112.2	L650 Q651 N656 V657	L650-R654 WeakPolarHBondContact O-CG 3.32Å; L650-R654 PolarHBondContact O-N 3.37Å; L650-R654 VanDerWaalsContact O-N 3.13Å; L650-R654 PolarHBondContact O-NH1 3.49Å; Q651-R654 PolarHBondContact O-N 2.93Å; Q651-R654 VanDerWaalsContact O-N 3.16Å; R654-N656 PolarHBondContact O-N 3.35Å; R654-V657 PolarHBondContact O-N 3.44Å
655	D	80.8	Confident	88.9	Confident	71 Å²	71	46.3 Å²	46.3	38%	0.38	23%	0.234	S	C	.	.	H	α-helix	trans	-61.2	-12.9	178.5	-70	-28.6	0	0	0	112.4	Q651 R1059	Q651-D655 PolarHBondContact NE2-OD2 2.83Å; Q651-D655 WeakPolarHBondContact O-CB 3.29Å; Q651-D655 PolarHBondContact O-N 2.78Å; D655-R1059 IonicContact OD1-NH1 3.78Å; D655-R1059 PolarHBondContact OD1-NH1 2.86Å; D655-R1059 IonicContact OD2-NH1 3.02Å
656	N	83.1	Confident	89	Confident	23 Å²	23	46.2 Å²	46.2	12%	0.123	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.5	10.4	173	-75.1	-99.5	0	0	0	114	D652 V653 R654 L658 R948	D652-N656 WeakPolarHBondContact O-CB 3.15Å; D652-N656 PolarHBondContact O-N 2.9Å; D652-N656 VanDerWaalsContact O-N 3.11Å; D652-N656 PolarHBondContact O-ND2 3.31Å; D652-N656 PolarHBondContact OD1-ND2 2.94Å; D652-N656 VanDerWaalsContact OD1-ND2 3.12Å; V653-N656 PolarHBondContact O-N 2.83Å; R654-N656 PolarHBondContact O-N 3.35Å; N656-L658 VanDerWaalsContact C-N 3.35Å; N656-L658 HydrophobicContact CB-CD1 4.39Å; N656-L658 PolarHBondContact O-N 3.34Å; N656-R948 HydrophobicContact CB-CB 4.41Å; N656-R948 WeakPolarHBondContact O-CD 3.34Å
657	V	85.1	Confident	89	Confident	101 Å²	101	41.8 Å²	41.8	61%	0.612	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.2	54.7	-179.6	-162.3	0	0	0	0	111.9	V653 R654	V653-V657 PolarHBondContact O-N 3.48Å; R654-V657 PolarHBondContact O-N 3.44Å
658	L	87.7	Confident	89.1	Confident	19 Å²	19	41 Å²	41	10%	0.099	22%	0.215	C	C	.	.			trans	-111.3	151.7	172.1	-76.9	170.1	0	0	0	110	V653 N656 R948 A949 C952	V653-L658 HydrophobicContact CG1-CB 3.89Å; V653-L658 VanDerWaalsContact CG1-O 3.31Å; V653-L658 WeakPolarHBondContact CG1-O 3.39Å; V653-L658 PolarHBondContact O-N 3.17Å; N656-L658 VanDerWaalsContact C-N 3.35Å; N656-L658 HydrophobicContact CB-CD1 4.39Å; N656-L658 PolarHBondContact O-N 3.34Å; L658-R948 HydrophobicContact CD1-CB 3.97Å; L658-R948 HydrophobicContact CD2-CB 3.95Å; L658-R948 HydrophobicContact CG-CB 3.95Å; L658-A949 HydrophobicContact CD1-CB 4.25Å; L658-C952 HydrophobicContact CD1-CB 4.43Å
659	D	85.9	Confident	89.2	Confident	90 Å²	90	41.1 Å²	41.1	48%	0.481	22%	0.215	S	C	.	.			trans	-62.2	142.4	171	170.8	50.5	0	0	0	111.9	V653 S661 W662	V653-D659 WeakPolarHBondContact CG1-O 3.27Å; D659-S661 PolarHBondContact O-N 3.34Å; D659-S661 WeakPolarHBondContact OD2-CB 3.37Å; D659-S661 PolarHBondContact OD2-N 3.28Å; D659-S661 PolarHBondContact OD2-OG 3.49Å; D659-W662 WeakPolarHBondContact O-CB 3.43Å; D659-W662 PolarHBondContact O-N 3.46Å; D659-W662 VanDerWaalsContact O-N 3.1Å
660	S	88.2	Confident	89.2	Confident	77 Å²	77	41.1 Å²	41.1	54%	0.538	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.5	-33.6	177.1	64.1	0	0	0	0	114.9	W662 A663	S660-W662 PolarHBondContact O-N 3.16Å; S660-A663 WeakPolarHBondContact O-CB 3.28Å; S660-A663 PolarHBondContact O-N 2.83Å; S660-A663 VanDerWaalsContact O-N 3.08Å
661	S	87.9	Confident	89.2	Confident	38 Å²	38	41.3 Å²	41.3	27%	0.266	21%	0.213	S	C	.	.	H	α-helix	trans	-63.2	-24.9	-179.9	71.8	0	0	0	0	112.8	D659 A663 S664	D659-S661 PolarHBondContact O-N 3.34Å; D659-S661 WeakPolarHBondContact OD2-CB 3.37Å; D659-S661 PolarHBondContact OD2-N 3.28Å; D659-S661 PolarHBondContact OD2-OG 3.49Å; S661-A663 PolarHBondContact O-N 3.19Å; S661-S664 PolarHBondContact O-N 2.93Å; S661-S664 PolarHBondContact O-OG 3.2Å; S661-S664 VanDerWaalsContact O-OG 3.14Å
662	W	91.7	Very high	89.3	Confident	5 Å²	5	44 Å²	44	2%	0.019	23%	0.228	C	C	.	.	H	α-helix	trans	-58.9	-33.1	174.3	-84.6	107.2	0	0	0	112.5	V653 D659 S660 S664 I665 L666 N746 L938 R939 D940 A949	V653-W662 HydrophobicContact CG2-CB 4.44Å; D659-W662 WeakPolarHBondContact O-CB 3.43Å; D659-W662 PolarHBondContact O-N 3.46Å; D659-W662 VanDerWaalsContact O-N 3.1Å; S660-W662 PolarHBondContact O-N 3.16Å; W662-S664 PolarHBondContact O-N 2.98Å; W662-I665 HydrophobicContact CE3-CB 4.41Å; W662-I665 HydrophobicContact CE3-CG2 4.25Å; W662-I665 HydrophobicContact CZ3-CG2 4.2Å; W662-I665 PolarHBondContact O-N 2.96Å; W662-L666 HydrophobicContact CB-CD1 4.22Å; W662-L666 HydrophobicContact CE3-CD2 4.22Å; W662-L666 HydrophobicContact CE3-CG 4.21Å; W662-L666 WeakPolarHBondContact O-CB 3.3Å; W662-L666 WeakPolarHBondContact O-CG 3.49Å; W662-L666 PolarHBondContact O-N 3.07Å; W662-N746 HydrophobicContact CH2-CB 3.99Å; W662-N746 HydrophobicContact CZ2-CB 3.65Å; W662-L938 HydrophobicContact CZ3-CD2 4.37Å; W662-R939 WeakPolarHBondContact CH2-O 3.15Å; W662-D940 HydrophobicContact CZ2-CB 4.15Å; W662-D940 WeakPolarHBondContact CZ2-OD2 3.49Å; W662-A949 HydrophobicContact CD2-CB 4.01Å; W662-A949 HydrophobicContact CE3-CB 3.98Å; W662-A949 HydrophobicContact CH2-CB 3.95Å; W662-A949 HydrophobicContact CZ2-CB 3.97Å; W662-A949 HydrophobicContact CZ3-CB 3.96Å
663	A	92.1	Very high	89.4	Confident	0 Å²	0	44 Å²	44	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-58.8	-44.3	-175.4	0	0	0	0	0	112.8	V649 L650 V653 S660 S661 I667	V649-A663 HydrophobicContact CG1-CB 3.95Å; L650-A663 HydrophobicContact CD2-CB 3.71Å; L650-A663 HydrophobicContact CG-CB 4.16Å; V653-A663 HydrophobicContact CG2-CB 4.3Å; S660-A663 WeakPolarHBondContact O-CB 3.28Å; S660-A663 PolarHBondContact O-N 2.83Å; S660-A663 VanDerWaalsContact O-N 3.08Å; S661-A663 PolarHBondContact O-N 3.19Å; A663-I667 WeakPolarHBondContact O-CD1 3.37Å; A663-I667 VanDerWaalsContact O-CG1 3.28Å; A663-I667 WeakPolarHBondContact O-CG1 3.47Å; A663-I667 PolarHBondContact O-N 3.29Å; A663-I667 VanDerWaalsContact O-N 3.12Å
664	S	91	Very high	89.3	Confident	71 Å²	71	44.1 Å²	44.1	50%	0.497	23%	0.229	S	C	.	.	H	α-helix	trans	-70.4	-39.5	178.4	66.4	0	0	0	0	112.2	S661 W662 R668	S661-S664 PolarHBondContact O-N 2.93Å; S661-S664 PolarHBondContact O-OG 3.2Å; S661-S664 VanDerWaalsContact O-OG 3.14Å; W662-S664 PolarHBondContact O-N 2.98Å; S664-R668 VanDerWaalsContact O-CB 3.27Å; S664-R668 WeakPolarHBondContact O-CB 3.28Å; S664-R668 PolarHBondContact O-N 3.2Å
665	I	91.9	Very high	89.2	Confident	9 Å²	9	42.6 Å²	42.6	5%	0.046	23%	0.229	C	C	.	.	H	α-helix	trans	-61.2	-46.4	176	-61.8	171.4	0	0	0	110.4	W662 L669 K747	W662-I665 HydrophobicContact CE3-CB 4.41Å; W662-I665 HydrophobicContact CE3-CG2 4.25Å; W662-I665 HydrophobicContact CZ3-CG2 4.2Å; W662-I665 PolarHBondContact O-N 2.96Å; I665-L669 HydrophobicContact CG2-CD1 3.92Å; I665-L669 WeakPolarHBondContact O-CB 3.42Å; I665-L669 VanDerWaalsContact O-CG 3.31Å; I665-L669 WeakPolarHBondContact O-CG 3.35Å; I665-L669 PolarHBondContact O-N 3.41Å; I665-K747 HydrophobicContact CD1-CG 4.4Å
666	L	93.9	Very high	89.1	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-46.3	-178.9	-68.9	172	0	0	0	112	V649 V653 W662 L669 A670 C952 F953 T956	V649-L666 HydrophobicContact CG1-CB 4.5Å; V649-L666 HydrophobicContact CG1-CD1 4.43Å; V653-L666 HydrophobicContact CG2-CD1 4.13Å; W662-L666 HydrophobicContact CB-CD1 4.22Å; W662-L666 HydrophobicContact CE3-CD2 4.22Å; W662-L666 HydrophobicContact CE3-CG 4.21Å; W662-L666 WeakPolarHBondContact O-CB 3.3Å; W662-L666 WeakPolarHBondContact O-CG 3.49Å; W662-L666 PolarHBondContact O-N 3.07Å; L666-L669 PolarHBondContact O-N 2.83Å; L666-A670 VanDerWaalsContact O-CB 3.32Å; L666-A670 WeakPolarHBondContact O-CB 3.44Å; L666-A670 PolarHBondContact O-N 3.41Å; L666-C952 HydrophobicContact CD1-CB 3.64Å; L666-F953 HydrophobicContact CD2-CB 3.61Å; L666-F953 HydrophobicContact CD2-CD2 3.88Å; L666-F953 HydrophobicContact CD2-CG 4.23Å; L666-T956 HydrophobicContact CB-CG2 4.32Å
667	I	93.1	Very high	88.9	Confident	22 Å²	22	40.1 Å²	40.1	11%	0.113	22%	0.217	C	C	.	.	H	α-helix	trans	-64.6	-46	178.5	-68.3	164.2	0	0	0	111	I645 Y646 V649 A663 L669 A670 W671 T956	I645-I667 HydrophobicContact CG2-CD1 4.39Å; I645-I667 HydrophobicContact CG2-CG1 4.24Å; Y646-I667 HydrophobicContact CD2-CD1 3.8Å; V649-I667 HydrophobicContact CB-CD1 4.05Å; V649-I667 HydrophobicContact CB-CG1 4.27Å; V649-I667 HydrophobicContact CG1-CD1 4.25Å; V649-I667 HydrophobicContact CG1-CG1 4.21Å; V649-I667 HydrophobicContact CG2-CD1 4.15Å; V649-I667 HydrophobicContact CG2-CG1 3.97Å; A663-I667 WeakPolarHBondContact O-CD1 3.37Å; A663-I667 VanDerWaalsContact O-CG1 3.28Å; A663-I667 WeakPolarHBondContact O-CG1 3.47Å; A663-I667 PolarHBondContact O-N 3.29Å; A663-I667 VanDerWaalsContact O-N 3.12Å; I667-L669 VanDerWaalsContact C-N 3.35Å; I667-L669 PolarHBondContact O-N 3.16Å; I667-A670 PolarHBondContact O-N 3.31Å; I667-A670 VanDerWaalsContact O-N 3.17Å; I667-W671 PolarHBondContact O-N 2.95Å; I667-T956 HydrophobicContact CG1-CG2 3.9Å
668	R	92.3	Very high	88	Confident	130 Å²	130	40.8 Å²	40.8	49%	0.491	21%	0.213	S	C	.	.	H	α-helix	trans	-57.6	-46.6	176.5	-174.7	-177.7	71	177.5	3.6	111.6	S664 N672	S664-R668 VanDerWaalsContact O-CB 3.27Å; S664-R668 WeakPolarHBondContact O-CB 3.28Å; S664-R668 PolarHBondContact O-N 3.2Å; R668-N672 WeakPolarHBondContact O-CB 3.48Å; R668-N672 PolarHBondContact O-N 2.96Å; R668-N672 VanDerWaalsContact O-N 3.1Å; R668-N672 PolarHBondContact O-OD1 2.89Å
669	L	93.1	Very high	87	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.016	22%	0.216	C	C	.	.	H	α-helix	trans	-66.5	-36.5	177.2	-72.5	171.5	0	0	0	112.3	I665 L666 I667 V673 L751 V936 L938 F953	I665-L669 HydrophobicContact CG2-CD1 3.92Å; I665-L669 WeakPolarHBondContact O-CB 3.42Å; I665-L669 VanDerWaalsContact O-CG 3.31Å; I665-L669 WeakPolarHBondContact O-CG 3.35Å; I665-L669 PolarHBondContact O-N 3.41Å; L666-L669 PolarHBondContact O-N 2.83Å; I667-L669 VanDerWaalsContact C-N 3.35Å; I667-L669 PolarHBondContact O-N 3.16Å; L669-V673 WeakPolarHBondContact O-CB 3.39Å; L669-V673 VanDerWaalsContact O-CG2 3.25Å; L669-V673 WeakPolarHBondContact O-CG2 3.43Å; L669-V673 PolarHBondContact O-N 3.27Å; L669-L751 HydrophobicContact CD2-CB 4.45Å; L669-V936 HydrophobicContact CD1-CG1 4.36Å; L669-L938 HydrophobicContact CD1-CD2 4.07Å; L669-F953 HydrophobicContact CB-CD2 4.32Å; L669-F953 HydrophobicContact CB-CE2 3.59Å; L669-F953 HydrophobicContact CB-CZ 4.4Å
670	A	92.9	Very high	85.7	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-66.8	-49	178.6	0	0	0	0	0	112	L666 I667 N672 V673 C674 F953 T956 C960	L666-A670 VanDerWaalsContact O-CB 3.32Å; L666-A670 WeakPolarHBondContact O-CB 3.44Å; L666-A670 PolarHBondContact O-N 3.41Å; I667-A670 PolarHBondContact O-N 3.31Å; I667-A670 VanDerWaalsContact O-N 3.17Å; A670-N672 PolarHBondContact O-N 2.83Å; A670-V673 WeakPolarHBondContact O-CB 3.42Å; A670-V673 PolarHBondContact O-N 2.96Å; A670-C674 PolarHBondContact O-N 3.49Å; A670-C674 PolarHBondContact O-SG 2.79Å; A670-C674 VanDerWaalsContact O-SG 3.37Å; A670-F953 HydrophobicContact CB-CE2 4.28Å; A670-T956 HydrophobicContact CB-CG2 3.7Å; A670-C960 HydrophobicContact CB-CB 4.21Å
671	W	92.2	Very high	84.5	Confident	41 Å²	41	35.6 Å²	35.6	16%	0.155	18%	0.177	C	C	.	.	H	α-helix	trans	-61.1	-44.1	176	-85.7	131	0	0	0	112.4	D642 I645 I667 V673 C674 Q675 C960 Q964	D642-W671 PolarHBondContact OD1-NE1 3.21Å; I645-W671 HydrophobicContact CD1-CZ2 4.25Å; I667-W671 PolarHBondContact O-N 2.95Å; W671-V673 VanDerWaalsContact C-N 3.26Å; W671-V673 PolarHBondContact O-N 3.47Å; W671-C674 HydrophobicContact CE3-CB 4.38Å; W671-C674 PolarHBondContact O-N 3.14Å; W671-Q675 WeakPolarHBondContact O-CG 3.49Å; W671-Q675 PolarHBondContact O-N 3.43Å; W671-C960 HydrophobicContact CD2-CB 4.08Å; W671-C960 HydrophobicContact CE3-CB 4.22Å; W671-C960 HydrophobicContact CZ2-CB 4.46Å; W671-C960 HydrophobicContact CZ3-CB 4.45Å; W671-Q964 HydrophobicContact CZ3-CB 4.19Å
672	N	89.7	Confident	83.2	Confident	66 Å²	66	36 Å²	36	35%	0.353	17%	0.173	S	C	.	.	H	α-helix	trans	-60.8	-35.5	175.8	-70	1.7	0	0	0	112.1	R668 A670 T676 L751	R668-N672 WeakPolarHBondContact O-CB 3.48Å; R668-N672 PolarHBondContact O-N 2.96Å; R668-N672 VanDerWaalsContact O-N 3.1Å; R668-N672 PolarHBondContact O-OD1 2.89Å; A670-N672 PolarHBondContact O-N 2.83Å; N672-T676 VanDerWaalsContact O-CB 3.3Å; N672-T676 WeakPolarHBondContact O-CB 3.44Å; N672-T676 PolarHBondContact O-N 3.02Å; N672-T676 PolarHBondContact O-OG1 2.81Å; N672-L751 VanDerWaalsContact C-CD2 3.46Å; N672-L751 HydrophobicContact CB-CD2 3.71Å; N672-L751 WeakPolarHBondContact O-CD2 3.11Å
673	V	89.9	Confident	81.2	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.2	-46.4	174	165	0	0	0	0	111.5	L669 A670 W671 Q675 T676 V677 I732 V736 L751 V936 F953 L957	L669-V673 WeakPolarHBondContact O-CB 3.39Å; L669-V673 VanDerWaalsContact O-CG2 3.25Å; L669-V673 WeakPolarHBondContact O-CG2 3.43Å; L669-V673 PolarHBondContact O-N 3.27Å; A670-V673 WeakPolarHBondContact O-CB 3.42Å; A670-V673 PolarHBondContact O-N 2.96Å; W671-V673 VanDerWaalsContact C-N 3.26Å; W671-V673 PolarHBondContact O-N 3.47Å; V673-Q675 VanDerWaalsContact C-N 3.29Å; V673-Q675 PolarHBondContact O-N 2.98Å; V673-T676 PolarHBondContact O-N 3.35Å; V673-T676 VanDerWaalsContact O-N 3.09Å; V673-V677 HydrophobicContact CG1-CG2 4.02Å; V673-V677 WeakPolarHBondContact O-CB 3.43Å; V673-V677 WeakPolarHBondContact O-CG2 3.31Å; V673-V677 PolarHBondContact O-N 3.36Å; V673-I732 HydrophobicContact CG1-CD1 4.36Å; V673-V736 HydrophobicContact CG1-CG1 4.27Å; V673-V736 HydrophobicContact CG1-CG2 3.46Å; V673-V736 VanDerWaalsContact CG1-CG2 3.46Å; V673-L751 HydrophobicContact CG2-CD1 3.58Å; V673-L751 HydrophobicContact CG2-CD2 3.9Å; V673-L751 HydrophobicContact CG2-CG 4.34Å; V673-V936 HydrophobicContact CG2-CG2 3.66Å; V673-F953 HydrophobicContact CG2-CZ 4.26Å; V673-L957 HydrophobicContact CB-CD1 4.04Å; V673-L957 HydrophobicContact CG1-CD1 3.5Å; V673-L957 VanDerWaalsContact CG1-CD1 3.5Å; V673-L957 HydrophobicContact CG1-CD2 4.41Å
674	C	88	Confident	79.1	Confident	4 Å²	4	39.3 Å²	39.3	3%	0.027	20%	0.195	C	C	.	.	H	α-helix	trans	-59	-39.8	177.5	-65.4	0	0	0	0	112.2	A670 W671	A670-C674 PolarHBondContact O-N 3.49Å; A670-C674 PolarHBondContact O-SG 2.79Å; A670-C674 VanDerWaalsContact O-SG 3.37Å; W671-C674 HydrophobicContact CE3-CB 4.38Å; W671-C674 PolarHBondContact O-N 3.14Å
675	Q	83.4	Confident	76.8	Confident	125 Å²	125	36.4 Å²	36.4	58%	0.584	18%	0.176	S	C	*	.	H	α-helix	trans	-69.4	-31.7	175	-67.4	175	3.3	0	0	113.3	W671 V673 H678	W671-Q675 WeakPolarHBondContact O-CG 3.49Å; W671-Q675 PolarHBondContact O-N 3.43Å; V673-Q675 VanDerWaalsContact C-N 3.29Å; V673-Q675 PolarHBondContact O-N 2.98Å; Q675-H678 PolarHBondContact O-CE1 3.49Å
676	T	78.9	Confident	74.2	Confident	36 Å²	36	38.6 Å²	38.6	22%	0.221	19%	0.188	C	C	.	.	H	α-helix	trans	-81.3	-39.6	-178.7	-62.6	0	0	0	0	112.6	N672 V673 H678 P753	N672-T676 VanDerWaalsContact O-CB 3.3Å; N672-T676 WeakPolarHBondContact O-CB 3.44Å; N672-T676 PolarHBondContact O-N 3.02Å; N672-T676 PolarHBondContact O-OG1 2.81Å; V673-T676 PolarHBondContact O-N 3.35Å; V673-T676 VanDerWaalsContact O-N 3.09Å; T676-H678 VanDerWaalsContact C-N 3.34Å; T676-H678 PolarHBondContact O-N 2.81Å; T676-H678 VanDerWaalsContact O-N 3.14Å; T676-P753 HydrophobicContact CG2-CB 3.71Å
677	V	77.5	Confident	71.4	Confident	5 Å²	5	42.9 Å²	42.9	3%	0.03	20%	0.204	C	C	.	.			trans	-89.4	69.1	-174	179.1	0	0	0	0	109.5	V673 F679 I732 V736 A934	V673-V677 HydrophobicContact CG1-CG2 4.02Å; V673-V677 WeakPolarHBondContact O-CB 3.43Å; V673-V677 WeakPolarHBondContact O-CG2 3.31Å; V673-V677 PolarHBondContact O-N 3.36Å; V677-F679 PolarHBondContact O-N 2.76Å; V677-I732 HydrophobicContact CB-CD1 4.37Å; V677-I732 HydrophobicContact CG1-CD1 4.3Å; V677-I732 HydrophobicContact CG1-CG1 4.16Å; V677-V736 HydrophobicContact CG2-CG2 4.26Å; V677-A934 HydrophobicContact CG2-CB 3.58Å
678	H	67	Low	68.6	Low	116 Å²	116	49.3 Å²	49.3	54%	0.537	23%	0.228	S	C	.	.			trans	-66	121.1	167.5	-69.6	-37.3	0	0	0	110.1	Q675 T676	Q675-H678 PolarHBondContact O-CE1 3.49Å; T676-H678 VanDerWaalsContact C-N 3.34Å; T676-H678 PolarHBondContact O-N 2.81Å; T676-H678 VanDerWaalsContact O-N 3.14Å
679	F	66	Low	65.8	Low	35 Å²	35	46.6 Å²	46.6	15%	0.154	22%	0.22	C	C	.	.			trans	-112.5	138.4	-176.2	-154.3	-82	0	0	0	111.6	V677 L681 Y735 T931	V677-F679 PolarHBondContact O-N 2.76Å; F679-L681 HydrophobicContact CD1-CD2 4.2Å; F679-L681 HydrophobicContact CD1-CG 3.78Å; F679-L681 HydrophobicContact CE1-CB 4.23Å; F679-L681 HydrophobicContact CE1-CD2 3.45Å; F679-L681 VanDerWaalsContact CE1-CD2 3.45Å; F679-L681 HydrophobicContact CE1-CG 3.5Å; F679-L681 VanDerWaalsContact CE1-CG 3.5Å; F679-L681 HydrophobicContact CZ-CD2 4.25Å; F679-Y735 HydrophobicContact CD2-CD1 4.37Å; F679-Y735 AromaticContact CD2-CD2 3.87Å; F679-Y735 HydrophobicContact CD2-CD2 3.87Å; F679-Y735 HydrophobicContact CD2-CE1 4.3Å; F679-Y735 AromaticContact CD2-CE2 3.79Å; F679-Y735 HydrophobicContact CD2-CE2 3.79Å; F679-Y735 HydrophobicContact CD2-CG 4.17Å; F679-Y735 AromaticContact CE2-CD1 3.7Å; F679-Y735 HydrophobicContact CE2-CD1 3.7Å; F679-Y735 AromaticContact CE2-CD2 3.8Å; F679-Y735 HydrophobicContact CE2-CD2 3.8Å; F679-Y735 AromaticContact CE2-CE1 3.3Å; F679-Y735 HydrophobicContact CE2-CE1 3.3Å; F679-Y735 AromaticContact CE2-CE2 3.43Å; F679-Y735 HydrophobicContact CE2-CE2 3.43Å; F679-Y735 VanDerWaalsContact CE2-CE2 3.43Å; F679-Y735 AromaticContact CE2-CG 3.93Å; F679-Y735 HydrophobicContact CE2-CG 3.93Å; F679-Y735 AromaticContact CE2-CZ 3.15Å; F679-Y735 AromaticContact CZ-CE1 3.86Å; F679-Y735 HydrophobicContact CZ-CE1 3.86Å; F679-Y735 HydrophobicContact CZ-CE2 4.03Å; F679-Y735 AromaticContact CZ-CZ 3.5Å; F679-Y735 WeakPolarHBondContact CZ-OH 3.46Å; F679-T931 HydrophobicContact CD2-CG2 3.96Å; F679-T931 HydrophobicContact CE1-CG2 4.17Å; F679-T931 HydrophobicContact CE2-CG2 3.41Å; F679-T931 VanDerWaalsContact CE2-CG2 3.41Å; F679-T931 HydrophobicContact CZ-CG2 3.54Å
680	D	59.8	Low	62.9	Low	32 Å²	32	50.4 Å²	50.4	17%	0.171	24%	0.237	C	C	.	.			trans	-132.7	100	169	176.4	33.5	0	0	0	111.5	R682 S683	D680-R682 VanDerWaalsContact C-N 3.29Å; D680-R682 PolarHBondContact O-N 2.93Å; D680-R682 WeakPolarHBondContact OD1-CB 3.29Å; D680-R682 VanDerWaalsContact OD1-CG 3.31Å; D680-R682 WeakPolarHBondContact OD1-CG 3.1Å; D680-R682 PolarHBondContact OD1-N 2.92Å; D680-S683 PolarHBondContact O-OG 2.72Å; D680-S683 VanDerWaalsContact OD2-CB 3.3Å; D680-S683 WeakPolarHBondContact OD2-CB 3.29Å; D680-S683 PolarHBondContact OD2-N 2.84Å; D680-S683 VanDerWaalsContact OD2-N 3.13Å
681	L	62.5	Low	60.1	Low	9 Å²	9	57 Å²	57	5%	0.047	27%	0.266	C	S	.	.	S	Bend	trans	-67.4	-27.8	174	-77	172.2	0	0	0	112.7	F679 S683 T684 G685 S728 M730 P1335 W1432 H1433	F679-L681 HydrophobicContact CD1-CD2 4.2Å; F679-L681 HydrophobicContact CD1-CG 3.78Å; F679-L681 HydrophobicContact CE1-CB 4.23Å; F679-L681 HydrophobicContact CE1-CD2 3.45Å; F679-L681 VanDerWaalsContact CE1-CD2 3.45Å; F679-L681 HydrophobicContact CE1-CG 3.5Å; F679-L681 VanDerWaalsContact CE1-CG 3.5Å; F679-L681 HydrophobicContact CZ-CD2 4.25Å; L681-S683 PolarHBondContact O-N 3.15Å; L681-T684 PolarHBondContact O-N 3.47Å; L681-T684 PolarHBondContact O-OG1 3.15Å; L681-G685 PolarHBondContact O-N 2.77Å; L681-S728 WeakPolarHBondContact CD2-O 3.38Å; L681-M730 HydrophobicContact CD1-CB 4.2Å; L681-M730 HydrophobicContact CD1-CG 3.93Å; L681-M730 HydrophobicContact CD1-SD 4.22Å; L681-P1335 HydrophobicContact CD1-CB 4.41Å; L681-P1335 HydrophobicContact CD1-CG 3.37Å; L681-W1432 HydrophobicContact CB-CH2 4.33Å; L681-W1432 HydrophobicContact CB-CZ3 3.73Å; L681-H1433 PolarHBondContact N-NE2 3.42Å
682	R	61.2	Low	57.2	Low	47 Å²	47	58.3 Å²	58.3	18%	0.177	28%	0.277	C	S	.	.	H	α-helix	trans	-60	-38.3	-176.7	-55.2	168.8	170.2	166.8	-0.7	110.6	D680 T684 L686 C1407 S1428 W1432	D680-R682 VanDerWaalsContact C-N 3.29Å; D680-R682 PolarHBondContact O-N 2.93Å; D680-R682 WeakPolarHBondContact OD1-CB 3.29Å; D680-R682 VanDerWaalsContact OD1-CG 3.31Å; D680-R682 WeakPolarHBondContact OD1-CG 3.1Å; D680-R682 PolarHBondContact OD1-N 2.92Å; R682-T684 PolarHBondContact O-N 3.46Å; R682-L686 HydrophobicContact CB-CD1 4.26Å; R682-L686 WeakPolarHBondContact O-CG 3.33Å; R682-L686 PolarHBondContact O-N 2.74Å; R682-C1407 PolarHBondContact NH2-SG 3.24Å; R682-S1428 PolarHBondContact NH2-O 3.04Å; R682-W1432 HydrophobicContact CG-CD2 3.99Å; R682-W1432 HydrophobicContact CG-CE3 4.03Å; R682-W1432 HydrophobicContact CG-CH2 3.87Å; R682-W1432 HydrophobicContact CG-CZ2 3.77Å; R682-W1432 HydrophobicContact CG-CZ3 4Å; R682-W1432 VanDerWaalsContact NH2-CD1 3.3Å
683	S	49.9	Very low	54.3	Low	19 Å²	19	63.4 Å²	63.4	13%	0.133	29%	0.291	C	S	.	.	H	α-helix	trans	-53.4	-32.9	174.9	72.1	0	0	0	0	114.9	D680 L681	D680-S683 PolarHBondContact O-OG 2.72Å; D680-S683 VanDerWaalsContact OD2-CB 3.3Å; D680-S683 WeakPolarHBondContact OD2-CB 3.29Å; D680-S683 PolarHBondContact OD2-N 2.84Å; D680-S683 VanDerWaalsContact OD2-N 3.13Å; L681-S683 PolarHBondContact O-N 3.15Å
684	T	47.6	Very low	51.5	Low	55 Å²	55	68.7 Å²	68.7	34%	0.337	32%	0.315	S	S	.	.	H	α-helix	trans	-94	-45.4	-175.5	66.5	0	0	0	0	111.9	L681 R682 L686	L681-T684 PolarHBondContact O-N 3.47Å; L681-T684 PolarHBondContact O-OG1 3.15Å; R682-T684 PolarHBondContact O-N 3.46Å; T684-L686 PolarHBondContact O-N 2.86Å
685	G	43.2	Very low	49	Very low	10 Å²	10	75.4 Å²	75.4	10%	0.103	35%	0.346	C	S	.	.	H	α-helix	trans	-68	-35.1	-175.4	0	0	0	0	0	114.6	L681	L681-G685 PolarHBondContact O-N 2.77Å
686	L	36	Very low	46.7	Very low	56 Å²	56	78 Å²	78	29%	0.293	36%	0.355	S	S	.	.	H	α-helix	trans	-80.7	-22	-169.1	-69.6	171.8	0	0	0	115	R682 T684 Y688 F689 Q690	R682-L686 HydrophobicContact CB-CD1 4.26Å; R682-L686 WeakPolarHBondContact O-CG 3.33Å; R682-L686 PolarHBondContact O-N 2.74Å; T684-L686 PolarHBondContact O-N 2.86Å; L686-Y688 PolarHBondContact O-N 2.94Å; L686-F689 PolarHBondContact O-N 2.86Å; L686-Q690 PolarHBondContact O-N 3.16Å; L686-Q690 VanDerWaalsContact O-N 3.17Å
687	R	34.3	Very low	44.4	Very low	90 Å²	90	82.8 Å²	82.8	34%	0.34	38%	0.375	S	S	.	.	H	α-helix	trans	-65.6	-36.4	-175.4	-74.8	-170.5	175.9	-126.5	-4.1	113.2	F689 Q690 F691 P926 I927	R687-F689 VanDerWaalsContact C-N 3.34Å; R687-Q690 PolarHBondContact O-N 2.91Å; R687-F691 PolarHBondContact O-N 2.83Å; R687-P926 PolarHBondContact NH2-O 3.33Å; R687-I927 PolarHBondContact NH2-O 3.07Å
688	Y	34.4	Very low	42.1	Very low	157 Å²	157	90 Å²	90	62%	0.616	41%	0.409	S	S	*	.	H	α-helix	trans	-67.1	-36.4	177.9	-158.4	-99.4	0	0	0	112	L686 N692	L686-Y688 PolarHBondContact O-N 2.94Å; Y688-N692 WeakPolarHBondContact CD1-ND2 3.48Å; Y688-N692 VanDerWaalsContact CE1-ND2 3.26Å; Y688-N692 WeakPolarHBondContact CE1-ND2 3.24Å; Y688-N692 PolarHBondContact O-N 2.91Å; Y688-N692 PolarHBondContact O-ND2 2.73Å
689	F	35.4	Very low	40.3	Very low	72 Å²	72	88.7 Å²	88.7	32%	0.316	41%	0.413	S	S	.	.	H	α-helix	trans	-69.1	-35.6	175.3	-76	-74.1	0	0	0	113.1	L686 R687 R693 M1346	L686-F689 PolarHBondContact O-N 2.86Å; R687-F689 VanDerWaalsContact C-N 3.34Å; F689-R693 WeakPolarHBondContact O-CB 3.37Å; F689-R693 PolarHBondContact O-N 2.93Å; F689-M1346 HydrophobicContact CD1-CE 4.3Å; F689-M1346 HydrophobicContact CD1-SD 4.27Å; F689-M1346 HydrophobicContact CE1-CE 3.84Å; F689-M1346 HydrophobicContact CE1-SD 3.65Å; F689-M1346 HydrophobicContact CZ-SD 4.06Å
690	Q	32	Very low	38.3	Very low	84 Å²	84	96.2 Å²	96.2	39%	0.393	45%	0.448	S	S	.	.	H	α-helix	trans	-70.1	-39.9	176.5	-75.3	-166.1	-117.8	0	0	113	L686 R687 N692 R693 Q694 R1405	L686-Q690 PolarHBondContact O-N 3.16Å; L686-Q690 VanDerWaalsContact O-N 3.17Å; R687-Q690 PolarHBondContact O-N 2.91Å; Q690-N692 PolarHBondContact O-N 3.48Å; Q690-R693 PolarHBondContact O-N 3.49Å; Q690-Q694 PolarHBondContact O-N 3.42Å; Q690-R1405 VanDerWaalsContact OE1-NH1 3.09Å
691	F	32.9	Very low	36.6	Very low	137 Å²	137	99.1 Å²	99.1	60%	0.601	47%	0.471	S	S	*	.	H	α-helix	trans	-58	-47.7	173.2	-103.9	-89.7	0	0	0	111.7	R687 R693 Q694 Q695	R687-F691 PolarHBondContact O-N 2.83Å; F691-R693 VanDerWaalsContact C-N 3.34Å; F691-R693 PolarHBondContact O-N 3.16Å; F691-Q694 PolarHBondContact O-N 3.09Å; F691-Q695 PolarHBondContact O-N 2.74Å; F691-Q695 VanDerWaalsContact O-N 3.17Å
692	N	30.7	Very low	34.7	Very low	70 Å²	70	106.2 Å²	106.2	37%	0.374	51%	0.509	S	S	.	.	H	α-helix	trans	-70	-26.2	178.5	-68.9	-20.3	0	0	0	113.5	Y688 Q690 K696	Y688-N692 WeakPolarHBondContact CD1-ND2 3.48Å; Y688-N692 VanDerWaalsContact CE1-ND2 3.26Å; Y688-N692 WeakPolarHBondContact CE1-ND2 3.24Å; Y688-N692 PolarHBondContact O-N 2.91Å; Y688-N692 PolarHBondContact O-ND2 2.73Å; Q690-N692 PolarHBondContact O-N 3.48Å; N692-K696 PolarHBondContact O-N 3.28Å
693	R	29.3	Very low	32.8	Very low	173 Å²	173	110.5 Å²	110.5	65%	0.653	54%	0.536	S	S	*	.	H	α-helix	trans	-73.2	-42.8	172	-109	-169.1	-176.4	-167.3	0.9	112.4	F689 Q690 F691 Q695 K696 Q697	F689-R693 WeakPolarHBondContact O-CB 3.37Å; F689-R693 PolarHBondContact O-N 2.93Å; Q690-R693 PolarHBondContact O-N 3.49Å; F691-R693 VanDerWaalsContact C-N 3.34Å; F691-R693 PolarHBondContact O-N 3.16Å; R693-Q695 VanDerWaalsContact C-N 3.34Å; R693-Q695 PolarHBondContact O-N 3.31Å; R693-K696 CarbonylContact O-C 3.49Å; R693-K696 PolarHBondContact O-N 2.95Å; R693-K696 VanDerWaalsContact O-N 3.07Å; R693-Q697 WeakPolarHBondContact O-CB 3.43Å; R693-Q697 WeakPolarHBondContact O-CG 3.12Å; R693-Q697 PolarHBondContact O-N 2.88Å
694	Q	32.2	Very low	31.5	Very low	111 Å²	111	117 Å²	117	52%	0.519	56%	0.564	S	S	.	*	H	α-helix	trans	-62.1	-43.1	178.7	-74.5	175.3	-41.2	0	0	111	Q690 F691 K696 Q697 Q698	Q690-Q694 PolarHBondContact O-N 3.42Å; F691-Q694 PolarHBondContact O-N 3.09Å; Q694-K696 VanDerWaalsContact C-N 3.26Å; Q694-K696 PolarHBondContact O-N 2.82Å; Q694-Q697 PolarHBondContact O-N 2.78Å; Q694-Q698 PolarHBondContact O-N 3.07Å
695	Q	35.5	Very low	30.2	Very low	144 Å²	144	120.5 Å²	120.5	67%	0.673	59%	0.586	S	S	*	*	H	α-helix	trans	-65.1	-22.9	173.4	-69	-172.9	3.1	0	0	114.5	F691 R693	F691-Q695 PolarHBondContact O-N 2.74Å; F691-Q695 VanDerWaalsContact O-N 3.17Å; R693-Q695 VanDerWaalsContact C-N 3.34Å; R693-Q695 PolarHBondContact O-N 3.31Å
696	K	34.9	Very low	29.4	Very low	179 Å²	179	126.8 Å²	126.8	78%	0.778	62%	0.621	S	S	*	*	H	α-helix	trans	-96.3	-5.1	176.3	-84.6	-159.7	169.2	-164.6	0	115.4	N692 R693 Q694	N692-K696 PolarHBondContact O-N 3.28Å; R693-K696 CarbonylContact O-C 3.49Å; R693-K696 PolarHBondContact O-N 2.95Å; R693-K696 VanDerWaalsContact O-N 3.07Å; Q694-K696 VanDerWaalsContact C-N 3.26Å; Q694-K696 PolarHBondContact O-N 2.82Å
697	Q	31.1	Very low	28.8	Very low	137 Å²	137	133.1 Å²	133.1	64%	0.64	65%	0.647	S	S	*	*	H	α-helix	trans	-120.9	0.5	-176.2	-64.8	-168.8	-70.5	0	0	114.1	R693 Q694	R693-Q697 WeakPolarHBondContact O-CB 3.43Å; R693-Q697 WeakPolarHBondContact O-CG 3.12Å; R693-Q697 PolarHBondContact O-N 2.88Å; Q694-Q697 PolarHBondContact O-N 2.78Å
698	Q	29.3	Very low	28.4	Very low	157 Å²	157	136.4 Å²	136.4	73%	0.734	67%	0.671	S	S	*	*	S	Bend	trans	-104.8	20.8	173	-65.9	-170.9	-56.7	0	0	113.3	Q694	Q694-Q698 PolarHBondContact O-N 3.07Å
699	S	28	Very low	27.9	Very low	88 Å²	88	135 Å²	135	62%	0.615	67%	0.674	S	S	*	*	S	Bend	trans	-127.2	39.9	-179.5	69	0	0	0	0	112.9
700	Q	24.3	Very low	27.5	Very low	193 Å²	193	136.6 Å²	136.6	90%	0.902	69%	0.686	S	S	*	*	S	Bend	trans	-141.7	53.7	171.4	-74.8	-165.5	-44.8	0	0	111.1
701	S	23	Very low	27.4	Very low	93 Å²	93	137.8 Å²	137.8	65%	0.65	70%	0.699	S	S	*	*	S	Bend	trans	-158.7	128.4	167.9	58.8	0	0	0	0	112.3
702	N	23.2	Very low	27	Very low	158 Å²	158	138.3 Å²	138.3	85%	0.845	70%	0.703	S	S	*	*			trans	77.5	135.2	162.7	-57.1	7.4	0	0	0	118.3
703	N	20.9	Very low	26.9	Very low	138 Å²	138	142.6 Å²	142.6	74%	0.738	72%	0.718	S	S	*	*			trans	-85.7	-175.2	-172.5	-62.2	-5.4	0	0	0	113.8
704	E	22.8	Very low	26.9	Very low	154 Å²	154	139.4 Å²	139.4	72%	0.72	72%	0.723	S	S	*	*			trans	73.6	82.9	144.2	-77.3	145.3	-116.2	0	0	118.5
705	T	21.8	Very low	26.8	Very low	130 Å²	130	139.2 Å²	139.2	80%	0.798	73%	0.729	S	S	*	*				43	103.2	119.6	54.6	0	0	0	0	119.4
706	V	25.7	Very low	26.3	Very low	141 Å²	141	140.1 Å²	140.1	86%	0.855	74%	0.735	S	S	*	*				-138.3	140.2	115	167.8	0	0	0	0	108.5
707	K	23.1	Very low	25.7	Very low	189 Å²	189	138.8 Å²	138.8	82%	0.822	74%	0.737	S	S	*	*			trans	-78.1	124.3	171.8	-62.1	172.8	-176.9	173.6	0	109.7
708	N	25.2	Very low	25.4	Very low	159 Å²	159	136.5 Å²	136.5	85%	0.85	74%	0.735	S	S	*	*			trans	-149.6	119.7	149.2	-112	-27.8	0	0	0	109.9
709	N	25.1	Very low	25.1	Very low	129 Å²	129	135.6 Å²	135.6	69%	0.69	74%	0.736	S	S	*	*			trans	-86.4	-179.2	-175.5	-71.6	-38.3	0	0	0	111.7
710	D	26.2	Very low	24.9	Very low	104 Å²	104	137.4 Å²	137.4	56%	0.556	74%	0.743	S	S	*	*			trans	73.5	32.3	150.2	-54.9	-42	0	0	0	119.6	K713	D710-K713 WeakPolarHBondContact OD1-CD 3.4Å; D710-K713 VanDerWaalsContact OD1-CE 3.23Å; D710-K713 WeakPolarHBondContact OD1-CE 3.17Å; D710-K713 IonicContact OD1-NZ 2.77Å; D710-K713 PolarHBondContact OD1-NZ 2.87Å; D710-K713 IonicContact OD2-NZ 3.44Å
711	V	29.5	Very low	25	Very low	110 Å²	110	133.9 Å²	133.9	67%	0.667	74%	0.735	S	S	*	*	S	Bend	trans	-131.2	37.9	149.9	-151.7	0	0	0	0	113.3	R874	V711-R874 PolarHBondContact O-NH2 3.09Å
712	Q	25.6	Very low	25	Very low	147 Å²	147	138.4 Å²	138.4	69%	0.687	75%	0.745	S	S	*	*	S	Bend	trans	-144.6	1.9	171.8	-121.4	168.6	1.3	0	0	116.3	S714	Q712-S714 PolarHBondContact O-N 2.65Å
713	K	27.7	Very low	25.3	Very low	160 Å²	160	137 Å²	137	70%	0.696	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.1	-1.2	173.9	-72.7	176.2	-179.5	156.8	0	114.4	D710	D710-K713 WeakPolarHBondContact OD1-CD 3.4Å; D710-K713 VanDerWaalsContact OD1-CE 3.23Å; D710-K713 WeakPolarHBondContact OD1-CE 3.17Å; D710-K713 IonicContact OD1-NZ 2.77Å; D710-K713 PolarHBondContact OD1-NZ 2.87Å; D710-K713 IonicContact OD2-NZ 3.44Å
714	S	29.6	Very low	25.6	Very low	106 Å²	106	138.9 Å²	138.9	74%	0.741	74%	0.736	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96	0.2	-176	53.2	0	0	0	0	115.8	Q712	Q712-S714 PolarHBondContact O-N 2.65Å
715	V	29.9	Very low	26	Very low	108 Å²	108	138.1 Å²	138.1	66%	0.655	73%	0.732	S	S	*	*	S	Bend	trans	-115.5	-15.6	-173.5	-176.6	0	0	0	0	114
716	M	24.6	Very low	26.9	Very low	162 Å²	162	137.7 Å²	137.7	80%	0.798	73%	0.73	S	S	*	*	S	Bend	trans	-91.4	-7.1	-178.2	-82.4	-67.3	-179.9	0	0	115.7	S718	M716-S718 PolarHBondContact O-N 2.93Å
717	N	23	Very low	28	Very low	152 Å²	152	133.7 Å²	133.7	81%	0.813	70%	0.699	S	S	*	*			trans	-96.7	68.5	175.1	-83.5	-4.3	0	0	0	112.1
718	S	24.5	Very low	29.9	Very low	88 Å²	88	125.6 Å²	125.6	62%	0.615	67%	0.666	S	S	*	*			trans	-140	61.9	166.2	56.8	0	0	0	0	111.6	M716 T720	M716-S718 PolarHBondContact O-N 2.93Å; S718-T720 VanDerWaalsContact C-N 3.26Å; S718-T720 PolarHBondContact O-N 3.42Å
719	N	23	Very low	31.8	Very low	138 Å²	138	119.8 Å²	119.8	74%	0.738	64%	0.637	S	S	*	*			trans	-70.3	65.6	-177.6	-80.4	-32.2	0	0	0	114
720	T	23.3	Very low	34.4	Very low	127 Å²	127	114.1 Å²	114.1	78%	0.779	61%	0.607	S	S	*	*			trans	-151.2	61.4	175.6	20.2	0	0	0	0	113.1	S718	S718-T720 VanDerWaalsContact C-N 3.26Å; S718-T720 PolarHBondContact O-N 3.42Å
721	V	26.8	Very low	37.1	Very low	119 Å²	119	109.7 Å²	109.7	72%	0.721	58%	0.583	S	S	*	*			trans	-128.2	66.7	168.2	-165.9	0	0	0	0	111.7	K723	V721-K723 VanDerWaalsContact C-N 3.28Å; V721-K723 HydrophobicContact CG1-CB 4.25Å; V721-K723 HydrophobicContact CG1-CG 4.28Å; V721-K723 PolarHBondContact O-N 3.19Å; V721-K723 VanDerWaalsContact O-N 3.09Å
722	H	23.7	Very low	39.8	Very low	187 Å²	187	104.6 Å²	104.6	87%	0.866	55%	0.552	S	S	*	*			trans	-74.1	84.6	156.3	-88.9	-93.4	0	0	0	109.2
723	K	28.3	Very low	42.7	Very low	128 Å²	128	100.9 Å²	100.9	56%	0.557	53%	0.532	S	S	*	.			trans	-126.4	119.3	165.6	-70.5	-174	175.5	-179.3	0	108.8	V721 D863	V721-K723 VanDerWaalsContact C-N 3.28Å; V721-K723 HydrophobicContact CG1-CB 4.25Å; V721-K723 HydrophobicContact CG1-CG 4.28Å; V721-K723 PolarHBondContact O-N 3.19Å; V721-K723 VanDerWaalsContact O-N 3.09Å; K723-D863 IonicContact NZ-OD1 3.43Å; K723-D863 PolarHBondContact NZ-OD1 2.87Å; K723-D863 IonicContact NZ-OD2 2.97Å; K723-D863 PolarHBondContact NZ-OD2 3.33Å
724	Q	27.4	Very low	45.3	Very low	178 Å²	178	99.7 Å²	99.7	83%	0.832	52%	0.524	S	S	*	.			trans	-64.7	168.8	-179.1	-70.7	166.6	-38	0	0	111.5	V726	Q724-V726 PolarHBondContact O-N 3.43Å
725	Q	31.8	Very low	47.9	Very low	138 Å²	138	94.7 Å²	94.7	65%	0.645	49%	0.489	S	S	*	.			trans	-70	76.1	173.1	-66.3	-179.2	5.7	0	0	110.7	Y727	Q725-Y727 VanDerWaalsContact C-N 3.27Å; Q725-Y727 HydrophobicContact CB-CD2 4.49Å; Q725-Y727 HydrophobicContact CB-CE2 4.23Å; Q725-Y727 WeakPolarHBondContact O-CD2 3.3Å; Q725-Y727 PolarHBondContact O-N 2.64Å
726	V	40.2	Very low	50.7	Low	122 Å²	122	90 Å²	90	74%	0.739	46%	0.461	S	S	*	.			trans	-74.5	81.9	177.4	-172.1	0	0	0	0	109.7	Q724	Q724-V726 PolarHBondContact O-N 3.43Å
727	Y	50.2	Low	53.8	Low	57 Å²	57	85.3 Å²	85.3	22%	0.224	44%	0.436	C	S	.	.	P	Polyproline II helix	trans	-58.2	146.3	149.6	-62.6	-84.9	0	0	0	108.3	Q725 L1338 K1342	Q725-Y727 VanDerWaalsContact C-N 3.27Å; Q725-Y727 HydrophobicContact CB-CD2 4.49Å; Q725-Y727 HydrophobicContact CB-CE2 4.23Å; Q725-Y727 WeakPolarHBondContact O-CD2 3.3Å; Q725-Y727 PolarHBondContact O-N 2.64Å; Y727-L1338 HydrophobicContact CD1-CD2 3.79Å; Y727-L1338 HydrophobicContact CE1-CD1 4.17Å; Y727-L1338 HydrophobicContact CE1-CD2 3.65Å; Y727-L1338 HydrophobicContact CG-CD2 4.49Å; Y727-K1342 PolarHBondContact OH-NZ 3.48Å
728	S	61.4	Low	57.1	Low	18 Å²	18	78.6 Å²	78.6	13%	0.126	40%	0.4	C	S	.	.	P	Polyproline II helix	trans	-64.4	138.2	172.9	-144.9	0	0	0	0	109.3	L681 M730 Y735	L681-S728 WeakPolarHBondContact CD2-O 3.38Å; S728-M730 PolarHBondContact O-N 3.16Å; S728-Y735 WeakPolarHBondContact CB-OH 3.33Å; S728-Y735 PolarHBondContact OG-OH 3.24Å
729	P	66.4	Low	60.2	Low	37 Å²	37	75.7 Å²	75.7	24%	0.24	38%	0.377	C	S	.	.	P	Polyproline II helix	trans	-60.3	137.3	-179.6	22.2	-32.8	0	0	0	111.3	Y734 Y735	P729-Y734 HydrophobicContact CB-CD1 4.31Å; P729-Y734 HydrophobicContact CB-CD2 3.71Å; P729-Y734 HydrophobicContact CB-CE2 4.07Å; P729-Y734 HydrophobicContact CB-CG 3.84Å; P729-Y734 HydrophobicContact CG-CD1 3.86Å; P729-Y734 HydrophobicContact CG-CD2 3.96Å; P729-Y734 HydrophobicContact CG-CG 3.53Å; P729-Y735 VanDerWaalsContact CD-OH 3.23Å; P729-Y735 WeakPolarHBondContact CD-OH 3.36Å; P729-Y735 WeakPolarHBondContact CG-OH 3.33Å; P729-Y735 VanDerWaalsContact O-CE2 3.3Å; P729-Y735 WeakPolarHBondContact O-CE2 3.35Å; P729-Y735 PolarHBondContact O-OH 3.08Å
730	M	80.2	Confident	63.4	Low	11 Å²	11	71.7 Å²	71.7	5%	0.054	35%	0.353	C	S	.	.	S	Bend	trans	-77.1	-26.4	-174.5	-172.9	163.5	60.7	0	0	113.1	L681 S728 I732 Y1329 D1333 P1335	L681-M730 HydrophobicContact CD1-CB 4.2Å; L681-M730 HydrophobicContact CD1-CG 3.93Å; L681-M730 HydrophobicContact CD1-SD 4.22Å; S728-M730 PolarHBondContact O-N 3.16Å; M730-I732 PolarHBondContact O-N 3.46Å; M730-Y1329 HydrophobicContact CE-CD1 3.83Å; M730-Y1329 HydrophobicContact CE-CG 4.44Å; M730-Y1329 HydrophobicContact CG-CD1 3.87Å; M730-Y1329 HydrophobicContact SD-CD1 4.07Å; M730-D1333 HydrophobicContact CE-CB 4.1Å; M730-D1333 WeakPolarHBondContact CE-OD2 3.37Å; M730-P1335 HydrophobicContact SD-CB 4Å; M730-P1335 HydrophobicContact SD-CG 3.57Å; M730-P1335 VanDerWaalsContact SD-CG 3.57Å
731	D	82.8	Confident	66.4	Low	10 Å²	10	66.3 Å²	66.3	5%	0.053	32%	0.319	C	S	.	.	S	Bend	trans	-64.1	116.8	174	170.4	16.2	0	0	0	112.7	R733 Y734 Y1329	D731-R733 PolarHBondContact O-N 2.88Å; D731-R733 VanDerWaalsContact OD1-CB 3.22Å; D731-R733 WeakPolarHBondContact OD1-CB 3.38Å; D731-R733 WeakPolarHBondContact OD1-CG 3.44Å; D731-R733 IonicContact OD1-CZ 3.36Å; D731-R733 PolarHBondContact OD1-N 2.88Å; D731-R733 IonicContact OD1-NE 2.87Å; D731-R733 PolarHBondContact OD1-NE 3.22Å; D731-R733 IonicContact OD1-NH2 2.92Å; D731-R733 IonicContact OD2-CZ 3.15Å; D731-R733 IonicContact OD2-NE 2.65Å; D731-R733 PolarHBondContact OD2-NE 3.09Å; D731-R733 IonicContact OD2-NH2 2.74Å; D731-R733 PolarHBondContact OD2-NH2 3.42Å; D731-Y734 HydrophobicContact CB-CD2 3.84Å; D731-Y734 HydrophobicContact CB-CE2 4.02Å; D731-Y734 WeakPolarHBondContact O-CD2 3.37Å; D731-Y734 PolarHBondContact O-N 3.12Å; D731-Y734 VanDerWaalsContact O-N 3.12Å; D731-Y1329 VanDerWaalsContact CB-O 3.3Å; D731-Y1329 WeakPolarHBondContact CB-O 3.36Å; D731-Y1329 PolarHBondContact N-O 2.8Å
732	I	84.8	Confident	69	Low	4 Å²	4	63.1 Å²	63.1	2%	0.021	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-52.3	-28.1	178.3	-172.5	162.8	0	0	0	113.6	V673 V677 M730 Y734 Y735 V736 L957 Y961	V673-I732 HydrophobicContact CG1-CD1 4.36Å; V677-I732 HydrophobicContact CB-CD1 4.37Å; V677-I732 HydrophobicContact CG1-CD1 4.3Å; V677-I732 HydrophobicContact CG1-CG1 4.16Å; M730-I732 PolarHBondContact O-N 3.46Å; I732-Y734 PolarHBondContact O-N 2.85Å; I732-Y734 VanDerWaalsContact O-N 3.07Å; I732-Y735 PolarHBondContact O-N 3.22Å; I732-V736 HydrophobicContact CG1-CG2 4.15Å; I732-L957 HydrophobicContact CD1-CD1 4.04Å; I732-L957 HydrophobicContact CG1-CD1 4.4Å; I732-L957 HydrophobicContact CG2-CD1 4.21Å; I732-L957 HydrophobicContact CG2-CD2 4.24Å; I732-L957 HydrophobicContact CG2-CG 3.85Å; I732-Y961 HydrophobicContact CB-CD1 3.92Å; I732-Y961 HydrophobicContact CB-CD2 4.43Å; I732-Y961 HydrophobicContact CB-CE1 4.16Å; I732-Y961 HydrophobicContact CB-CG 4.06Å; I732-Y961 HydrophobicContact CD1-CD2 3.67Å; I732-Y961 HydrophobicContact CD1-CE2 4.12Å; I732-Y961 HydrophobicContact CD1-CG 3.97Å; I732-Y961 HydrophobicContact CG2-CD1 3.83Å; I732-Y961 HydrophobicContact CG2-CG 3.9Å
733	R	86.7	Confident	71.6	Confident	69 Å²	69	56 Å²	56	26%	0.26	27%	0.267	S	S	.	.	G	3₁₀ helix	trans	-62.9	-16.5	-179.3	-58.9	172.6	-57.8	-174.8	4.4	113.2	D731 Y735 L954 L957	D731-R733 PolarHBondContact O-N 2.88Å; D731-R733 VanDerWaalsContact OD1-CB 3.22Å; D731-R733 WeakPolarHBondContact OD1-CB 3.38Å; D731-R733 WeakPolarHBondContact OD1-CG 3.44Å; D731-R733 IonicContact OD1-CZ 3.36Å; D731-R733 PolarHBondContact OD1-N 2.88Å; D731-R733 IonicContact OD1-NE 2.87Å; D731-R733 PolarHBondContact OD1-NE 3.22Å; D731-R733 IonicContact OD1-NH2 2.92Å; D731-R733 IonicContact OD2-CZ 3.15Å; D731-R733 IonicContact OD2-NE 2.65Å; D731-R733 PolarHBondContact OD2-NE 3.09Å; D731-R733 IonicContact OD2-NH2 2.74Å; D731-R733 PolarHBondContact OD2-NH2 3.42Å; R733-Y735 VanDerWaalsContact C-N 3.32Å; R733-L954 HydrophobicContact CB-CD2 4.2Å; R733-L954 VanDerWaalsContact CD-O 3.31Å; R733-L954 WeakPolarHBondContact CD-O 3.1Å; R733-L954 HydrophobicContact CG-CD2 3.95Å; R733-L957 HydrophobicContact CG-CD2 4.14Å
734	Y	83.3	Confident	73.7	Confident	134 Å²	134	57.1 Å²	57.1	53%	0.525	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-77.7	-10.6	174.2	-75.5	-91.3	0	0	0	114.7	P729 D731 I732 R855	P729-Y734 HydrophobicContact CB-CD1 4.31Å; P729-Y734 HydrophobicContact CB-CD2 3.71Å; P729-Y734 HydrophobicContact CB-CE2 4.07Å; P729-Y734 HydrophobicContact CB-CG 3.84Å; P729-Y734 HydrophobicContact CG-CD1 3.86Å; P729-Y734 HydrophobicContact CG-CD2 3.96Å; P729-Y734 HydrophobicContact CG-CG 3.53Å; D731-Y734 HydrophobicContact CB-CD2 3.84Å; D731-Y734 HydrophobicContact CB-CE2 4.02Å; D731-Y734 WeakPolarHBondContact O-CD2 3.37Å; D731-Y734 PolarHBondContact O-N 3.12Å; D731-Y734 VanDerWaalsContact O-N 3.12Å; I732-Y734 PolarHBondContact O-N 2.85Å; I732-Y734 VanDerWaalsContact O-N 3.07Å; Y734-R855 PolarHBondContact O-NH2 2.78Å
735	Y	83.1	Confident	75.7	Confident	1 Å²	1	52.1 Å²	52.1	0%	0.004	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.5	-6	179.8	-48.4	-72.9	0	0	0	112.8	F679 S728 P729 I732 R733 R855 A934	F679-Y735 HydrophobicContact CD2-CD1 4.37Å; F679-Y735 AromaticContact CD2-CD2 3.87Å; F679-Y735 HydrophobicContact CD2-CD2 3.87Å; F679-Y735 HydrophobicContact CD2-CE1 4.3Å; F679-Y735 AromaticContact CD2-CE2 3.79Å; F679-Y735 HydrophobicContact CD2-CE2 3.79Å; F679-Y735 HydrophobicContact CD2-CG 4.17Å; F679-Y735 AromaticContact CE2-CD1 3.7Å; F679-Y735 HydrophobicContact CE2-CD1 3.7Å; F679-Y735 AromaticContact CE2-CD2 3.8Å; F679-Y735 HydrophobicContact CE2-CD2 3.8Å; F679-Y735 AromaticContact CE2-CE1 3.3Å; F679-Y735 HydrophobicContact CE2-CE1 3.3Å; F679-Y735 AromaticContact CE2-CE2 3.43Å; F679-Y735 HydrophobicContact CE2-CE2 3.43Å; F679-Y735 VanDerWaalsContact CE2-CE2 3.43Å; F679-Y735 AromaticContact CE2-CG 3.93Å; F679-Y735 HydrophobicContact CE2-CG 3.93Å; F679-Y735 AromaticContact CE2-CZ 3.15Å; F679-Y735 AromaticContact CZ-CE1 3.86Å; F679-Y735 HydrophobicContact CZ-CE1 3.86Å; F679-Y735 HydrophobicContact CZ-CE2 4.03Å; F679-Y735 AromaticContact CZ-CZ 3.5Å; F679-Y735 WeakPolarHBondContact CZ-OH 3.46Å; S728-Y735 WeakPolarHBondContact CB-OH 3.33Å; S728-Y735 PolarHBondContact OG-OH 3.24Å; P729-Y735 VanDerWaalsContact CD-OH 3.23Å; P729-Y735 WeakPolarHBondContact CD-OH 3.36Å; P729-Y735 WeakPolarHBondContact CG-OH 3.33Å; P729-Y735 VanDerWaalsContact O-CE2 3.3Å; P729-Y735 WeakPolarHBondContact O-CE2 3.35Å; P729-Y735 PolarHBondContact O-OH 3.08Å; I732-Y735 PolarHBondContact O-N 3.22Å; R733-Y735 VanDerWaalsContact C-N 3.32Å; Y735-R855 VanDerWaalsContact CE1-CZ 3.46Å; Y735-A934 PolarHBondContact O-N 2.82Å; Y735-A934 VanDerWaalsContact O-N 3.08Å
736	V	88.8	Confident	77.6	Confident	11 Å²	11	46.8 Å²	46.8	7%	0.067	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	124	-177.3	-176.9	0	0	0	0	109.1	V673 V677 I732 A934 V936 F953 L957	V673-V736 HydrophobicContact CG1-CG1 4.27Å; V673-V736 HydrophobicContact CG1-CG2 3.46Å; V673-V736 VanDerWaalsContact CG1-CG2 3.46Å; V677-V736 HydrophobicContact CG2-CG2 4.26Å; I732-V736 HydrophobicContact CG1-CG2 4.15Å; V736-A934 HydrophobicContact CG2-CB 4.45Å; V736-V936 HydrophobicContact CG1-CG2 3.95Å; V736-F953 HydrophobicContact CG1-CE1 4.27Å; V736-L957 HydrophobicContact CB-CD2 4.02Å; V736-L957 HydrophobicContact CG1-CD2 4.04Å; V736-L957 HydrophobicContact CG2-CD2 3.94Å
737	H	89.4	Confident	79	Confident	62 Å²	62	48 Å²	48	29%	0.287	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	143.6	178.4	174.8	-112.2	0	0	0	110.9	I756 R852 A934 T935 V936	H737-I756 PolarHBondContact CE1-O 2.82Å; H737-I756 VanDerWaalsContact CE1-O 3.22Å; H737-I756 PolarHBondContact ND1-O 3.12Å; H737-I756 VanDerWaalsContact ND1-O 3.17Å; H737-R852 VanDerWaalsContact CB-CZ 3.44Å; H737-A934 PolarHBondContact N-O 3.41Å; H737-T935 HydrophobicContact CB-CG2 4.22Å; H737-T935 WeakPolarHBondContact ND1-CG2 3.42Å; H737-T935 CarbonylContact O-C 3.56Å; H737-T935 VanDerWaalsContact O-CA 3.28Å; H737-T935 WeakPolarHBondContact O-CA 3.49Å; H737-T935 WeakPolarHBondContact O-CG2 3.44Å; H737-V936 PolarHBondContact O-N 2.7Å
738	I	92.5	Very high	80.3	Confident	11 Å²	11	49.2 Å²	49.2	6%	0.056	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	106.6	-172.4	-57.2	167.3	0	0	0	108.8	V936 L938 K950 F953 L954	I738-V936 WeakPolarHBondContact CA-O 3.44Å; I738-L938 HydrophobicContact CG2-CD1 3.63Å; I738-L938 HydrophobicContact CG2-CG 3.88Å; I738-K950 HydrophobicContact CB-CD 4.18Å; I738-K950 HydrophobicContact CD1-CD 4.4Å; I738-K950 HydrophobicContact CD1-CG 3.96Å; I738-K950 HydrophobicContact CG2-CD 3.91Å; I738-K950 HydrophobicContact CG2-CG 4.08Å; I738-F953 HydrophobicContact CD1-CD1 3.61Å; I738-F953 HydrophobicContact CD1-CE1 4.23Å; I738-F953 HydrophobicContact CG1-CD1 4.19Å; I738-F953 HydrophobicContact CG1-CE1 4.44Å; I738-L954 HydrophobicContact CD1-CD1 4.08Å; I738-L954 HydrophobicContact CD1-CD2 3.61Å; I738-L954 HydrophobicContact CD1-CG 3.59Å
739	K	90	Very high	81.5	Confident	28 Å²	28	48.6 Å²	48.6	12%	0.122	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	134.2	165.1	-72.3	-65	-164.7	177.7	0	108.5	I756 S758 L908 T935 V936 I937 L938	K739-I756 VanDerWaalsContact CE-O 3.28Å; K739-I756 WeakPolarHBondContact CE-O 3.49Å; K739-S758 PolarHBondContact NZ-OG 2.68Å; K739-L908 HydrophobicContact CD-CD2 4.37Å; K739-T935 HydrophobicContact CG-CG2 3.96Å; K739-V936 PolarHBondContact N-O 3.43Å; K739-I937 HydrophobicContact CB-CG1 4.47Å; K739-L938 PolarHBondContact O-N 3.05Å
740	K	90.5	Very high	82.5	Confident	53 Å²	53	51.2 Å²	51.2	23%	0.23	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	130.7	165.8	-45.2	-170	-47.6	147.7	0	107.4	L943 L946 K950	K740-L943 PolarHBondContact NZ-O 3.37Å; K740-L946 HydrophobicContact CB-CB 4.46Å; K740-L946 HydrophobicContact CB-CD1 4.46Å; K740-L946 HydrophobicContact CD-CB 4.04Å; K740-L946 WeakPolarHBondContact CD-O 3.19Å; K740-K950 HydrophobicContact CD-CD 4.38Å
741	L	86.1	Confident	82.9	Confident	14 Å²	14	51.7 Å²	51.7	7%	0.073	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	147.3	170.7	-61.1	178.7	0	0	0	108.1	L898 K906 I937 L938 R939 L946	L741-L898 HydrophobicContact CD1-CD1 3.97Å; L741-L898 HydrophobicContact CD2-CD2 4.31Å; L741-K906 HydrophobicContact CD2-CD 4.48Å; L741-I937 HydrophobicContact CD1-CG2 3.66Å; L741-I937 HydrophobicContact CG-CG2 4.11Å; L741-L938 PolarHBondContact N-O 3Å; L741-R939 WeakPolarHBondContact O-CA 3.45Å; L741-L946 VanDerWaalsContact O-CD1 3.24Å; L741-L946 WeakPolarHBondContact O-CD1 3.46Å
742	L	81.8	Confident	83.2	Confident	52 Å²	52	53 Å²	53	27%	0.272	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	126.3	169.5	-60.3	170.1	0	0	0	107.4	P901 D940 L943 L946	L742-P901 HydrophobicContact CB-CG 3.99Å; L742-D940 WeakPolarHBondContact CA-O 3.21Å; L742-L943 HydrophobicContact CD2-CB 4.24Å; L742-L943 HydrophobicContact CD2-CD1 4.42Å; L742-L946 HydrophobicContact CD2-CD1 3.74Å
743	D	78.3	Confident	83.1	Confident	39 Å²	39	55.1 Å²	55.1	21%	0.209	26%	0.26	C	S	.	.			trans	-167.9	137.8	-174.3	178.1	-11.5	0	0	0	107.3	D745 K748 R939 D940	D743-D745 PolarHBondContact O-N 3.4Å; D743-D745 VanDerWaalsContact O-N 3.12Å; D743-K748 WeakPolarHBondContact OD1-CD 3.44Å; D743-K748 IonicContact OD1-NZ 4Å; D743-K748 PolarHBondContact OD1-NZ 3.45Å; D743-K748 WeakPolarHBondContact OD2-CD 3.41Å; D743-R939 HydrophobicContact CB-CB 4.16Å; D743-R939 HydrophobicContact CB-CG 4.39Å; D743-R939 WeakPolarHBondContact OD2-CD 3.44Å; D743-R939 IonicContact OD2-CZ 2.75Å; D743-R939 IonicContact OD2-NE 3.75Å; D743-R939 IonicContact OD2-NH1 3.37Å; D743-R939 PolarHBondContact OD2-NH1 2.87Å; D743-D940 PolarHBondContact N-O 3.23Å; D743-D940 VanDerWaalsContact N-O 3.09Å; D743-D940 CarbonylContact O-C 3.54Å; D743-D940 WeakPolarHBondContact O-CA 3.44Å; D743-D940 PolarHBondContact O-N 3.46Å
744	E	71.6	Confident	83	Confident	151 Å²	151	52 Å²	52	71%	0.706	25%	0.248	S	C	*	.	S	Bend	trans	-65.3	-21	-163.8	-62.6	179.9	157.7	0	0	115	N941	E744-N941 WeakPolarHBondContact CA-OD1 3.38Å; E744-N941 PolarHBondContact O-ND2 3.38Å
745	D	70.5	Confident	83.3	Confident	73 Å²	73	45.6 Å²	45.6	39%	0.39	22%	0.223	S	C	.	.			trans	-108.8	111.6	177.2	-71.8	-76.3	0	0	0	112.4	D743 K747 K748	D743-D745 PolarHBondContact O-N 3.4Å; D743-D745 VanDerWaalsContact O-N 3.12Å; D745-K747 PolarHBondContact O-N 3.43Å; D745-K748 HydrophobicContact CB-CB 4.36Å; D745-K748 HydrophobicContact CB-CD 3.72Å; D745-K748 HydrophobicContact CB-CG 3.69Å; D745-K748 WeakPolarHBondContact O-CB 3.44Å; D745-K748 PolarHBondContact O-N 3.34Å; D745-K748 VanDerWaalsContact O-N 3.14Å; D745-K748 WeakPolarHBondContact OD2-CE 3.45Å; D745-K748 IonicContact OD2-NZ 2.76Å; D745-K748 PolarHBondContact OD2-NZ 3.1Å
746	N	71.1	Confident	83.5	Confident	26 Å²	26	45.6 Å²	45.6	14%	0.139	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-60.7	-29	169.5	71.1	-5.8	0	0	0	113	W662 K748 S749 R939	W662-N746 HydrophobicContact CH2-CB 3.99Å; W662-N746 HydrophobicContact CZ2-CB 3.65Å; N746-K748 PolarHBondContact O-N 3.42Å; N746-S749 VanDerWaalsContact O-CB 3.28Å; N746-S749 WeakPolarHBondContact O-CB 3.38Å; N746-S749 PolarHBondContact O-N 3.33Å; N746-S749 PolarHBondContact O-OG 3.05Å; N746-R939 VanDerWaalsContact CA-O 3.24Å; N746-R939 WeakPolarHBondContact CA-O 3.28Å; N746-R939 WeakPolarHBondContact CB-O 3.24Å
747	K	69.2	Low	83.6	Confident	148 Å²	148	45.6 Å²	45.6	64%	0.643	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-60.4	-21.8	176.2	-66.6	172.7	-174.1	168.2	0	113.7	I665 D745 S749	I665-K747 HydrophobicContact CD1-CG 4.4Å; D745-K747 PolarHBondContact O-N 3.43Å; K747-S749 PolarHBondContact O-N 3.49Å
748	K	77.6	Confident	83.5	Confident	82 Å²	82	45.6 Å²	45.6	36%	0.357	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-76.6	3	173.8	-66	170.3	-173.4	137.7	0	113.5	D743 D745 N746 D750 R939	D743-K748 WeakPolarHBondContact OD1-CD 3.44Å; D743-K748 IonicContact OD1-NZ 4Å; D743-K748 PolarHBondContact OD1-NZ 3.45Å; D743-K748 WeakPolarHBondContact OD2-CD 3.41Å; D745-K748 HydrophobicContact CB-CB 4.36Å; D745-K748 HydrophobicContact CB-CD 3.72Å; D745-K748 HydrophobicContact CB-CG 3.69Å; D745-K748 WeakPolarHBondContact O-CB 3.44Å; D745-K748 PolarHBondContact O-N 3.34Å; D745-K748 VanDerWaalsContact O-N 3.14Å; D745-K748 WeakPolarHBondContact OD2-CE 3.45Å; D745-K748 IonicContact OD2-NZ 2.76Å; D745-K748 PolarHBondContact OD2-NZ 3.1Å; N746-K748 PolarHBondContact O-N 3.42Å; K748-D750 PolarHBondContact O-N 2.94Å; K748-R939 VanDerWaalsContact O-CZ 3.3Å; K748-R939 PolarHBondContact O-NE 3.21Å; K748-R939 PolarHBondContact O-NH2 3.16Å; K748-R939 VanDerWaalsContact O-NH2 3.14Å
749	S	87.6	Confident	83.3	Confident	4 Å²	4	48.2 Å²	48.2	3%	0.028	24%	0.24	C	C	.	.			trans	-64.3	128.5	174.5	-63	0	0	0	0	111.5	N746 K747 I937 R939	N746-S749 VanDerWaalsContact O-CB 3.28Å; N746-S749 WeakPolarHBondContact O-CB 3.38Å; N746-S749 PolarHBondContact O-N 3.33Å; N746-S749 PolarHBondContact O-OG 3.05Å; K747-S749 PolarHBondContact O-N 3.49Å; S749-I937 CarbonylContact C-O 3.51Å; S749-I937 VanDerWaalsContact CA-O 3.23Å; S749-I937 WeakPolarHBondContact CA-O 3.26Å; S749-I937 WeakPolarHBondContact CB-O 3.5Å; S749-R939 PolarHBondContact OG-N 2.89Å; S749-R939 PolarHBondContact OG-O 2.91Å
750	D	87.3	Confident	83.1	Confident	93 Å²	93	54.6 Å²	54.6	50%	0.497	26%	0.264	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.3	164.2	-160.6	-171.9	27	0	0	0	113.3	K748 I937	K748-D750 PolarHBondContact O-N 2.94Å; D750-I937 PolarHBondContact N-O 3.08Å; D750-I937 PolarHBondContact O-N 3.05Å
751	L	88.9	Confident	83.1	Confident	20 Å²	20	52.7 Å²	52.7	11%	0.105	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	113.9	-176.5	172.8	56.7	0	0	0	111.8	L669 N672 V673 P753 A934 V936	L669-L751 HydrophobicContact CD2-CB 4.45Å; N672-L751 VanDerWaalsContact C-CD2 3.46Å; N672-L751 HydrophobicContact CB-CD2 3.71Å; N672-L751 WeakPolarHBondContact O-CD2 3.11Å; V673-L751 HydrophobicContact CG2-CD1 3.58Å; V673-L751 HydrophobicContact CG2-CD2 3.9Å; V673-L751 HydrophobicContact CG2-CG 4.34Å; L751-P753 WeakPolarHBondContact O-CD 3.36Å; L751-A934 HydrophobicContact CD1-CB 3.84Å; L751-V936 HydrophobicContact CD1-CG2 4.09Å
752	F	87.7	Confident	83.2	Confident	39 Å²	39	53.7 Å²	53.7	17%	0.171	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	116.5	167.9	-173.9	-102.4	0	0	0	110.9	G754 I756 F910 K912 T935	F752-G754 VanDerWaalsContact C-N 3.25Å; F752-G754 PolarHBondContact O-N 3.41Å; F752-I756 HydrophobicContact CB-CD1 3.71Å; F752-I756 HydrophobicContact CB-CG1 4.29Å; F752-I756 HydrophobicContact CD1-CD1 3.91Å; F752-I756 HydrophobicContact CD1-CG1 3.56Å; F752-I756 HydrophobicContact CD2-CD1 4.5Å; F752-I756 HydrophobicContact CE1-CG1 4.03Å; F752-I756 HydrophobicContact CG-CD1 3.8Å; F752-I756 HydrophobicContact CG-CG1 4Å; F752-F910 HydrophobicContact CD2-CD1 4.19Å; F752-F910 HydrophobicContact CE1-CB 4.4Å; F752-F910 HydrophobicContact CE1-CD1 4.25Å; F752-F910 AromaticContact CE2-CD1 3.86Å; F752-F910 HydrophobicContact CE2-CD1 3.86Å; F752-F910 HydrophobicContact CZ-CB 3.98Å; F752-F910 AromaticContact CZ-CD1 3.89Å; F752-F910 HydrophobicContact CZ-CD1 3.89Å; F752-F910 HydrophobicContact CZ-CG 4.44Å; F752-K912 HydrophobicContact CZ-CB 4.05Å; F752-K912 HydrophobicContact CZ-CG 4.04Å; F752-T935 WeakPolarHBondContact CB-O 3.24Å; F752-T935 PolarHBondContact N-O 3.34Å; F752-T935 PolarHBondContact O-N 3.15Å
753	P	83.6	Confident	83.5	Confident	48 Å²	48	54.7 Å²	54.7	31%	0.312	27%	0.266	S	S	.	.	S	Bend	trans	-75.7	78.7	174.1	31.5	-35	0	0	0	110.1	T676 L751 K912	T676-P753 HydrophobicContact CG2-CB 3.71Å; L751-P753 WeakPolarHBondContact O-CD 3.36Å; P753-K912 WeakPolarHBondContact O-CG 3.22Å
754	G	84.8	Confident	83.7	Confident	2 Å²	2	62 Å²	62	2%	0.021	30%	0.297	C	S	.	.	S	Bend	trans	160.7	-162.3	-179	0	0	0	0	0	112.5	F752 I911 E933 A934 T935	F752-G754 VanDerWaalsContact C-N 3.25Å; F752-G754 PolarHBondContact O-N 3.41Å; G754-I911 WeakPolarHBondContact CA-O 3.18Å; G754-E933 WeakPolarHBondContact CA-O 3.42Å; G754-E933 PolarHBondContact N-O 2.93Å; G754-E933 VanDerWaalsContact N-O 3.1Å; G754-A934 CarbonylContact O-C 3.49Å; G754-T935 WeakPolarHBondContact O-CB 3.47Å; G754-T935 PolarHBondContact O-N 3.49Å; G754-T935 VanDerWaalsContact O-N 3.07Å; G754-T935 PolarHBondContact O-OG1 2.95Å
755	L	88.1	Confident	84.3	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	126.1	-174.4	171.8	62.6	0	0	0	111.7	F757 R852 I853 M856 F910 I911 T935	L755-F757 HydrophobicContact CD1-CD1 4.3Å; L755-F757 HydrophobicContact CD2-CD1 4.02Å; L755-F757 HydrophobicContact CD2-CE1 4.08Å; L755-F757 HydrophobicContact CG-CD1 3.86Å; L755-F757 HydrophobicContact CG-CE1 4.28Å; L755-R852 HydrophobicContact CD1-CB 4.29Å; L755-R852 HydrophobicContact CD2-CB 4.45Å; L755-I853 HydrophobicContact CD2-CB 4.39Å; L755-I853 HydrophobicContact CD2-CD1 4.36Å; L755-I853 HydrophobicContact CD2-CG1 3.35Å; L755-M856 HydrophobicContact CB-CE 3.62Å; L755-M856 HydrophobicContact CB-SD 3.67Å; L755-M856 HydrophobicContact CD2-CE 3.86Å; L755-M856 HydrophobicContact CG-CE 4.38Å; L755-F910 CarbonylContact O-C 3.49Å; L755-F910 WeakPolarHBondContact O-CA 3.48Å; L755-I911 HydrophobicContact CB-CB 4.41Å; L755-I911 HydrophobicContact CD2-CD1 4.43Å; L755-I911 PolarHBondContact N-O 2.83Å; L755-I911 PolarHBondContact O-N 3.12Å; L755-T935 WeakPolarHBondContact CA-OG1 3.43Å
756	I	88.9	Confident	85.1	Confident	1 Å²	1	58 Å²	58	1%	0.005	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	123.1	166.3	-39.6	168.8	0	0	0	111.4	H737 K739 F752 L908 T909 F910 T935 I937	H737-I756 PolarHBondContact CE1-O 2.82Å; H737-I756 VanDerWaalsContact CE1-O 3.22Å; H737-I756 PolarHBondContact ND1-O 3.12Å; H737-I756 VanDerWaalsContact ND1-O 3.17Å; K739-I756 VanDerWaalsContact CE-O 3.28Å; K739-I756 WeakPolarHBondContact CE-O 3.49Å; F752-I756 HydrophobicContact CB-CD1 3.71Å; F752-I756 HydrophobicContact CB-CG1 4.29Å; F752-I756 HydrophobicContact CD1-CD1 3.91Å; F752-I756 HydrophobicContact CD1-CG1 3.56Å; F752-I756 HydrophobicContact CD2-CD1 4.5Å; F752-I756 HydrophobicContact CE1-CG1 4.03Å; F752-I756 HydrophobicContact CG-CD1 3.8Å; F752-I756 HydrophobicContact CG-CG1 4Å; I756-L908 HydrophobicContact CG2-CB 4Å; I756-L908 HydrophobicContact CG2-CD2 4.01Å; I756-L908 HydrophobicContact CG2-CG 4.45Å; I756-T909 VanDerWaalsContact CA-O 3.29Å; I756-T909 WeakPolarHBondContact CA-O 3.35Å; I756-F910 HydrophobicContact CB-CD1 4.5Å; I756-F910 HydrophobicContact CD1-CD1 3.7Å; I756-F910 HydrophobicContact CD1-CE1 3.45Å; I756-F910 VanDerWaalsContact CD1-CE1 3.45Å; I756-F910 HydrophobicContact CD1-CZ 4.36Å; I756-F910 HydrophobicContact CG1-CD1 3.62Å; I756-F910 HydrophobicContact CG1-CE1 3.86Å; I756-F910 HydrophobicContact CG1-CG 4.35Å; I756-F910 HydrophobicContact CG2-CD1 4.14Å; I756-F910 HydrophobicContact CG2-CD2 4.44Å; I756-F910 HydrophobicContact CG2-CE1 4.06Å; I756-F910 HydrophobicContact CG2-CE2 4.34Å; I756-F910 HydrophobicContact CG2-CG 4.32Å; I756-F910 HydrophobicContact CG2-CZ 4.15Å; I756-T935 HydrophobicContact CB-CG2 3.8Å; I756-T935 HydrophobicContact CD1-CG2 4.02Å; I756-T935 HydrophobicContact CG1-CG2 3.93Å; I756-T935 PolarHBondContact N-OG1 3.21Å; I756-I937 HydrophobicContact CD1-CD1 3.83Å; I756-I937 HydrophobicContact CD1-CG1 4.13Å
757	F	90.3	Very high	85.8	Confident	12 Å²	12	59.8 Å²	59.8	5%	0.053	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	167	173.8	59.8	-77.7	0	0	0	111.6	L755 K759 F821 F842 V849 L908 T909 I911	L755-F757 HydrophobicContact CD1-CD1 4.3Å; L755-F757 HydrophobicContact CD2-CD1 4.02Å; L755-F757 HydrophobicContact CD2-CE1 4.08Å; L755-F757 HydrophobicContact CG-CD1 3.86Å; L755-F757 HydrophobicContact CG-CE1 4.28Å; F757-K759 HydrophobicContact CD2-CB 3.75Å; F757-K759 HydrophobicContact CE2-CB 3.81Å; F757-F821 HydrophobicContact CE2-CE1 4.3Å; F757-F821 AromaticContact CZ-CE1 3.68Å; F757-F821 HydrophobicContact CZ-CE1 3.68Å; F757-F821 HydrophobicContact CZ-CZ 4.29Å; F757-F842 HydrophobicContact CE2-CD1 4.45Å; F757-F842 HydrophobicContact CE2-CE1 4.29Å; F757-V849 HydrophobicContact CB-CG1 4.2Å; F757-V849 HydrophobicContact CB-CG2 4.41Å; F757-V849 HydrophobicContact CD1-CG1 3.96Å; F757-V849 HydrophobicContact CD2-CG1 4.04Å; F757-V849 HydrophobicContact CE1-CG1 4.32Å; F757-V849 HydrophobicContact CE2-CG1 4.4Å; F757-V849 HydrophobicContact CG-CG1 3.81Å; F757-L908 WeakPolarHBondContact O-CA 3.42Å; F757-T909 HydrophobicContact CE1-CG2 3.66Å; F757-T909 HydrophobicContact CE2-CG2 4.14Å; F757-T909 HydrophobicContact CZ-CG2 3.42Å; F757-T909 VanDerWaalsContact CZ-CG2 3.42Å; F757-T909 PolarHBondContact N-O 3.41Å; F757-T909 PolarHBondContact O-N 3.46Å; F757-I911 HydrophobicContact CE1-CD1 3.86Å; F757-I911 HydrophobicContact CE1-CG1 4.23Å; F757-I911 HydrophobicContact CZ-CD1 4.36Å
758	S	86.6	Confident	86.6	Confident	61 Å²	61	56.2 Å²	56.2	43%	0.427	28%	0.283	S	S	.	.			trans	-109.7	99	-179.1	-70.8	0	0	0	0	110.1	K739 F907 L908	K739-S758 PolarHBondContact NZ-OG 2.68Å; S758-F907 WeakPolarHBondContact CA-O 3.42Å; S758-F907 PolarHBondContact OG-O 3.13Å; S758-L908 WeakPolarHBondContact OG-CD2 3.4Å
759	K	88.8	Confident	87.1	Confident	66 Å²	66	55.6 Å²	55.6	29%	0.287	29%	0.286	S	S	.	.			trans	-158.4	160.1	178	-166.5	71.5	-178.5	-165.4	0	107.3	F757 F842 S843 N844 T909	F757-K759 HydrophobicContact CD2-CB 3.75Å; F757-K759 HydrophobicContact CE2-CB 3.81Å; K759-F842 HydrophobicContact CB-CD1 4.25Å; K759-F842 HydrophobicContact CB-CE1 4.33Å; K759-F842 HydrophobicContact CG-CD1 3.75Å; K759-F842 HydrophobicContact CG-CE1 4.28Å; K759-S843 WeakPolarHBondContact CE-O 3.33Å; K759-S843 PolarHBondContact NZ-O 3.18Å; K759-N844 PolarHBondContact NZ-O 2.84Å; K759-T909 PolarHBondContact O-OG1 3.28Å
760	R	86.3	Confident	87.2	Confident	163 Å²	163	57.7 Å²	57.7	62%	0.615	30%	0.296	S	S	*	.			trans	-114	155.7	169.2	64.2	173.6	-167.6	-144.9	1.4	110	F842	R760-F842 VanDerWaalsContact C-CE1 3.49Å; R760-F842 WeakPolarHBondContact O-CD1 3.37Å
761	P	89.8	Confident	87.1	Confident	13 Å²	13	58.9 Å²	58.9	8%	0.084	30%	0.302	C	S	.	.			trans	-51.4	149.9	162.6	-25.4	35.2	0	0	0	111.4	H763 M766 I840 L841 F842 V895	P761-H763 VanDerWaalsContact C-N 3.33Å; P761-H763 PolarHBondContact O-N 2.87Å; P761-M766 HydrophobicContact CB-CB 3.93Å; P761-M766 HydrophobicContact CB-SD 4.23Å; P761-I840 HydrophobicContact CB-CG2 4.18Å; P761-I840 HydrophobicContact CG-CG2 4.26Å; P761-L841 CarbonylContact C-O 3.21Å; P761-L841 WeakPolarHBondContact CA-O 3.49Å; P761-F842 HydrophobicContact CG-CE1 4.36Å; P761-F842 HydrophobicContact CG-CE2 4.5Å; P761-F842 HydrophobicContact CG-CZ 4.01Å; P761-V895 HydrophobicContact CG-CG2 4.41Å
762	T	88.6	Confident	86.9	Confident	35 Å²	35	63 Å²	63	22%	0.215	33%	0.325	C	S	.	.	S	Bend	trans	-66	-35.7	-173.9	-62	0	0	0	0	112.1	Q831 L841 S843	T762-Q831 HydrophobicContact CG2-CG 4.24Å; T762-Q831 VanDerWaalsContact CG2-OE1 3.23Å; T762-L841 HydrophobicContact CG2-CD2 4.3Å; T762-L841 PolarHBondContact N-O 3.22Å; T762-L841 PolarHBondContact OG1-O 3.35Å; T762-S843 WeakPolarHBondContact CG2-OG 3.36Å; T762-S843 PolarHBondContact OG1-N 3.49Å; T762-S843 PolarHBondContact OG1-OG 3.34Å
763	H	87.2	Confident	87.1	Confident	72 Å²	72	61.3 Å²	61.3	33%	0.333	32%	0.317	S	S	.	.	S	Bend	trans	-110	141.7	176	-171.2	-121.8	0	0	0	112	P761 L765 M766 F835	P761-H763 VanDerWaalsContact C-N 3.33Å; P761-H763 PolarHBondContact O-N 2.87Å; H763-L765 VanDerWaalsContact C-N 3.29Å; H763-L765 PolarHBondContact O-N 3.31Å; H763-M766 HydrophobicContact CB-CE 3.89Å; H763-M766 HydrophobicContact CB-CG 4.05Å; H763-M766 HydrophobicContact CB-SD 3.85Å; H763-M766 PolarHBondContact O-N 2.85Å; H763-F835 HydrophobicContact CB-CD2 4.46Å; H763-F835 AromaticContact CE1-CE1 3.54Å; H763-F835 AromaticContact CE1-CE2 3.85Å; H763-F835 AromaticContact CE1-CZ 3.45Å; H763-F835 VanDerWaalsContact CE1-CZ 3.45Å; H763-F835 WeakPolarHBondContact CE1-CZ 3.32Å; H763-F835 AromaticContact ND1-CD1 3.85Å; H763-F835 AromaticContact ND1-CD2 3.44Å; H763-F835 WeakPolarHBondContact ND1-CD2 3.25Å; H763-F835 AromaticContact ND1-CE1 3.65Å; H763-F835 AromaticContact ND1-CE2 3.22Å; H763-F835 WeakPolarHBondContact ND1-CE2 3.47Å; H763-F835 AromaticContact ND1-CG 3.76Å; H763-F835 AromaticContact ND1-CZ 3.34Å; H763-F835 VanDerWaalsContact ND1-CZ 3.34Å; H763-F835 WeakPolarHBondContact ND1-CZ 3.16Å
764	K	82.7	Confident	87.4	Confident	194 Å²	194	64 Å²	64	84%	0.843	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	-29.2	-175.5	-72.7	-173.2	178.9	-178	0	114
765	L	84.8	Confident	87.7	Confident	131 Å²	131	64 Å²	64	69%	0.686	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	9	-177.7	-54.7	-178.7	0	0	0	113.4	H763 F835	H763-L765 VanDerWaalsContact C-N 3.29Å; H763-L765 PolarHBondContact O-N 3.31Å; L765-F835 HydrophobicContact CB-CE2 3.97Å; L765-F835 HydrophobicContact CB-CZ 3.86Å; L765-F835 HydrophobicContact CD1-CZ 4.39Å
766	M	87.9	Confident	87.9	Confident	9 Å²	9	64 Å²	64	4%	0.044	32%	0.321	C	S	.	.	S	Bend	trans	-73.4	140.3	171.6	-77.1	168.1	174.9	0	0	110.2	P761 H763 T768 F835 L841	P761-M766 HydrophobicContact CB-CB 3.93Å; P761-M766 HydrophobicContact CB-SD 4.23Å; H763-M766 HydrophobicContact CB-CE 3.89Å; H763-M766 HydrophobicContact CB-CG 4.05Å; H763-M766 HydrophobicContact CB-SD 3.85Å; H763-M766 PolarHBondContact O-N 2.85Å; M766-T768 PolarHBondContact O-N 2.97Å; M766-F835 HydrophobicContact CE-CB 3.91Å; M766-F835 HydrophobicContact CE-CD2 4.08Å; M766-F835 HydrophobicContact CE-CG 4.43Å; M766-F835 HydrophobicContact CG-CD2 3.99Å; M766-F835 HydrophobicContact CG-CE2 4.46Å; M766-L841 HydrophobicContact CE-CB 3.75Å; M766-L841 HydrophobicContact SD-CB 4.01Å; M766-L841 PolarHBondContact SD-N 3.24Å; M766-L841 VanDerWaalsContact SD-N 3.36Å
767	P	84.6	Confident	88.1	Confident	62 Å²	62	64 Å²	64	40%	0.403	32%	0.321	S	S	.	.			trans	-53.7	139.7	178.7	-27.3	34.4	0	0	0	113	I840	P767-I840 HydrophobicContact CB-CD1 4.26Å; P767-I840 WeakPolarHBondContact O-CD1 3.32Å
768	T	86.8	Confident	88.2	Confident	74 Å²	74	63.4 Å²	63.4	45%	0.454	32%	0.318	S	S	.	.	S	Bend	trans	-92.3	-13.6	178	48.7	0	0	0	0	113.4	M766 E894 V895	M766-T768 PolarHBondContact O-N 2.97Å; T768-E894 CarbonylContact O-C 2.99Å; T768-E894 VanDerWaalsContact O-CA 3.31Å; T768-E894 WeakPolarHBondContact O-CA 3.36Å; T768-V895 HydrophobicContact CG2-CB 4.3Å; T768-V895 PolarHBondContact O-N 3.5Å
769	V	87.9	Confident	88.3	Confident	69 Å²	69	62 Å²	62	42%	0.418	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	135.2	-177.2	-167.8	0	0	0	0	110	F893 E894	V769-F893 CarbonylContact C-O 3.49Å; V769-F893 WeakPolarHBondContact CA-O 3.44Å; V769-E894 HydrophobicContact CG2-CG 4.24Å
770	L	88.9	Confident	88.3	Confident	47 Å²	47	60.2 Å²	60.2	25%	0.246	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	146.7	172	-71.5	-178.3	0	0	0	111.1	P773 N818 I819 I840 F893	L770-P773 HydrophobicContact CB-CB 4.17Å; L770-P773 HydrophobicContact CB-CG 4.16Å; L770-P773 HydrophobicContact CD1-CB 4.04Å; L770-N818 HydrophobicContact CD1-CB 4.15Å; L770-I819 HydrophobicContact CD1-CD1 4.21Å; L770-I819 HydrophobicContact CD1-CG1 3.99Å; L770-I840 HydrophobicContact CD1-CD1 3.44Å; L770-I840 VanDerWaalsContact CD1-CD1 3.44Å; L770-I840 HydrophobicContact CD1-CG1 4.17Å; L770-I840 HydrophobicContact CG-CD1 3.84Å; L770-F893 HydrophobicContact CB-CB 4.42Å; L770-F893 HydrophobicContact CB-CD1 4.25Å; L770-F893 PolarHBondContact N-O 3.11Å; L770-F893 PolarHBondContact O-N 3.21Å
771	N	86.9	Confident	88.4	Confident	118 Å²	118	54.6 Å²	54.6	63%	0.631	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	142.9	170.6	-63.6	-34.2	0	0	0	109.8	P773 N891 H892	N771-P773 VanDerWaalsContact C-N 3.35Å; N771-P773 WeakPolarHBondContact O-CD 3.2Å; N771-N891 WeakPolarHBondContact CA-O 3.27Å; N771-H892 PolarHBondContact OD1-ND1 3.48Å
772	N	84.5	Confident	88.3	Confident	108 Å²	108	54 Å²	54	58%	0.578	28%	0.284	S	S	*	.	S	Bend	trans	49.8	33.8	-178.1	-60.9	-18.6	0	0	0	117	C890 N891	N772-C890 CarbonylContact C-O 3.52Å; N772-C890 WeakPolarHBondContact CA-O 3.3Å; N772-N891 PolarHBondContact N-O 2.82Å; N772-N891 WeakPolarHBondContact OD1-CA 3.39Å; N772-N891 PolarHBondContact OD1-O 3.29Å
773	P	90.3	Very high	88.2	Confident	2 Å²	2	54.1 Å²	54.1	1%	0.013	29%	0.286	C	S	.	.			trans	-68.2	141.4	-175.1	29.5	-37.4	0	0	0	113.6	L770 N771 N818 I819 C890 F893	L770-P773 HydrophobicContact CB-CB 4.17Å; L770-P773 HydrophobicContact CB-CG 4.16Å; L770-P773 HydrophobicContact CD1-CB 4.04Å; N771-P773 VanDerWaalsContact C-N 3.35Å; N771-P773 WeakPolarHBondContact O-CD 3.2Å; P773-N818 HydrophobicContact CB-CB 3.88Å; P773-I819 HydrophobicContact CB-CD1 3.73Å; P773-I819 HydrophobicContact CB-CG1 3.93Å; P773-I819 HydrophobicContact CG-CD1 3.77Å; P773-C890 WeakPolarHBondContact CD-O 3.37Å; P773-F893 HydrophobicContact CG-CB 4Å
774	R	90.2	Very high	88	Confident	106 Å²	106	53 Å²	53	40%	0.4	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	129.9	167.5	-63.1	170.2	65.7	172.2	-0.8	110.1	L815 H816 N818 I819 L887 G888	R774-L815 PolarHBondContact NH2-O 2.82Å; R774-H816 WeakPolarHBondContact CD-O 3.46Å; R774-H816 PolarHBondContact NE-O 3.12Å; R774-N818 WeakPolarHBondContact CB-OD1 3.35Å; R774-N818 PolarHBondContact N-OD1 2.83Å; R774-N818 PolarHBondContact O-N 2.93Å; R774-I819 PolarHBondContact O-N 3.33Å; R774-L887 HydrophobicContact CB-CD1 4.3Å; R774-G888 CarbonylContact C-O 3.54Å; R774-G888 WeakPolarHBondContact CA-O 3.46Å
775	I	92.2	Very high	87.7	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	125.4	-168.7	-65	167.3	0	0	0	110.9	L777 I819 F821 I853 T857 L887 G888 C890	I775-L777 HydrophobicContact CG2-CD2 3.79Å; I775-L777 HydrophobicContact CG2-CG 4.36Å; I775-I819 WeakPolarHBondContact CA-O 3.32Å; I775-I819 HydrophobicContact CG1-CB 4.23Å; I775-I819 HydrophobicContact CG1-CD1 4.41Å; I775-F821 HydrophobicContact CG2-CD2 3.74Å; I775-F821 HydrophobicContact CG2-CE2 3.77Å; I775-I853 HydrophobicContact CG2-CG2 3.96Å; I775-T857 HydrophobicContact CD1-CG2 3.74Å; I775-L887 WeakPolarHBondContact O-CD2 3.21Å; I775-G888 PolarHBondContact N-O 3.31Å; I775-G888 PolarHBondContact O-N 2.86Å; I775-C890 HydrophobicContact CD1-CB 4.34Å
776	L	92.6	Very high	87.2	Confident	1 Å²	1	51.8 Å²	51.8	1%	0.005	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	138.9	171.3	-178.8	61.7	0	0	0	110.7	L778 I812 L815 P817 I819 I820 F821 L862 L887	L776-L778 HydrophobicContact CD1-CD2 4.19Å; L776-L778 HydrophobicContact CD2-CD2 4.09Å; L776-L778 HydrophobicContact CD2-CG 4.42Å; L776-L778 HydrophobicContact CG-CD2 4.01Å; L776-L778 HydrophobicContact CG-CG 4.31Å; L776-I812 HydrophobicContact CD2-CB 4.47Å; L776-I812 HydrophobicContact CD2-CG1 4.17Å; L776-I812 HydrophobicContact CD2-CG2 3.82Å; L776-L815 HydrophobicContact CD1-CD1 4.07Å; L776-L815 HydrophobicContact CD2-CD1 4.3Å; L776-P817 HydrophobicContact CB-CB 3.91Å; L776-P817 HydrophobicContact CB-CG 4.38Å; L776-P817 HydrophobicContact CD2-CG 4.41Å; L776-I819 PolarHBondContact N-O 2.96Å; L776-I820 HydrophobicContact CB-CG1 4.31Å; L776-I820 HydrophobicContact CD2-CG1 4.41Å; L776-I820 WeakPolarHBondContact O-CA 3.44Å; L776-F821 PolarHBondContact O-N 2.91Å; L776-L862 HydrophobicContact CD1-CD1 4.11Å; L776-L887 HydrophobicContact CB-CD2 3.6Å; L776-L887 HydrophobicContact CD1-CD2 3.7Å; L776-L887 HydrophobicContact CG-CD2 4.2Å
777	L	92.9	Very high	86.4	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	123.3	178.8	-53.3	179.8	0	0	0	110.4	I775 F821 L850 I853 A854 A859 I861 L862	I775-L777 HydrophobicContact CG2-CD2 3.79Å; I775-L777 HydrophobicContact CG2-CG 4.36Å; L777-F821 HydrophobicContact CD2-CB 3.81Å; L777-F821 HydrophobicContact CD2-CD2 3.69Å; L777-F821 HydrophobicContact CD2-CG 4.11Å; L777-L850 HydrophobicContact CD2-CD2 4.11Å; L777-I853 HydrophobicContact CD1-CB 4.29Å; L777-I853 HydrophobicContact CD1-CG2 4.25Å; L777-I853 HydrophobicContact CD2-CB 4.12Å; L777-I853 HydrophobicContact CD2-CD1 4.44Å; L777-I853 HydrophobicContact CD2-CG2 3.78Å; L777-A854 HydrophobicContact CD1-CB 3.58Å; L777-A859 HydrophobicContact CD1-CB 3.72Å; L777-A859 HydrophobicContact CG-CB 4.08Å; L777-I861 HydrophobicContact CB-CB 4.45Å; L777-I861 HydrophobicContact CB-CG1 3.94Å; L777-I861 HydrophobicContact CD1-CG1 3.83Å; L777-L862 PolarHBondContact O-N 2.74Å
778	L	91.4	Very high	85.7	Confident	0 Å²	0	59 Å²	59	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	129.7	179.7	-54.5	-178.7	0	0	0	110.3	L776 I782 I812 I820 F821 V822 S823 L862	L776-L778 HydrophobicContact CD1-CD2 4.19Å; L776-L778 HydrophobicContact CD2-CD2 4.09Å; L776-L778 HydrophobicContact CD2-CG 4.42Å; L776-L778 HydrophobicContact CG-CD2 4.01Å; L776-L778 HydrophobicContact CG-CG 4.31Å; L778-I782 HydrophobicContact CD1-CD1 3.79Å; L778-I782 HydrophobicContact CD1-CG1 3.92Å; L778-I812 HydrophobicContact CD1-CD1 4.09Å; L778-I820 HydrophobicContact CD1-CG2 4.17Å; L778-I820 HydrophobicContact CG-CG2 4.45Å; L778-F821 PolarHBondContact N-O 2.69Å; L778-V822 HydrophobicContact CB-CG1 4.44Å; L778-V822 HydrophobicContact CD1-CG2 4.31Å; L778-V822 WeakPolarHBondContact O-CA 3.46Å; L778-S823 PolarHBondContact O-N 2.83Å; L778-L862 HydrophobicContact CD2-CB 3.85Å; L778-L862 HydrophobicContact CD2-CD1 3.84Å; L778-L862 HydrophobicContact CD2-CG 4.33Å
779	D	89.2	Confident	85.1	Confident	33 Å²	33	60.9 Å²	60.9	18%	0.176	33%	0.328	C	S	.	.	S	Bend	trans	-91.5	-19.4	174.7	-139.6	-0.2	0	0	0	113.2	S823 Q847 I861 L862	D779-S823 WeakPolarHBondContact O-CB 3.21Å; D779-S823 WeakPolarHBondContact OD1-CB 3.16Å; D779-S823 PolarHBondContact OD1-OG 2.83Å; D779-Q847 PolarHBondContact OD1-NE2 2.91Å; D779-Q847 PolarHBondContact OD2-NE2 3.4Å; D779-I861 HydrophobicContact CB-CG2 3.91Å; D779-L862 PolarHBondContact N-O 3.23Å
780	S	87.9	Confident	84.2	Confident	27 Å²	27	64.3 Å²	64.3	19%	0.189	34%	0.337	C	S	.	.	S	Bend	trans	-81.2	159.4	171	41.3	0	0	0	0	112.3	V822 D863 S864	S780-V822 WeakPolarHBondContact O-CG1 3.3Å; S780-D863 WeakPolarHBondContact CB-O 3.42Å; S780-D863 PolarHBondContact N-O 2.72Å; S780-D863 PolarHBondContact OG-O 2.83Å; S780-S864 WeakPolarHBondContact OG-CA 3.37Å
781	S	89.1	Confident	83.1	Confident	46 Å²	46	71.1 Å²	71.1	32%	0.322	37%	0.37	S	S	.	.			trans	-74.4	151.9	162.5	52.6	0	0	0	0	111.2	S783 T825	S781-S783 WeakPolarHBondContact CB-OG 3.05Å; S781-S783 PolarHBondContact O-N 3.04Å; S781-S783 PolarHBondContact OG-OG 2.91Å; S781-T825 CarbonylContact C-O 3.6Å; S781-T825 WeakPolarHBondContact CA-O 3.3Å; S781-T825 WeakPolarHBondContact CB-O 3.27Å
782	I	88.8	Confident	82.6	Confident	1 Å²	1	68.2 Å²	68.2	1%	0.005	36%	0.356	C	S	.	.	B	Isolated β-bridge	trans	-95.7	83.9	170.1	-47.1	176.6	0	0	0	107.4	L778 I805 I812 V822 T825 V826 C827 A830 I834 I865	L778-I782 HydrophobicContact CD1-CD1 3.79Å; L778-I782 HydrophobicContact CD1-CG1 3.92Å; I782-I805 HydrophobicContact CG2-CD1 4.36Å; I782-I812 HydrophobicContact CD1-CD1 4.12Å; I782-V822 HydrophobicContact CD1-CG2 3.99Å; I782-V822 HydrophobicContact CG1-CG1 4.31Å; I782-V822 HydrophobicContact CG1-CG2 4.38Å; I782-T825 PolarHBondContact N-O 3.4Å; I782-V826 HydrophobicContact CB-CB 4.4Å; I782-V826 HydrophobicContact CB-CG1 4.06Å; I782-V826 HydrophobicContact CB-CG2 4.17Å; I782-V826 HydrophobicContact CD1-CG1 4.21Å; I782-V826 HydrophobicContact CD1-CG2 3.97Å; I782-V826 HydrophobicContact CG1-CG2 4.05Å; I782-V826 CarbonylContact O-C 3.55Å; I782-V826 WeakPolarHBondContact O-CA 3.49Å; I782-C827 PolarHBondContact O-N 2.78Å; I782-A830 HydrophobicContact CB-CB 4.42Å; I782-A830 HydrophobicContact CG2-CB 3.66Å; I782-I834 HydrophobicContact CD1-CD1 4.05Å; I782-I865 HydrophobicContact CB-CD1 4.3Å; I782-I865 HydrophobicContact CG1-CD1 4.09Å; I782-I865 HydrophobicContact CG2-CD1 3.95Å
783	S	85.2	Confident	82.3	Confident	37 Å²	37	73.7 Å²	73.7	26%	0.259	37%	0.369	S	S	.	.	S	Bend	trans	-154.7	136.6	-171.6	55	0	0	0	0	111	S781 Q785	S781-S783 WeakPolarHBondContact CB-OG 3.05Å; S781-S783 PolarHBondContact O-N 3.04Å; S781-S783 PolarHBondContact OG-OG 2.91Å; S783-Q785 PolarHBondContact O-N 3.16Å
784	Y	84.1	Confident	81.9	Confident	47 Å²	47	78.8 Å²	78.8	18%	0.184	40%	0.396	C	S	.	.			trans	-72.1	116.4	172.6	179.6	-102.4	0	0	0	110.2	R786 Q800 E801 Y804	Y784-R786 HydrophobicContact CD1-CG 3.69Å; Y784-R786 HydrophobicContact CE1-CG 3.82Å; Y784-R786 PolarHBondContact O-N 3.28Å; Y784-Q800 HydrophobicContact CE2-CB 4.22Å; Y784-Q800 PolarHBondContact OH-OE1 3.06Å; Y784-Q800 VanDerWaalsContact OH-OE1 3.08Å; Y784-E801 HydrophobicContact CD1-CB 3.8Å; Y784-E801 HydrophobicContact CD1-CG 4.22Å; Y784-E801 HydrophobicContact CE1-CB 4.4Å; Y784-E801 HydrophobicContact CG-CB 3.88Å; Y784-E801 HydrophobicContact CG-CG 4.09Å; Y784-Y804 AromaticContact CD2-CD1 3.86Å; Y784-Y804 HydrophobicContact CD2-CD1 3.86Å; Y784-Y804 AromaticContact CD2-CG 3.87Å; Y784-Y804 HydrophobicContact CD2-CG 3.87Å
785	Q	76.5	Confident	81.4	Confident	179 Å²	179	79.7 Å²	79.7	84%	0.836	40%	0.404	S	S	*	.			trans	-85.1	99.8	179.9	-176.1	174.3	-10.4	0	0	110.4	S783	S783-Q785 PolarHBondContact O-N 3.16Å
786	R	73.3	Confident	81	Confident	121 Å²	121	82.2 Å²	82.2	46%	0.457	42%	0.422	S	S	.	.			trans	-67	131.6	178.4	-57.6	-176.9	-173.5	-178.2	2.1	111.2	Y784 T788 E801	Y784-R786 HydrophobicContact CD1-CG 3.69Å; Y784-R786 HydrophobicContact CE1-CG 3.82Å; Y784-R786 PolarHBondContact O-N 3.28Å; R786-T788 PolarHBondContact O-N 3.06Å; R786-E801 IonicContact CZ-OE2 2.68Å; R786-E801 VanDerWaalsContact CZ-OE2 3.32Å; R786-E801 IonicContact NE-OE2 3.67Å; R786-E801 PolarHBondContact NE-OE2 3.31Å; R786-E801 VanDerWaalsContact NE-OE2 3.09Å; R786-E801 IonicContact NH2-OE2 3.24Å; R786-E801 PolarHBondContact NH2-OE2 2.96Å
787	T	70.9	Confident	80.4	Confident	93 Å²	93	83.7 Å²	83.7	57%	0.571	43%	0.429	S	S	*	.			trans	-78	95.3	174.5	32.9	0	0	0	0	110.8	S789 K790	T787-S789 PolarHBondContact O-N 3.26Å; T787-K790 PolarHBondContact O-N 3.38Å; T787-K790 VanDerWaalsContact O-N 3.14Å
788	T	69.3	Low	79.8	Confident	129 Å²	129	86.6 Å²	86.6	79%	0.791	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-17.1	-174.8	52.2	0	0	0	0	115.3	R786	R786-T788 PolarHBondContact O-N 3.06Å
789	S	75	Confident	79.4	Confident	115 Å²	115	92.4 Å²	92.4	80%	0.804	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.7	-3.9	179.5	54	0	0	0	0	115	T787	T787-S789 PolarHBondContact O-N 3.26Å
790	K	68.4	Low	79.2	Confident	140 Å²	140	94.8 Å²	94.8	61%	0.609	48%	0.483	S	S	*	.			trans	-124.1	108.6	-178	-166.6	-179.8	-178.6	178.9	0	111.7	T787 T792	T787-K790 PolarHBondContact O-N 3.38Å; T787-K790 VanDerWaalsContact O-N 3.14Å; K790-T792 HydrophobicContact CD-CG2 4.18Å; K790-T792 HydrophobicContact CG-CG2 4.03Å; K790-T792 PolarHBondContact O-N 3.27Å
791	M	66.7	Low	79.1	Confident	190 Å²	190	95 Å²	95	94%	0.936	48%	0.481	S	S	*	.			trans	-66.1	125.5	170.5	-159.9	77.3	89.2	0	0	109.6
792	T	75.5	Confident	79	Confident	57 Å²	57	97.3 Å²	97.3	35%	0.35	49%	0.487	S	S	.	.			trans	-142.7	162	174.8	60.7	0	0	0	0	110.4	K790 L794 Q797	K790-T792 HydrophobicContact CD-CG2 4.18Å; K790-T792 HydrophobicContact CG-CG2 4.03Å; K790-T792 PolarHBondContact O-N 3.27Å; T792-L794 PolarHBondContact O-N 3.26Å; T792-Q797 VanDerWaalsContact OG1-CG 3.23Å; T792-Q797 WeakPolarHBondContact OG1-CG 3.48Å; T792-Q797 PolarHBondContact OG1-NE2 2.74Å
793	W	79.5	Confident	78.9	Confident	223 Å²	223	103.3 Å²	103.3	85%	0.845	52%	0.515	S	S	*	.			trans	-57.3	130.3	177.3	-75.9	89.1	0	0	0	111.6	E795 S796 Q797	W793-E795 VanDerWaalsContact C-N 3.33Å; W793-E795 PolarHBondContact O-N 3.41Å; W793-S796 WeakPolarHBondContact O-CB 3.31Å; W793-S796 PolarHBondContact O-N 2.88Å; W793-S796 VanDerWaalsContact O-N 3.07Å; W793-Q797 PolarHBondContact O-N 2.89Å; W793-Q797 VanDerWaalsContact O-N 3.1Å
794	L	80.4	Confident	79.1	Confident	109 Å²	109	104.9 Å²	104.9	57%	0.571	52%	0.515	S	S	*	.	H	α-helix	trans	-58.1	-44	-175.4	-179.8	61	0	0	0	112.1	T792 S796 Q797 I798	T792-L794 PolarHBondContact O-N 3.26Å; L794-S796 VanDerWaalsContact C-N 3.28Å; L794-S796 PolarHBondContact O-N 3.38Å; L794-Q797 WeakPolarHBondContact O-CA 3.48Å; L794-Q797 WeakPolarHBondContact O-CB 3.46Å; L794-Q797 PolarHBondContact O-N 3.35Å; L794-I798 HydrophobicContact CD1-CD1 4.32Å; L794-I798 HydrophobicContact CD1-CG1 4.42Å; L794-I798 HydrophobicContact CG-CD1 3.97Å; L794-I798 HydrophobicContact CG-CG1 4.49Å; L794-I798 WeakPolarHBondContact O-CG1 3.37Å; L794-I798 PolarHBondContact O-N 2.99Å
795	E	81.1	Confident	79.4	Confident	125 Å²	125	102.7 Å²	102.7	58%	0.584	51%	0.507	S	S	*	.	H	α-helix	trans	-58.6	-40.7	177.3	-162.2	61	-157	0	0	111.7	W793 Q797 I798 M799	W793-E795 VanDerWaalsContact C-N 3.33Å; W793-E795 PolarHBondContact O-N 3.41Å; E795-Q797 VanDerWaalsContact C-N 3.33Å; E795-Q797 PolarHBondContact O-N 2.87Å; E795-I798 PolarHBondContact O-N 3.29Å; E795-M799 WeakPolarHBondContact O-CG 3.38Å; E795-M799 PolarHBondContact O-N 3.01Å
796	S	82.4	Confident	80	Confident	54 Å²	54	96.6 Å²	96.6	38%	0.378	48%	0.482	S	S	.	.	H	α-helix	trans	-67.5	-32.2	175.7	-168.3	0	0	0	0	112.4	W793 L794 Q800	W793-S796 WeakPolarHBondContact O-CB 3.31Å; W793-S796 PolarHBondContact O-N 2.88Å; W793-S796 VanDerWaalsContact O-N 3.07Å; L794-S796 VanDerWaalsContact C-N 3.28Å; L794-S796 PolarHBondContact O-N 3.38Å; S796-Q800 VanDerWaalsContact O-CB 3.26Å; S796-Q800 WeakPolarHBondContact O-CB 3.39Å; S796-Q800 WeakPolarHBondContact O-CG 3.27Å; S796-Q800 PolarHBondContact O-N 3.25Å; S796-Q800 PolarHBondContact O-NE2 3.17Å; S796-Q800 PolarHBondContact OG-NE2 3Å; S796-Q800 VanDerWaalsContact OG-NE2 3.07Å
797	Q	80.5	Confident	80.6	Confident	32 Å²	32	94.1 Å²	94.1	15%	0.15	48%	0.478	C	S	.	.	H	α-helix	trans	-70.1	-38.2	170.9	-65.2	-163.3	4.3	0	0	112.2	T792 W793 L794 E795 Q800 E801	T792-Q797 VanDerWaalsContact OG1-CG 3.23Å; T792-Q797 WeakPolarHBondContact OG1-CG 3.48Å; T792-Q797 PolarHBondContact OG1-NE2 2.74Å; W793-Q797 PolarHBondContact O-N 2.89Å; W793-Q797 VanDerWaalsContact O-N 3.1Å; L794-Q797 WeakPolarHBondContact O-CA 3.48Å; L794-Q797 WeakPolarHBondContact O-CB 3.46Å; L794-Q797 PolarHBondContact O-N 3.35Å; E795-Q797 VanDerWaalsContact C-N 3.33Å; E795-Q797 PolarHBondContact O-N 2.87Å; Q797-Q800 PolarHBondContact O-N 3.39Å; Q797-E801 VanDerWaalsContact O-CB 3.29Å; Q797-E801 WeakPolarHBondContact O-CB 3.42Å; Q797-E801 PolarHBondContact O-N 2.85Å
798	I	81.4	Confident	81.4	Confident	61 Å²	61	89.7 Å²	89.7	31%	0.313	45%	0.451	S	S	.	.	H	α-helix	trans	-65.3	-51.9	177.3	-67.7	168.6	0	0	0	109.6	L794 E795 Q800 E801 E802	L794-I798 HydrophobicContact CD1-CD1 4.32Å; L794-I798 HydrophobicContact CD1-CG1 4.42Å; L794-I798 HydrophobicContact CG-CD1 3.97Å; L794-I798 HydrophobicContact CG-CG1 4.49Å; L794-I798 WeakPolarHBondContact O-CG1 3.37Å; L794-I798 PolarHBondContact O-N 2.99Å; E795-I798 PolarHBondContact O-N 3.29Å; I798-Q800 VanDerWaalsContact C-N 3.32Å; I798-Q800 PolarHBondContact O-N 3.2Å; I798-E801 PolarHBondContact O-N 3.27Å; I798-E801 VanDerWaalsContact O-N 3.12Å; I798-E802 HydrophobicContact CG2-CG 4.44Å; I798-E802 WeakPolarHBondContact O-CG 3.28Å; I798-E802 PolarHBondContact O-N 3.07Å
799	M	82	Confident	82.3	Confident	122 Å²	122	83.8 Å²	83.8	60%	0.601	41%	0.414	S	S	*	.	H	α-helix	trans	-56.9	-43.2	175.7	-67.8	-178.1	79	0	0	112.1	E795 E802 E803	E795-M799 WeakPolarHBondContact O-CG 3.38Å; E795-M799 PolarHBondContact O-N 3.01Å; M799-E802 PolarHBondContact O-N 3.02Å; M799-E803 VanDerWaalsContact O-CB 3.23Å; M799-E803 WeakPolarHBondContact O-CB 3.46Å; M799-E803 PolarHBondContact O-N 3.47Å
800	Q	84.3	Confident	82.8	Confident	82 Å²	82	81 Å²	81	38%	0.383	39%	0.394	S	S	.	.	H	α-helix	trans	-67.3	-36.3	176.2	-75.8	172.6	54.7	0	0	113.2	Y784 S796 Q797 I798 Y804	Y784-Q800 HydrophobicContact CE2-CB 4.22Å; Y784-Q800 PolarHBondContact OH-OE1 3.06Å; Y784-Q800 VanDerWaalsContact OH-OE1 3.08Å; S796-Q800 VanDerWaalsContact O-CB 3.26Å; S796-Q800 WeakPolarHBondContact O-CB 3.39Å; S796-Q800 WeakPolarHBondContact O-CG 3.27Å; S796-Q800 PolarHBondContact O-N 3.25Å; S796-Q800 PolarHBondContact O-NE2 3.17Å; S796-Q800 PolarHBondContact OG-NE2 3Å; S796-Q800 VanDerWaalsContact OG-NE2 3.07Å; Q797-Q800 PolarHBondContact O-N 3.39Å; I798-Q800 VanDerWaalsContact C-N 3.32Å; I798-Q800 PolarHBondContact O-N 3.2Å; Q800-Y804 WeakPolarHBondContact O-CB 3.36Å; Q800-Y804 PolarHBondContact O-N 2.88Å
801	E	86.9	Confident	83.7	Confident	31 Å²	31	76.6 Å²	76.6	15%	0.145	38%	0.375	C	S	.	.	H	α-helix	trans	-68.4	-44.6	175.3	176.3	156	-176.6	0	0	110.9	Y784 R786 Q797 I798 I805	Y784-E801 HydrophobicContact CD1-CB 3.8Å; Y784-E801 HydrophobicContact CD1-CG 4.22Å; Y784-E801 HydrophobicContact CE1-CB 4.4Å; Y784-E801 HydrophobicContact CG-CB 3.88Å; Y784-E801 HydrophobicContact CG-CG 4.09Å; R786-E801 IonicContact CZ-OE2 2.68Å; R786-E801 VanDerWaalsContact CZ-OE2 3.32Å; R786-E801 IonicContact NE-OE2 3.67Å; R786-E801 PolarHBondContact NE-OE2 3.31Å; R786-E801 VanDerWaalsContact NE-OE2 3.09Å; R786-E801 IonicContact NH2-OE2 3.24Å; R786-E801 PolarHBondContact NH2-OE2 2.96Å; Q797-E801 VanDerWaalsContact O-CB 3.29Å; Q797-E801 WeakPolarHBondContact O-CB 3.42Å; Q797-E801 PolarHBondContact O-N 2.85Å; I798-E801 PolarHBondContact O-N 3.27Å; I798-E801 VanDerWaalsContact O-N 3.12Å; E801-I805 HydrophobicContact CG-CG1 4.37Å; E801-I805 WeakPolarHBondContact O-CB 3.39Å; E801-I805 WeakPolarHBondContact O-CG1 3.43Å; E801-I805 PolarHBondContact O-N 3.4Å
802	E	87.5	Confident	84.7	Confident	96 Å²	96	67.5 Å²	67.5	45%	0.449	33%	0.33	S	S	.	.	H	α-helix	trans	-64.2	-44.8	175.2	-67.6	-158.9	151.8	0	0	112.2	I798 M799 T806 L829	I798-E802 HydrophobicContact CG2-CG 4.44Å; I798-E802 WeakPolarHBondContact O-CG 3.28Å; I798-E802 PolarHBondContact O-N 3.07Å; M799-E802 PolarHBondContact O-N 3.02Å; E802-T806 WeakPolarHBondContact O-CB 3.25Å; E802-T806 PolarHBondContact O-N 3.35Å; E802-T806 PolarHBondContact O-OG1 2.82Å; E802-L829 HydrophobicContact CG-CD1 3.86Å
803	E	86.3	Confident	85.2	Confident	127 Å²	127	67.2 Å²	67.2	59%	0.593	33%	0.326	S	S	*	.	H	α-helix	trans	-67.3	-44.4	178.6	-160.3	-156.7	148.6	0	0	111.6	M799 T806 N807	M799-E803 VanDerWaalsContact O-CB 3.23Å; M799-E803 WeakPolarHBondContact O-CB 3.46Å; M799-E803 PolarHBondContact O-N 3.47Å; E803-T806 PolarHBondContact O-N 3.32Å; E803-N807 VanDerWaalsContact O-CB 3.24Å; E803-N807 WeakPolarHBondContact O-CB 3.5Å; E803-N807 PolarHBondContact O-N 3.26Å; E803-N807 PolarHBondContact O-ND2 3.35Å; E803-N807 PolarHBondContact OE1-ND2 3.44Å
804	Y	88.8	Confident	85.5	Confident	70 Å²	70	61.2 Å²	61.2	28%	0.275	32%	0.317	S	S	.	.	H	α-helix	trans	-62.9	-46.9	176.4	176.6	-97	0	0	0	111.4	Y784 Q800 N807 C808	Y784-Y804 AromaticContact CD2-CD1 3.86Å; Y784-Y804 HydrophobicContact CD2-CD1 3.86Å; Y784-Y804 AromaticContact CD2-CG 3.87Å; Y784-Y804 HydrophobicContact CD2-CG 3.87Å; Q800-Y804 WeakPolarHBondContact O-CB 3.36Å; Q800-Y804 PolarHBondContact O-N 2.88Å; Y804-N807 PolarHBondContact O-N 3.48Å; Y804-C808 VanDerWaalsContact CZ-SG 3.52Å; Y804-C808 VanDerWaalsContact O-CB 3.28Å; Y804-C808 WeakPolarHBondContact O-CB 3.49Å; Y804-C808 PolarHBondContact O-N 2.75Å; Y804-C808 PolarHBondContact O-SG 2.95Å; Y804-C808 VanDerWaalsContact O-SG 3.34Å
805	I	90.5	Very high	85.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-66.7	-41.5	179.4	-69.1	-62.7	0	0	0	111.1	I782 E801 C808 V809 C827 L829 A830 F833	I782-I805 HydrophobicContact CG2-CD1 4.36Å; E801-I805 HydrophobicContact CG-CG1 4.37Å; E801-I805 WeakPolarHBondContact O-CB 3.39Å; E801-I805 WeakPolarHBondContact O-CG1 3.43Å; E801-I805 PolarHBondContact O-N 3.4Å; I805-C808 PolarHBondContact O-N 3.34Å; I805-V809 HydrophobicContact CG2-CG2 4.38Å; I805-V809 WeakPolarHBondContact O-CG2 3.42Å; I805-V809 PolarHBondContact O-N 2.84Å; I805-C827 VanDerWaalsContact CD1-SG 3.51Å; I805-L829 HydrophobicContact CG2-CB 3.99Å; I805-A830 HydrophobicContact CG2-CB 3.84Å; I805-F833 HydrophobicContact CG2-CD2 4.41Å
806	T	88.3	Confident	86	Confident	52 Å²	52	57.9 Å²	57.9	32%	0.319	30%	0.3	S	S	.	.	H	α-helix	trans	-60.7	-49.9	174.7	-59.8	0	0	0	0	110.4	E802 E803 C808 V809 C810	E802-T806 WeakPolarHBondContact O-CB 3.25Å; E802-T806 PolarHBondContact O-N 3.35Å; E802-T806 PolarHBondContact O-OG1 2.82Å; E803-T806 PolarHBondContact O-N 3.32Å; T806-C808 VanDerWaalsContact C-N 3.33Å; T806-C808 PolarHBondContact O-N 3.27Å; T806-V809 PolarHBondContact O-N 3.5Å; T806-C810 WeakPolarHBondContact O-CB 3.44Å; T806-C810 PolarHBondContact O-N 3.45Å; T806-C810 PolarHBondContact O-SG 2.78Å
807	N	86.3	Confident	86.5	Confident	69 Å²	69	55.5 Å²	55.5	37%	0.369	28%	0.283	S	S	.	.	H	α-helix	trans	-58.7	-41.5	175.7	-84.6	-53.6	0	0	0	112.5	E803 Y804 K811	E803-N807 VanDerWaalsContact O-CB 3.24Å; E803-N807 WeakPolarHBondContact O-CB 3.5Å; E803-N807 PolarHBondContact O-N 3.26Å; E803-N807 PolarHBondContact O-ND2 3.35Å; E803-N807 PolarHBondContact OE1-ND2 3.44Å; Y804-N807 PolarHBondContact O-N 3.48Å; N807-K811 WeakPolarHBondContact O-CD 3.42Å; N807-K811 WeakPolarHBondContact O-CE 3.41Å; N807-K811 WeakPolarHBondContact O-CG 3.1Å; N807-K811 PolarHBondContact O-N 3.33Å
808	C	87.6	Confident	87.1	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68	-40.2	177.8	-78	0	0	0	0	112.8	Y804 I805 T806 I812 I865	Y804-C808 VanDerWaalsContact CZ-SG 3.52Å; Y804-C808 VanDerWaalsContact O-CB 3.28Å; Y804-C808 WeakPolarHBondContact O-CB 3.49Å; Y804-C808 PolarHBondContact O-N 2.75Å; Y804-C808 PolarHBondContact O-SG 2.95Å; Y804-C808 VanDerWaalsContact O-SG 3.34Å; I805-C808 PolarHBondContact O-N 3.34Å; T806-C808 VanDerWaalsContact C-N 3.33Å; T806-C808 PolarHBondContact O-N 3.27Å; C808-I812 WeakPolarHBondContact O-CG1 3.41Å; C808-I812 PolarHBondContact O-N 2.92Å; C808-I865 HydrophobicContact CB-CD1 4.05Å; C808-I865 HydrophobicContact CB-CG2 4.09Å
809	V	89.2	Confident	87.7	Confident	4 Å²	4	54.3 Å²	54.3	2%	0.024	28%	0.278	C	S	.	.	H	α-helix	trans	-68.8	-42.5	173.8	177	0	0	0	0	110.8	I805 T806 K811 I812 L813 A830 F833 I834	I805-V809 HydrophobicContact CG2-CG2 4.38Å; I805-V809 WeakPolarHBondContact O-CG2 3.42Å; I805-V809 PolarHBondContact O-N 2.84Å; T806-V809 PolarHBondContact O-N 3.5Å; V809-K811 VanDerWaalsContact C-N 3.34Å; V809-K811 PolarHBondContact O-N 3.03Å; V809-I812 CarbonylContact O-C 3.03Å; V809-I812 WeakPolarHBondContact O-CA 3.44Å; V809-I812 WeakPolarHBondContact O-CB 3.49Å; V809-I812 PolarHBondContact O-N 3.26Å; V809-L813 HydrophobicContact CG1-CD1 3.99Å; V809-L813 HydrophobicContact CG1-CG 4.01Å; V809-L813 WeakPolarHBondContact O-CG 3.2Å; V809-L813 PolarHBondContact O-N 3.05Å; V809-A830 HydrophobicContact CG2-CB 4.06Å; V809-F833 HydrophobicContact CB-CB 4.39Å; V809-F833 HydrophobicContact CG1-CB 3.82Å; V809-F833 HydrophobicContact CG2-CB 4.32Å; V809-I834 HydrophobicContact CG1-CG1 4.18Å; V809-I834 HydrophobicContact CG2-CG1 4.39Å
810	C	86.2	Confident	88.2	Confident	58 Å²	58	48.5 Å²	48.5	39%	0.392	25%	0.249	S	C	.	.	H	α-helix	trans	-55.8	-45.4	174.7	-72.7	0	0	0	0	112.2	T806 I812 L813 C814	T806-C810 WeakPolarHBondContact O-CB 3.44Å; T806-C810 PolarHBondContact O-N 3.45Å; T806-C810 PolarHBondContact O-SG 2.78Å; C810-I812 VanDerWaalsContact C-N 3.29Å; C810-I812 PolarHBondContact O-N 3.28Å; C810-L813 PolarHBondContact O-N 3.09Å; C810-L813 VanDerWaalsContact O-N 3.15Å; C810-C814 PolarHBondContact O-N 2.74Å; C810-C814 PolarHBondContact O-SG 2.82Å
811	K	85.9	Confident	88.7	Confident	46 Å²	46	44.6 Å²	44.6	20%	0.2	23%	0.231	C	C	.	.	H	α-helix	trans	-58.9	-38.3	174.3	-66.8	159.4	-151.4	170.7	0	112.6	N807 V809 L868 M869	N807-K811 WeakPolarHBondContact O-CD 3.42Å; N807-K811 WeakPolarHBondContact O-CE 3.41Å; N807-K811 WeakPolarHBondContact O-CG 3.1Å; N807-K811 PolarHBondContact O-N 3.33Å; V809-K811 VanDerWaalsContact C-N 3.34Å; V809-K811 PolarHBondContact O-N 3.03Å; K811-L868 HydrophobicContact CB-CD1 4.44Å; K811-M869 HydrophobicContact CD-CG 4.23Å; K811-M869 HydrophobicContact CD-SD 3.78Å; K811-M869 WeakPolarHBondContact CE-SD 3.37Å; K811-M869 PolarHBondContact NZ-SD 2.75Å
812	I	88.9	Confident	89	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-68.3	-42.8	175.4	-71.2	166.4	0	0	0	110.8	L776 L778 I782 C808 V809 C810 C814 L815 P817 I820 I865	L776-I812 HydrophobicContact CD2-CB 4.47Å; L776-I812 HydrophobicContact CD2-CG1 4.17Å; L776-I812 HydrophobicContact CD2-CG2 3.82Å; L778-I812 HydrophobicContact CD1-CD1 4.09Å; I782-I812 HydrophobicContact CD1-CD1 4.12Å; C808-I812 WeakPolarHBondContact O-CG1 3.41Å; C808-I812 PolarHBondContact O-N 2.92Å; V809-I812 CarbonylContact O-C 3.03Å; V809-I812 WeakPolarHBondContact O-CA 3.44Å; V809-I812 WeakPolarHBondContact O-CB 3.49Å; V809-I812 PolarHBondContact O-N 3.26Å; C810-I812 VanDerWaalsContact C-N 3.29Å; C810-I812 PolarHBondContact O-N 3.28Å; I812-C814 VanDerWaalsContact C-N 3.35Å; I812-C814 PolarHBondContact O-N 3.27Å; I812-L815 WeakPolarHBondContact O-CB 3.48Å; I812-L815 PolarHBondContact O-N 3.35Å; I812-L815 VanDerWaalsContact O-N 3.15Å; I812-P817 HydrophobicContact CG2-CG 4.1Å; I812-P817 WeakPolarHBondContact O-CD 3.02Å; I812-I820 HydrophobicContact CG2-CD1 3.55Å; I812-I820 HydrophobicContact CG2-CG1 4.37Å; I812-I865 HydrophobicContact CD1-CD1 4.38Å
813	L	86	Confident	89.2	Confident	51 Å²	51	39.9 Å²	39.9	27%	0.267	21%	0.212	S	C	.	.	H	α-helix	trans	-64.6	-35.7	177.7	-66	178.3	0	0	0	112.3	V809 C810 L815 H816 S837 I839	V809-L813 HydrophobicContact CG1-CD1 3.99Å; V809-L813 HydrophobicContact CG1-CG 4.01Å; V809-L813 WeakPolarHBondContact O-CG 3.2Å; V809-L813 PolarHBondContact O-N 3.05Å; C810-L813 PolarHBondContact O-N 3.09Å; C810-L813 VanDerWaalsContact O-N 3.15Å; L813-L815 PolarHBondContact O-N 2.68Å; L813-L815 VanDerWaalsContact O-N 3.15Å; L813-H816 WeakPolarHBondContact O-CA 3.37Å; L813-H816 PolarHBondContact O-N 3.35Å; L813-S837 WeakPolarHBondContact CD2-OG 3.35Å; L813-I839 HydrophobicContact CD2-CD1 3.4Å
814	C	85.1	Confident	89.3	Confident	97 Å²	97	34.9 Å²	34.9	66%	0.655	20%	0.195	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60	-20.8	173.6	-68	0	0	0	0	113.9	C810 I812 H816	C810-C814 PolarHBondContact O-N 2.74Å; C810-C814 PolarHBondContact O-SG 2.82Å; I812-C814 VanDerWaalsContact C-N 3.35Å; I812-C814 PolarHBondContact O-N 3.27Å; C814-H816 VanDerWaalsContact C-N 3.33Å; C814-H816 PolarHBondContact O-CD2 2.84Å
815	L	84.4	Confident	89.4	Confident	36 Å²	36	35.1 Å²	35.1	19%	0.188	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.3	-14.1	172.6	-58.6	177.1	0	0	0	112.6	R774 L776 I812 L813 L868 L887	R774-L815 PolarHBondContact NH2-O 2.82Å; L776-L815 HydrophobicContact CD1-CD1 4.07Å; L776-L815 HydrophobicContact CD2-CD1 4.3Å; I812-L815 WeakPolarHBondContact O-CB 3.48Å; I812-L815 PolarHBondContact O-N 3.35Å; I812-L815 VanDerWaalsContact O-N 3.15Å; L813-L815 PolarHBondContact O-N 2.68Å; L813-L815 VanDerWaalsContact O-N 3.15Å; L815-L868 HydrophobicContact CD1-CD1 4.15Å; L815-L868 HydrophobicContact CD1-CD2 4Å; L815-L868 HydrophobicContact CD2-CD2 4.36Å; L815-L887 HydrophobicContact CB-CD1 4.09Å; L815-L887 WeakPolarHBondContact O-CD1 3.41Å
816	H	88.1	Confident	89.4	Confident	128 Å²	128	35.6 Å²	35.6	59%	0.593	21%	0.206	S	C	*	.			trans	48.5	57.1	-171.7	-56.9	-91.6	0	0	0	114.8	R774 L813 C814	R774-H816 WeakPolarHBondContact CD-O 3.46Å; R774-H816 PolarHBondContact NE-O 3.12Å; L813-H816 WeakPolarHBondContact O-CA 3.37Å; L813-H816 PolarHBondContact O-N 3.35Å; C814-H816 VanDerWaalsContact C-N 3.33Å; C814-H816 PolarHBondContact O-CD2 2.84Å
817	P	92.8	Very high	89.5	Confident	3 Å²	3	34.2 Å²	34.2	2%	0.019	20%	0.199	C	C	.	.			trans	-78.3	147	170.7	34.2	-33	0	0	0	111.2	L776 I812 I820 I839 L887	L776-P817 HydrophobicContact CB-CB 3.91Å; L776-P817 HydrophobicContact CB-CG 4.38Å; L776-P817 HydrophobicContact CD2-CG 4.41Å; I812-P817 HydrophobicContact CG2-CG 4.1Å; I812-P817 WeakPolarHBondContact O-CD 3.02Å; P817-I820 HydrophobicContact CB-CG1 4.38Å; P817-I820 HydrophobicContact CG-CD1 4.36Å; P817-I820 HydrophobicContact CG-CG1 4.08Å; P817-I839 HydrophobicContact CG-CD1 4.38Å; P817-I839 WeakPolarHBondContact O-CD1 3.34Å; P817-I839 WeakPolarHBondContact O-CG1 3.22Å; P817-L887 HydrophobicContact CB-CD1 4.47Å; P817-L887 HydrophobicContact CB-CD2 4.32Å
818	N	92.4	Very high	89.7	Confident	68 Å²	68	39 Å²	39	36%	0.364	21%	0.213	S	C	.	.	S	Bend	trans	-93.2	-25.7	170.6	-55.3	103.6	0	0	0	112.1	L770 P773 R774 I840	L770-N818 HydrophobicContact CD1-CB 4.15Å; P773-N818 HydrophobicContact CB-CB 3.88Å; R774-N818 WeakPolarHBondContact CB-OD1 3.35Å; R774-N818 PolarHBondContact N-OD1 2.83Å; R774-N818 PolarHBondContact O-N 2.93Å; N818-I840 PolarHBondContact O-N 3.4Å
819	I	93.6	Very high	89.8	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	136	178.6	-47.4	179.5	0	0	0	109.6	L770 P773 R774 I775 L776 F821 I840 F842 F893	L770-I819 HydrophobicContact CD1-CD1 4.21Å; L770-I819 HydrophobicContact CD1-CG1 3.99Å; P773-I819 HydrophobicContact CB-CD1 3.73Å; P773-I819 HydrophobicContact CB-CG1 3.93Å; P773-I819 HydrophobicContact CG-CD1 3.77Å; R774-I819 PolarHBondContact O-N 3.33Å; I775-I819 WeakPolarHBondContact CA-O 3.32Å; I775-I819 HydrophobicContact CG1-CB 4.23Å; I775-I819 HydrophobicContact CG1-CD1 4.41Å; L776-I819 PolarHBondContact N-O 2.96Å; I819-F821 HydrophobicContact CB-CE2 4.31Å; I819-F821 HydrophobicContact CG2-CD2 4.03Å; I819-F821 HydrophobicContact CG2-CE1 4.42Å; I819-F821 HydrophobicContact CG2-CE2 3.42Å; I819-F821 VanDerWaalsContact CG2-CE2 3.42Å; I819-F821 HydrophobicContact CG2-CZ 3.64Å; I819-I840 CarbonylContact C-O 3.24Å; I819-I840 WeakPolarHBondContact CA-O 3.18Å; I819-I840 HydrophobicContact CB-CB 4.47Å; I819-I840 HydrophobicContact CD1-CD1 4.44Å; I819-I840 HydrophobicContact CG1-CB 4.21Å; I819-I840 HydrophobicContact CG1-CD1 4.26Å; I819-I840 HydrophobicContact CG2-CB 4.17Å; I819-I840 HydrophobicContact CG2-CG2 4.31Å; I819-F842 HydrophobicContact CG2-CD2 4.15Å; I819-F842 HydrophobicContact CG2-CE2 4.26Å; I819-F893 HydrophobicContact CD1-CB 4.06Å; I819-F893 HydrophobicContact CD1-CD1 4Å; I819-F893 HydrophobicContact CD1-CD2 3.48Å; I819-F893 VanDerWaalsContact CD1-CD2 3.48Å; I819-F893 HydrophobicContact CD1-CE1 4.35Å; I819-F893 HydrophobicContact CD1-CE2 3.87Å; I819-F893 HydrophobicContact CD1-CG 3.57Å; I819-F893 HydrophobicContact CD1-CZ 4.29Å
820	I	93.2	Very high	89.8	Confident	0 Å²	0	41 Å²	41	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	125.2	174.5	-56.4	164	0	0	0	108.9	L776 L778 I812 P817 V822 I834 I839 I840 L841 F842	L776-I820 HydrophobicContact CB-CG1 4.31Å; L776-I820 HydrophobicContact CD2-CG1 4.41Å; L776-I820 WeakPolarHBondContact O-CA 3.44Å; L778-I820 HydrophobicContact CD1-CG2 4.17Å; L778-I820 HydrophobicContact CG-CG2 4.45Å; I812-I820 HydrophobicContact CG2-CD1 3.55Å; I812-I820 HydrophobicContact CG2-CG1 4.37Å; P817-I820 HydrophobicContact CB-CG1 4.38Å; P817-I820 HydrophobicContact CG-CD1 4.36Å; P817-I820 HydrophobicContact CG-CG1 4.08Å; I820-V822 HydrophobicContact CG2-CG2 3.77Å; I820-I834 HydrophobicContact CD1-CD1 4.05Å; I820-I834 HydrophobicContact CD1-CG1 4.28Å; I820-I834 HydrophobicContact CD1-CG2 3.98Å; I820-I839 HydrophobicContact CD1-CG2 3.67Å; I820-I839 HydrophobicContact CG1-CG2 3.78Å; I820-I840 PolarHBondContact N-O 2.79Å; I820-L841 HydrophobicContact CB-CD1 4Å; I820-L841 HydrophobicContact CG2-CD1 4.05Å; I820-F842 PolarHBondContact O-N 3.17Å
821	F	94.6	Very high	90.1	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	130.8	168.4	-60.5	-89.4	0	0	0	110.2	F757 I775 L776 L777 L778 I819 F842 V845 L850 I853 F893 I911	F757-F821 HydrophobicContact CE2-CE1 4.3Å; F757-F821 AromaticContact CZ-CE1 3.68Å; F757-F821 HydrophobicContact CZ-CE1 3.68Å; F757-F821 HydrophobicContact CZ-CZ 4.29Å; I775-F821 HydrophobicContact CG2-CD2 3.74Å; I775-F821 HydrophobicContact CG2-CE2 3.77Å; L776-F821 PolarHBondContact O-N 2.91Å; L777-F821 HydrophobicContact CD2-CB 3.81Å; L777-F821 HydrophobicContact CD2-CD2 3.69Å; L777-F821 HydrophobicContact CD2-CG 4.11Å; L778-F821 PolarHBondContact N-O 2.69Å; I819-F821 HydrophobicContact CB-CE2 4.31Å; I819-F821 HydrophobicContact CG2-CD2 4.03Å; I819-F821 HydrophobicContact CG2-CE1 4.42Å; I819-F821 HydrophobicContact CG2-CE2 3.42Å; I819-F821 VanDerWaalsContact CG2-CE2 3.42Å; I819-F821 HydrophobicContact CG2-CZ 3.64Å; F821-F842 HydrophobicContact CD1-CB 3.52Å; F821-F842 AromaticContact CD1-CD2 3.72Å; F821-F842 HydrophobicContact CD1-CD2 3.72Å; F821-F842 AromaticContact CD1-CG 3.72Å; F821-F842 HydrophobicContact CD1-CG 3.72Å; F821-F842 HydrophobicContact CE1-CB 3.92Å; F821-F842 HydrophobicContact CE1-CD1 4.2Å; F821-F842 AromaticContact CE1-CD2 3.24Å; F821-F842 HydrophobicContact CE1-CD2 3.24Å; F821-F842 AromaticContact CE1-CE2 3.65Å; F821-F842 HydrophobicContact CE1-CE2 3.65Å; F821-F842 AromaticContact CE1-CG 3.55Å; F821-F842 HydrophobicContact CE1-CG 3.55Å; F821-F842 HydrophobicContact CE1-CZ 4.27Å; F821-F842 HydrophobicContact CG-CB 4.39Å; F821-F842 AromaticContact CZ-CD2 3.86Å; F821-F842 HydrophobicContact CZ-CD2 3.86Å; F821-F842 AromaticContact CZ-CE2 3.99Å; F821-F842 HydrophobicContact CZ-CE2 3.99Å; F821-V845 HydrophobicContact CB-CG2 4.36Å; F821-V845 HydrophobicContact CD1-CG2 4.16Å; F821-L850 HydrophobicContact CB-CD2 3.44Å; F821-L850 VanDerWaalsContact CB-CD2 3.44Å; F821-L850 HydrophobicContact CG-CD2 4.47Å; F821-I853 HydrophobicContact CB-CD1 4.48Å; F821-I853 HydrophobicContact CD1-CD1 3.79Å; F821-I853 HydrophobicContact CD2-CD1 3.87Å; F821-I853 HydrophobicContact CE1-CD1 3.94Å; F821-I853 HydrophobicContact CE2-CD1 3.98Å; F821-I853 HydrophobicContact CE2-CG2 4.41Å; F821-I853 HydrophobicContact CG-CD1 3.78Å; F821-I853 HydrophobicContact CZ-CD1 4.02Å; F821-F893 HydrophobicContact CZ-CE2 4.39Å; F821-I911 HydrophobicContact CE2-CD1 4.4Å; F821-I911 HydrophobicContact CZ-CD1 3.88Å
822	V	93.8	Very high	90.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	126.5	-175.8	-168.6	0	0	0	0	109.6	L778 S780 I782 I820 V826 L841 F842 N844 V845	L778-V822 HydrophobicContact CB-CG1 4.44Å; L778-V822 HydrophobicContact CD1-CG2 4.31Å; L778-V822 WeakPolarHBondContact O-CA 3.46Å; S780-V822 WeakPolarHBondContact O-CG1 3.3Å; I782-V822 HydrophobicContact CD1-CG2 3.99Å; I782-V822 HydrophobicContact CG1-CG1 4.31Å; I782-V822 HydrophobicContact CG1-CG2 4.38Å; I820-V822 HydrophobicContact CG2-CG2 3.77Å; V822-V826 HydrophobicContact CB-CG2 4.02Å; V822-V826 HydrophobicContact CG1-CG2 3.95Å; V822-V826 HydrophobicContact CG2-CG2 3.79Å; V822-L841 HydrophobicContact CG2-CD1 3.88Å; V822-F842 PolarHBondContact N-O 2.84Å; V822-N844 PolarHBondContact O-N 3.41Å; V822-V845 WeakPolarHBondContact O-CB 3.39Å; V822-V845 WeakPolarHBondContact O-CG2 3.25Å; V822-V845 PolarHBondContact O-N 2.8Å
823	S	91.3	Very high	90.3	Very high	29 Å²	29	44.7 Å²	44.7	20%	0.203	24%	0.236	C	C	.	.	S	Bend	trans	-65.3	-47.3	180	-153.4	0	0	0	0	111.2	L778 D779 N844 V845 L850	L778-S823 PolarHBondContact O-N 2.83Å; D779-S823 WeakPolarHBondContact O-CB 3.21Å; D779-S823 WeakPolarHBondContact OD1-CB 3.16Å; D779-S823 PolarHBondContact OD1-OG 2.83Å; S823-N844 WeakPolarHBondContact O-CA 3.41Å; S823-V845 WeakPolarHBondContact CA-O 3.17Å; S823-V845 PolarHBondContact O-N 3.02Å; S823-L850 VanDerWaalsContact CB-CD1 3.45Å
824	G	89.3	Confident	90.6	Very high	22 Å²	22	42.3 Å²	42.3	23%	0.227	22%	0.224	C	C	.	.	S	Bend	trans	-91.4	-161.8	174.9	0	0	0	0	0	114.7	N844	G824-N844 PolarHBondContact O-N 3.44Å; G824-N844 PolarHBondContact O-OD1 2.82Å; G824-N844 VanDerWaalsContact O-OD1 3.11Å
825	T	89.5	Confident	90.8	Very high	75 Å²	75	41 Å²	41	46%	0.46	21%	0.207	S	C	.	.			trans	-76.2	166	179.3	47.2	0	0	0	0	112.5	S781 I782 N844	S781-T825 CarbonylContact C-O 3.6Å; S781-T825 WeakPolarHBondContact CA-O 3.3Å; S781-T825 WeakPolarHBondContact CB-O 3.27Å; I782-T825 PolarHBondContact N-O 3.4Å; T825-N844 VanDerWaalsContact CA-OD1 3.32Å; T825-N844 WeakPolarHBondContact CA-OD1 3.2Å; T825-N844 VanDerWaalsContact CG2-OD1 3.27Å; T825-N844 WeakPolarHBondContact CG2-OD1 3.47Å; T825-N844 PolarHBondContact N-OD1 3.45Å
826	V	91.8	Very high	91	Very high	9 Å²	9	47.7 Å²	47.7	6%	0.055	24%	0.235	C	C	.	.	B	Isolated β-bridge	trans	-133.2	127.8	173.3	177.8	0	0	0	0	106.9	I782 V822 A830 Q831 L841	I782-V826 HydrophobicContact CB-CB 4.4Å; I782-V826 HydrophobicContact CB-CG1 4.06Å; I782-V826 HydrophobicContact CB-CG2 4.17Å; I782-V826 HydrophobicContact CD1-CG1 4.21Å; I782-V826 HydrophobicContact CD1-CG2 3.97Å; I782-V826 HydrophobicContact CG1-CG2 4.05Å; I782-V826 CarbonylContact O-C 3.55Å; I782-V826 WeakPolarHBondContact O-CA 3.49Å; V822-V826 HydrophobicContact CB-CG2 4.02Å; V822-V826 HydrophobicContact CG1-CG2 3.95Å; V822-V826 HydrophobicContact CG2-CG2 3.79Å; V826-A830 HydrophobicContact CG1-CB 3.6Å; V826-Q831 HydrophobicContact CB-CG 4.04Å; V826-Q831 HydrophobicContact CG1-CG 3.64Å; V826-Q831 PolarHBondContact O-NE2 3.27Å; V826-L841 HydrophobicContact CB-CD2 4.19Å; V826-L841 HydrophobicContact CG1-CD2 3.87Å; V826-L841 HydrophobicContact CG2-CD1 4.3Å; V826-L841 HydrophobicContact CG2-CD2 4.19Å
827	C	90.3	Very high	90.9	Very high	23 Å²	23	44.3 Å²	44.3	16%	0.155	23%	0.225	C	C	.	.			trans	-66.9	156.7	179.6	74.2	0	0	0	0	111.5	I782 I805 L829 A830 Q831	I782-C827 PolarHBondContact O-N 2.78Å; I805-C827 VanDerWaalsContact CD1-SG 3.51Å; C827-L829 VanDerWaalsContact C-N 3.31Å; C827-L829 PolarHBondContact O-N 2.84Å; C827-A830 PolarHBondContact O-N 2.85Å; C827-A830 VanDerWaalsContact O-N 3.14Å; C827-A830 PolarHBondContact SG-N 3.29Å; C827-Q831 WeakPolarHBondContact O-CG 3.4Å; C827-Q831 PolarHBondContact O-N 2.84Å
828	Y	90	Very high	90.7	Very high	169 Å²	169	46.9 Å²	46.9	66%	0.663	25%	0.252	S	S	*	.	H	α-helix	trans	-58.8	-40.3	-174.8	175.5	-119.4	0	0	0	113.1	A830 Q831 N832	Y828-A830 PolarHBondContact O-N 3.43Å; Y828-Q831 PolarHBondContact O-N 3.43Å; Y828-N832 WeakPolarHBondContact CE1-ND2 3.41Å; Y828-N832 WeakPolarHBondContact CE2-ND2 3.27Å; Y828-N832 WeakPolarHBondContact CE2-OD1 3.45Å; Y828-N832 PolarHBondContact O-N 3.48Å; Y828-N832 PolarHBondContact OH-ND2 3.38Å
829	L	88.7	Confident	90.7	Very high	47 Å²	47	44.2 Å²	44.2	25%	0.246	24%	0.238	C	C	.	.	H	α-helix	trans	-57.4	-49.6	174.3	-66.1	170.2	0	0	0	111.7	E802 I805 C827 Q831 N832 F833	E802-L829 HydrophobicContact CG-CD1 3.86Å; I805-L829 HydrophobicContact CG2-CB 3.99Å; C827-L829 VanDerWaalsContact C-N 3.31Å; C827-L829 PolarHBondContact O-N 2.84Å; L829-Q831 PolarHBondContact O-N 2.81Å; L829-N832 PolarHBondContact O-N 2.79Å; L829-F833 HydrophobicContact CB-CE2 4.38Å; L829-F833 WeakPolarHBondContact O-CD2 3.32Å; L829-F833 PolarHBondContact O-N 3.39Å
830	A	90.9	Very high	90.6	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-40.6	177.3	0	0	0	0	0	112.4	I782 I805 V809 V826 C827 Y828 N832 F833 I834	I782-A830 HydrophobicContact CB-CB 4.42Å; I782-A830 HydrophobicContact CG2-CB 3.66Å; I805-A830 HydrophobicContact CG2-CB 3.84Å; V809-A830 HydrophobicContact CG2-CB 4.06Å; V826-A830 HydrophobicContact CG1-CB 3.6Å; C827-A830 PolarHBondContact O-N 2.85Å; C827-A830 VanDerWaalsContact O-N 3.14Å; C827-A830 PolarHBondContact SG-N 3.29Å; Y828-A830 PolarHBondContact O-N 3.43Å; A830-N832 VanDerWaalsContact C-N 3.3Å; A830-N832 PolarHBondContact O-N 2.91Å; A830-F833 PolarHBondContact O-N 2.78Å; A830-I834 VanDerWaalsContact O-CB 3.3Å; A830-I834 WeakPolarHBondContact O-CB 3.38Å; A830-I834 WeakPolarHBondContact O-CD1 3.33Å; A830-I834 WeakPolarHBondContact O-CG1 3.23Å; A830-I834 PolarHBondContact O-N 3.36Å
831	Q	91.2	Very high	90.7	Very high	54 Å²	54	44.2 Å²	44.2	25%	0.252	24%	0.238	S	C	.	.	H	α-helix	trans	-58.6	-43.4	174	-65.3	-178.8	40.7	0	0	111.3	T762 V826 C827 Y828 L829 F835 L841	T762-Q831 HydrophobicContact CG2-CG 4.24Å; T762-Q831 VanDerWaalsContact CG2-OE1 3.23Å; V826-Q831 HydrophobicContact CB-CG 4.04Å; V826-Q831 HydrophobicContact CG1-CG 3.64Å; V826-Q831 PolarHBondContact O-NE2 3.27Å; C827-Q831 WeakPolarHBondContact O-CG 3.4Å; C827-Q831 PolarHBondContact O-N 2.84Å; Y828-Q831 PolarHBondContact O-N 3.43Å; L829-Q831 PolarHBondContact O-N 2.81Å; Q831-F835 VanDerWaalsContact O-CB 3.25Å; Q831-F835 WeakPolarHBondContact O-CB 3.39Å; Q831-F835 PolarHBondContact O-N 3.26Å; Q831-L841 HydrophobicContact CB-CD2 4.43Å; Q831-L841 HydrophobicContact CG-CD2 3.9Å
832	N	89.9	Confident	90.6	Very high	56 Å²	56	44.2 Å²	44.2	30%	0.299	24%	0.238	S	C	.	.	H	α-helix	trans	-68.4	-43.5	-179.8	-78.5	-6.4	0	0	0	112.9	Y828 L829 A830 F835 K836	Y828-N832 WeakPolarHBondContact CE1-ND2 3.41Å; Y828-N832 WeakPolarHBondContact CE2-ND2 3.27Å; Y828-N832 WeakPolarHBondContact CE2-OD1 3.45Å; Y828-N832 PolarHBondContact O-N 3.48Å; Y828-N832 PolarHBondContact OH-ND2 3.38Å; L829-N832 PolarHBondContact O-N 2.79Å; A830-N832 VanDerWaalsContact C-N 3.3Å; A830-N832 PolarHBondContact O-N 2.91Å; N832-F835 PolarHBondContact O-N 3.36Å; N832-K836 WeakPolarHBondContact O-CB 3.4Å; N832-K836 WeakPolarHBondContact O-CG 3.16Å; N832-K836 PolarHBondContact O-N 3.35Å
833	F	90	Very high	90.5	Very high	72 Å²	72	45.1 Å²	45.1	32%	0.316	24%	0.244	S	C	.	.	H	α-helix	trans	-63.6	-46.8	175.3	-69.2	-59.9	0	0	0	111.4	I805 V809 L829 A830 F835 K836 S837	I805-F833 HydrophobicContact CG2-CD2 4.41Å; V809-F833 HydrophobicContact CB-CB 4.39Å; V809-F833 HydrophobicContact CG1-CB 3.82Å; V809-F833 HydrophobicContact CG2-CB 4.32Å; L829-F833 HydrophobicContact CB-CE2 4.38Å; L829-F833 WeakPolarHBondContact O-CD2 3.32Å; L829-F833 PolarHBondContact O-N 3.39Å; A830-F833 PolarHBondContact O-N 2.78Å; F833-F835 VanDerWaalsContact C-N 3.32Å; F833-F835 PolarHBondContact O-N 2.96Å; F833-K836 PolarHBondContact O-N 3.05Å; F833-S837 PolarHBondContact O-N 2.83Å; F833-S837 PolarHBondContact O-OG 2.85Å
834	I	91.2	Very high	90.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-62.2	-39.3	178.7	-67.3	168.2	0	0	0	111.2	I782 V809 I820 A830 S837 G838 I839 L841	I782-I834 HydrophobicContact CD1-CD1 4.05Å; V809-I834 HydrophobicContact CG1-CG1 4.18Å; V809-I834 HydrophobicContact CG2-CG1 4.39Å; I820-I834 HydrophobicContact CD1-CD1 4.05Å; I820-I834 HydrophobicContact CD1-CG1 4.28Å; I820-I834 HydrophobicContact CD1-CG2 3.98Å; A830-I834 VanDerWaalsContact O-CB 3.3Å; A830-I834 WeakPolarHBondContact O-CB 3.38Å; A830-I834 WeakPolarHBondContact O-CD1 3.33Å; A830-I834 WeakPolarHBondContact O-CG1 3.23Å; A830-I834 PolarHBondContact O-N 3.36Å; I834-S837 PolarHBondContact O-N 3.11Å; I834-G838 PolarHBondContact O-N 2.91Å; I834-I839 HydrophobicContact CG2-CB 3.87Å; I834-I839 HydrophobicContact CG2-CG2 4Å; I834-I839 PolarHBondContact O-N 3.18Å; I834-L841 HydrophobicContact CD1-CD1 4.25Å; I834-L841 HydrophobicContact CD1-CD2 4.46Å; I834-L841 HydrophobicContact CG2-CB 4.11Å
835	F	90.8	Very high	90.6	Very high	71 Å²	71	47.1 Å²	47.1	31%	0.311	25%	0.247	S	C	.	.	H	α-helix	trans	-66.2	-44.7	174.3	177.9	-119.5	0	0	0	112.5	H763 L765 M766 Q831 N832 F833 S837 G838	H763-F835 HydrophobicContact CB-CD2 4.46Å; H763-F835 AromaticContact CE1-CE1 3.54Å; H763-F835 AromaticContact CE1-CE2 3.85Å; H763-F835 AromaticContact CE1-CZ 3.45Å; H763-F835 VanDerWaalsContact CE1-CZ 3.45Å; H763-F835 WeakPolarHBondContact CE1-CZ 3.32Å; H763-F835 AromaticContact ND1-CD1 3.85Å; H763-F835 AromaticContact ND1-CD2 3.44Å; H763-F835 WeakPolarHBondContact ND1-CD2 3.25Å; H763-F835 AromaticContact ND1-CE1 3.65Å; H763-F835 AromaticContact ND1-CE2 3.22Å; H763-F835 WeakPolarHBondContact ND1-CE2 3.47Å; H763-F835 AromaticContact ND1-CG 3.76Å; H763-F835 AromaticContact ND1-CZ 3.34Å; H763-F835 VanDerWaalsContact ND1-CZ 3.34Å; H763-F835 WeakPolarHBondContact ND1-CZ 3.16Å; L765-F835 HydrophobicContact CB-CE2 3.97Å; L765-F835 HydrophobicContact CB-CZ 3.86Å; L765-F835 HydrophobicContact CD1-CZ 4.39Å; M766-F835 HydrophobicContact CE-CB 3.91Å; M766-F835 HydrophobicContact CE-CD2 4.08Å; M766-F835 HydrophobicContact CE-CG 4.43Å; M766-F835 HydrophobicContact CG-CD2 3.99Å; M766-F835 HydrophobicContact CG-CE2 4.46Å; Q831-F835 VanDerWaalsContact O-CB 3.25Å; Q831-F835 WeakPolarHBondContact O-CB 3.39Å; Q831-F835 PolarHBondContact O-N 3.26Å; N832-F835 PolarHBondContact O-N 3.36Å; F833-F835 VanDerWaalsContact C-N 3.32Å; F833-F835 PolarHBondContact O-N 2.96Å; F835-S837 PolarHBondContact O-N 2.91Å; F835-G838 PolarHBondContact O-N 3.2Å
836	K	88.3	Confident	90.7	Very high	176 Å²	176	51.4 Å²	51.4	77%	0.765	26%	0.26	S	S	*	.	H	α-helix	trans	-59.8	-32	174.7	-77.9	-179.9	177.3	-175.7	0	112.6	N832 F833 G838	N832-K836 WeakPolarHBondContact O-CB 3.4Å; N832-K836 WeakPolarHBondContact O-CG 3.16Å; N832-K836 PolarHBondContact O-N 3.35Å; F833-K836 PolarHBondContact O-N 3.05Å; K836-G838 PolarHBondContact O-N 3.15Å
837	S	86.3	Confident	90.5	Very high	56 Å²	56	55.1 Å²	55.1	39%	0.392	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	1.8	174.1	-58.8	0	0	0	0	114.6	L813 F833 I834 F835 I839	L813-S837 WeakPolarHBondContact CD2-OG 3.35Å; F833-S837 PolarHBondContact O-N 2.83Å; F833-S837 PolarHBondContact O-OG 2.85Å; I834-S837 PolarHBondContact O-N 3.11Å; F835-S837 PolarHBondContact O-N 2.91Å; S837-I839 VanDerWaalsContact C-N 3.31Å; S837-I839 PolarHBondContact O-N 3.22Å
838	G	88.3	Confident	90.3	Very high	57 Å²	57	57.7 Å²	57.7	59%	0.588	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.9	16.2	177.8	0	0	0	0	0	115	I834 F835 K836	I834-G838 PolarHBondContact O-N 2.91Å; F835-G838 PolarHBondContact O-N 3.2Å; K836-G838 PolarHBondContact O-N 3.15Å
839	I	91.8	Very high	90.3	Very high	12 Å²	12	50.8 Å²	50.8	6%	0.062	27%	0.27	C	S	.	.			trans	-95	134.3	-173.4	-61.3	174.4	0	0	0	110.1	L813 P817 I820 I834 S837 L841	L813-I839 HydrophobicContact CD2-CD1 3.4Å; P817-I839 HydrophobicContact CG-CD1 4.38Å; P817-I839 WeakPolarHBondContact O-CD1 3.34Å; P817-I839 WeakPolarHBondContact O-CG1 3.22Å; I820-I839 HydrophobicContact CD1-CG2 3.67Å; I820-I839 HydrophobicContact CG1-CG2 3.78Å; I834-I839 HydrophobicContact CG2-CB 3.87Å; I834-I839 HydrophobicContact CG2-CG2 4Å; I834-I839 PolarHBondContact O-N 3.18Å; S837-I839 VanDerWaalsContact C-N 3.31Å; S837-I839 PolarHBondContact O-N 3.22Å; I839-L841 PolarHBondContact O-N 2.78Å
840	I	92.2	Very high	90.3	Very high	1 Å²	1	48.5 Å²	48.5	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	125	176.9	-56.1	176.7	0	0	0	109.4	P761 P767 L770 N818 I819 I820 F842 F893	P761-I840 HydrophobicContact CB-CG2 4.18Å; P761-I840 HydrophobicContact CG-CG2 4.26Å; P767-I840 HydrophobicContact CB-CD1 4.26Å; P767-I840 WeakPolarHBondContact O-CD1 3.32Å; L770-I840 HydrophobicContact CD1-CD1 3.44Å; L770-I840 VanDerWaalsContact CD1-CD1 3.44Å; L770-I840 HydrophobicContact CD1-CG1 4.17Å; L770-I840 HydrophobicContact CG-CD1 3.84Å; N818-I840 PolarHBondContact O-N 3.4Å; I819-I840 CarbonylContact C-O 3.24Å; I819-I840 WeakPolarHBondContact CA-O 3.18Å; I819-I840 HydrophobicContact CB-CB 4.47Å; I819-I840 HydrophobicContact CD1-CD1 4.44Å; I819-I840 HydrophobicContact CG1-CB 4.21Å; I819-I840 HydrophobicContact CG1-CD1 4.26Å; I819-I840 HydrophobicContact CG2-CB 4.17Å; I819-I840 HydrophobicContact CG2-CG2 4.31Å; I820-I840 PolarHBondContact N-O 2.79Å; I840-F842 HydrophobicContact CG2-CD2 4.01Å; I840-F842 HydrophobicContact CG2-CE2 3.62Å; I840-F893 HydrophobicContact CD1-CD1 4.15Å; I840-F893 HydrophobicContact CD1-CE1 3.57Å; I840-F893 HydrophobicContact CD1-CZ 4.14Å; I840-F893 HydrophobicContact CG2-CZ 4.37Å
841	L	93.8	Very high	90.1	Very high	0 Å²	0	53.8 Å²	53.8	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	136.4	176.6	-174.8	64.1	0	0	0	111.7	P761 T762 M766 I820 V822 V826 Q831 I834 I839	P761-L841 CarbonylContact C-O 3.21Å; P761-L841 WeakPolarHBondContact CA-O 3.49Å; T762-L841 HydrophobicContact CG2-CD2 4.3Å; T762-L841 PolarHBondContact N-O 3.22Å; T762-L841 PolarHBondContact OG1-O 3.35Å; M766-L841 HydrophobicContact CE-CB 3.75Å; M766-L841 HydrophobicContact SD-CB 4.01Å; M766-L841 PolarHBondContact SD-N 3.24Å; M766-L841 VanDerWaalsContact SD-N 3.36Å; I820-L841 HydrophobicContact CB-CD1 4Å; I820-L841 HydrophobicContact CG2-CD1 4.05Å; V822-L841 HydrophobicContact CG2-CD1 3.88Å; V826-L841 HydrophobicContact CB-CD2 4.19Å; V826-L841 HydrophobicContact CG1-CD2 3.87Å; V826-L841 HydrophobicContact CG2-CD1 4.3Å; V826-L841 HydrophobicContact CG2-CD2 4.19Å; Q831-L841 HydrophobicContact CB-CD2 4.43Å; Q831-L841 HydrophobicContact CG-CD2 3.9Å; I834-L841 HydrophobicContact CD1-CD1 4.25Å; I834-L841 HydrophobicContact CD1-CD2 4.46Å; I834-L841 HydrophobicContact CG2-CB 4.11Å; I839-L841 PolarHBondContact O-N 2.78Å
842	F	93.3	Very high	89.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	110.9	164.4	-72.6	-96.4	0	0	0	109.9	F757 K759 R760 P761 I819 I820 F821 V822 I840 V845 F893 V895 T909	F757-F842 HydrophobicContact CE2-CD1 4.45Å; F757-F842 HydrophobicContact CE2-CE1 4.29Å; K759-F842 HydrophobicContact CB-CD1 4.25Å; K759-F842 HydrophobicContact CB-CE1 4.33Å; K759-F842 HydrophobicContact CG-CD1 3.75Å; K759-F842 HydrophobicContact CG-CE1 4.28Å; R760-F842 VanDerWaalsContact C-CE1 3.49Å; R760-F842 WeakPolarHBondContact O-CD1 3.37Å; P761-F842 HydrophobicContact CG-CE1 4.36Å; P761-F842 HydrophobicContact CG-CE2 4.5Å; P761-F842 HydrophobicContact CG-CZ 4.01Å; I819-F842 HydrophobicContact CG2-CD2 4.15Å; I819-F842 HydrophobicContact CG2-CE2 4.26Å; I820-F842 PolarHBondContact O-N 3.17Å; F821-F842 HydrophobicContact CD1-CB 3.52Å; F821-F842 AromaticContact CD1-CD2 3.72Å; F821-F842 HydrophobicContact CD1-CD2 3.72Å; F821-F842 AromaticContact CD1-CG 3.72Å; F821-F842 HydrophobicContact CD1-CG 3.72Å; F821-F842 HydrophobicContact CE1-CB 3.92Å; F821-F842 HydrophobicContact CE1-CD1 4.2Å; F821-F842 AromaticContact CE1-CD2 3.24Å; F821-F842 HydrophobicContact CE1-CD2 3.24Å; F821-F842 AromaticContact CE1-CE2 3.65Å; F821-F842 HydrophobicContact CE1-CE2 3.65Å; F821-F842 AromaticContact CE1-CG 3.55Å; F821-F842 HydrophobicContact CE1-CG 3.55Å; F821-F842 HydrophobicContact CE1-CZ 4.27Å; F821-F842 HydrophobicContact CG-CB 4.39Å; F821-F842 AromaticContact CZ-CD2 3.86Å; F821-F842 HydrophobicContact CZ-CD2 3.86Å; F821-F842 AromaticContact CZ-CE2 3.99Å; F821-F842 HydrophobicContact CZ-CE2 3.99Å; V822-F842 PolarHBondContact N-O 2.84Å; I840-F842 HydrophobicContact CG2-CD2 4.01Å; I840-F842 HydrophobicContact CG2-CE2 3.62Å; F842-V845 HydrophobicContact CB-CG2 3.69Å; F842-V845 WeakPolarHBondContact O-CG2 3.02Å; F842-F893 AromaticContact CE2-CE2 3.71Å; F842-F893 HydrophobicContact CE2-CE2 3.71Å; F842-F893 AromaticContact CE2-CZ 3.61Å; F842-F893 HydrophobicContact CE2-CZ 3.61Å; F842-F893 AromaticContact CZ-CE2 3.9Å; F842-F893 HydrophobicContact CZ-CE2 3.9Å; F842-F893 AromaticContact CZ-CZ 3.7Å; F842-F893 HydrophobicContact CZ-CZ 3.7Å; F842-V895 HydrophobicContact CZ-CG2 4.34Å; F842-T909 HydrophobicContact CE1-CG2 4.44Å; F842-T909 HydrophobicContact CZ-CG2 3.94Å
843	S	91.8	Very high	89.8	Confident	18 Å²	18	49.7 Å²	49.7	13%	0.126	26%	0.257	C	S	.	.			trans	-99.9	157.1	175.6	55.1	0	0	0	0	113	K759 T762	K759-S843 WeakPolarHBondContact CE-O 3.33Å; K759-S843 PolarHBondContact NZ-O 3.18Å; T762-S843 WeakPolarHBondContact CG2-OG 3.36Å; T762-S843 PolarHBondContact OG1-N 3.49Å; T762-S843 PolarHBondContact OG1-OG 3.34Å
844	N	91.8	Very high	89.6	Confident	86 Å²	86	46.9 Å²	46.9	46%	0.46	25%	0.247	S	C	.	.	S	Bend	trans	53	50.9	-174.4	-63.7	-0.4	0	0	0	112.4	K759 V822 S823 G824 T825	K759-N844 PolarHBondContact NZ-O 2.84Å; V822-N844 PolarHBondContact O-N 3.41Å; S823-N844 WeakPolarHBondContact O-CA 3.41Å; G824-N844 PolarHBondContact O-N 3.44Å; G824-N844 PolarHBondContact O-OD1 2.82Å; G824-N844 VanDerWaalsContact O-OD1 3.11Å; T825-N844 VanDerWaalsContact CA-OD1 3.32Å; T825-N844 WeakPolarHBondContact CA-OD1 3.2Å; T825-N844 VanDerWaalsContact CG2-OD1 3.27Å; T825-N844 WeakPolarHBondContact CG2-OD1 3.47Å; T825-N844 PolarHBondContact N-OD1 3.45Å
845	V	91.6	Very high	88.9	Confident	7 Å²	7	49.5 Å²	49.5	4%	0.042	26%	0.257	C	S	.	.			trans	-87	130.8	177	-178.9	0	0	0	0	108.7	F821 V822 S823 F842 Q847 V849 L850	F821-V845 HydrophobicContact CB-CG2 4.36Å; F821-V845 HydrophobicContact CD1-CG2 4.16Å; V822-V845 WeakPolarHBondContact O-CB 3.39Å; V822-V845 WeakPolarHBondContact O-CG2 3.25Å; V822-V845 PolarHBondContact O-N 2.8Å; S823-V845 WeakPolarHBondContact CA-O 3.17Å; S823-V845 PolarHBondContact O-N 3.02Å; F842-V845 HydrophobicContact CB-CG2 3.69Å; F842-V845 WeakPolarHBondContact O-CG2 3.02Å; V845-Q847 PolarHBondContact O-N 3.46Å; V845-V849 HydrophobicContact CG1-CB 3.98Å; V845-V849 HydrophobicContact CG1-CG1 4.11Å; V845-L850 HydrophobicContact CB-CD2 4.17Å; V845-L850 HydrophobicContact CB-CG 4.41Å; V845-L850 HydrophobicContact CG1-CD2 3.82Å; V845-L850 HydrophobicContact CG1-CG 4.02Å
846	K	91.2	Very high	88.2	Confident	165 Å²	165	46.3 Å²	46.3	72%	0.717	24%	0.243	S	C	*	.			trans	-61.3	134.3	177.5	-66.2	-167.4	176.8	-168.4	0	109.9	S848 V849 L850	K846-S848 PolarHBondContact O-N 3.23Å; K846-S848 VanDerWaalsContact O-N 3.11Å; K846-V849 HydrophobicContact CB-CG2 4.34Å; K846-V849 WeakPolarHBondContact O-CA 3.38Å; K846-V849 WeakPolarHBondContact O-CB 3.47Å; K846-V849 PolarHBondContact O-N 2.98Å; K846-L850 PolarHBondContact O-N 2.98Å
847	Q	88.1	Confident	88	Confident	88 Å²	88	38.2 Å²	38.2	41%	0.411	21%	0.208	S	C	.	.	H	α-helix	trans	-53.1	-35.3	179.8	-156.4	-173.6	34.8	0	0	112.9	D779 V845 V849 L850 Y851	D779-Q847 PolarHBondContact OD1-NE2 2.91Å; D779-Q847 PolarHBondContact OD2-NE2 3.4Å; V845-Q847 PolarHBondContact O-N 3.46Å; Q847-V849 PolarHBondContact O-N 3.48Å; Q847-L850 WeakPolarHBondContact O-CB 3.49Å; Q847-L850 PolarHBondContact O-N 3.01Å; Q847-L850 VanDerWaalsContact O-N 3.08Å; Q847-Y851 HydrophobicContact CB-CE2 4.49Å; Q847-Y851 HydrophobicContact CG-CD2 4.24Å; Q847-Y851 HydrophobicContact CG-CE2 3.61Å; Q847-Y851 PolarHBondContact NE2-OH 3.36Å; Q847-Y851 VanDerWaalsContact O-CD2 3.25Å; Q847-Y851 WeakPolarHBondContact O-CD2 3.45Å; Q847-Y851 PolarHBondContact O-N 3.49Å
848	S	84.9	Confident	87.5	Confident	77 Å²	77	35.8 Å²	35.8	54%	0.538	19%	0.192	S	C	.	.	H	α-helix	trans	-66	-17	173.3	58.1	0	0	0	0	115	K846 R852	K846-S848 PolarHBondContact O-N 3.23Å; K846-S848 VanDerWaalsContact O-N 3.11Å; S848-R852 WeakPolarHBondContact O-CD 3.34Å; S848-R852 WeakPolarHBondContact O-CG 3.46Å
849	V	90.5	Very high	87.3	Confident	23 Å²	23	33.2 Å²	33.2	14%	0.139	17%	0.166	C	C	.	.	H	α-helix	trans	-86.7	-38	168	-178.9	0	0	0	0	110.2	F757 V845 K846 Q847 R852 I853	F757-V849 HydrophobicContact CB-CG1 4.2Å; F757-V849 HydrophobicContact CB-CG2 4.41Å; F757-V849 HydrophobicContact CD1-CG1 3.96Å; F757-V849 HydrophobicContact CD2-CG1 4.04Å; F757-V849 HydrophobicContact CE1-CG1 4.32Å; F757-V849 HydrophobicContact CE2-CG1 4.4Å; F757-V849 HydrophobicContact CG-CG1 3.81Å; V845-V849 HydrophobicContact CG1-CB 3.98Å; V845-V849 HydrophobicContact CG1-CG1 4.11Å; K846-V849 HydrophobicContact CB-CG2 4.34Å; K846-V849 WeakPolarHBondContact O-CA 3.38Å; K846-V849 WeakPolarHBondContact O-CB 3.47Å; K846-V849 PolarHBondContact O-N 2.98Å; Q847-V849 PolarHBondContact O-N 3.48Å; V849-R852 WeakPolarHBondContact O-CB 3.08Å; V849-R852 PolarHBondContact O-N 2.85Å; V849-R852 VanDerWaalsContact O-N 3.16Å; V849-I853 HydrophobicContact CG1-CD1 4Å; V849-I853 HydrophobicContact CG1-CG1 4.38Å; V849-I853 WeakPolarHBondContact O-CG1 3.34Å; V849-I853 PolarHBondContact O-N 2.89Å
850	L	89.4	Confident	86.9	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-59.3	-47.3	175.1	-64.7	178.1	0	0	0	112.1	L777 F821 S823 V845 K846 Q847 R852 I853 A854 I861	L777-L850 HydrophobicContact CD2-CD2 4.11Å; F821-L850 HydrophobicContact CB-CD2 3.44Å; F821-L850 VanDerWaalsContact CB-CD2 3.44Å; F821-L850 HydrophobicContact CG-CD2 4.47Å; S823-L850 VanDerWaalsContact CB-CD1 3.45Å; V845-L850 HydrophobicContact CB-CD2 4.17Å; V845-L850 HydrophobicContact CB-CG 4.41Å; V845-L850 HydrophobicContact CG1-CD2 3.82Å; V845-L850 HydrophobicContact CG1-CG 4.02Å; K846-L850 PolarHBondContact O-N 2.98Å; Q847-L850 WeakPolarHBondContact O-CB 3.49Å; Q847-L850 PolarHBondContact O-N 3.01Å; Q847-L850 VanDerWaalsContact O-N 3.08Å; L850-R852 PolarHBondContact O-N 3.33Å; L850-I853 PolarHBondContact O-N 2.68Å; L850-A854 WeakPolarHBondContact O-CB 3.48Å; L850-A854 PolarHBondContact O-N 3.24Å; L850-I861 HydrophobicContact CB-CD1 4.21Å
851	Y	87	Confident	86.7	Confident	110 Å²	110	36.2 Å²	36.2	43%	0.431	18%	0.181	S	C	.	.	H	α-helix	trans	-59	-34.5	175.9	-69.5	-54.2	0	0	0	112.9	Q847 A854 R855 I861	Q847-Y851 HydrophobicContact CB-CE2 4.49Å; Q847-Y851 HydrophobicContact CG-CD2 4.24Å; Q847-Y851 HydrophobicContact CG-CE2 3.61Å; Q847-Y851 PolarHBondContact NE2-OH 3.36Å; Q847-Y851 VanDerWaalsContact O-CD2 3.25Å; Q847-Y851 WeakPolarHBondContact O-CD2 3.45Å; Q847-Y851 PolarHBondContact O-N 3.49Å; Y851-A854 PolarHBondContact O-N 2.72Å; Y851-R855 WeakPolarHBondContact O-CG 3.42Å; Y851-R855 PolarHBondContact O-N 3.43Å; Y851-R855 VanDerWaalsContact O-N 3.08Å; Y851-I861 HydrophobicContact CD1-CD1 3.4Å; Y851-I861 HydrophobicContact CE1-CD1 3.66Å; Y851-I861 HydrophobicContact CG-CD1 4.24Å
852	R	85.9	Confident	86.4	Confident	24 Å²	24	36.4 Å²	36.4	9%	0.091	18%	0.183	C	C	.	.	H	α-helix	trans	-71.9	-42.1	177.3	-68.8	-176	72.8	-141.8	-9.2	112.5	H737 L755 S848 V849 L850 A854 R855 M856 E933 A934	H737-R852 VanDerWaalsContact CB-CZ 3.44Å; L755-R852 HydrophobicContact CD1-CB 4.29Å; L755-R852 HydrophobicContact CD2-CB 4.45Å; S848-R852 WeakPolarHBondContact O-CD 3.34Å; S848-R852 WeakPolarHBondContact O-CG 3.46Å; V849-R852 WeakPolarHBondContact O-CB 3.08Å; V849-R852 PolarHBondContact O-N 2.85Å; V849-R852 VanDerWaalsContact O-N 3.16Å; L850-R852 PolarHBondContact O-N 3.33Å; R852-A854 VanDerWaalsContact C-N 3.32Å; R852-A854 PolarHBondContact O-N 2.91Å; R852-R855 PolarHBondContact O-N 3.07Å; R852-M856 WeakPolarHBondContact O-CB 3.41Å; R852-M856 PolarHBondContact O-N 3.18Å; R852-E933 WeakPolarHBondContact CA-OE1 3.32Å; R852-E933 VanDerWaalsContact CB-OE2 3.32Å; R852-E933 WeakPolarHBondContact CB-OE2 3.24Å; R852-E933 WeakPolarHBondContact CG-OE2 3.32Å; R852-E933 IonicContact CZ-OE2 2.82Å; R852-E933 IonicContact NE-OE2 3.91Å; R852-E933 PolarHBondContact NE-OE2 3.48Å; R852-E933 IonicContact NH2-OE2 3.63Å; R852-E933 PolarHBondContact NH2-OE2 2.96Å; R852-A934 PolarHBondContact NH2-O 3.33Å
853	I	87.8	Confident	85.9	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-61.3	-44.3	171.7	-58.7	162.6	0	0	0	109.7	L755 I775 L777 F821 V849 L850 R855 M856 T857 I911	L755-I853 HydrophobicContact CD2-CB 4.39Å; L755-I853 HydrophobicContact CD2-CD1 4.36Å; L755-I853 HydrophobicContact CD2-CG1 3.35Å; I775-I853 HydrophobicContact CG2-CG2 3.96Å; L777-I853 HydrophobicContact CD1-CB 4.29Å; L777-I853 HydrophobicContact CD1-CG2 4.25Å; L777-I853 HydrophobicContact CD2-CB 4.12Å; L777-I853 HydrophobicContact CD2-CD1 4.44Å; L777-I853 HydrophobicContact CD2-CG2 3.78Å; F821-I853 HydrophobicContact CB-CD1 4.48Å; F821-I853 HydrophobicContact CD1-CD1 3.79Å; F821-I853 HydrophobicContact CD2-CD1 3.87Å; F821-I853 HydrophobicContact CE1-CD1 3.94Å; F821-I853 HydrophobicContact CE2-CD1 3.98Å; F821-I853 HydrophobicContact CE2-CG2 4.41Å; F821-I853 HydrophobicContact CG-CD1 3.78Å; F821-I853 HydrophobicContact CZ-CD1 4.02Å; V849-I853 HydrophobicContact CG1-CD1 4Å; V849-I853 HydrophobicContact CG1-CG1 4.38Å; V849-I853 WeakPolarHBondContact O-CG1 3.34Å; V849-I853 PolarHBondContact O-N 2.89Å; L850-I853 PolarHBondContact O-N 2.68Å; I853-R855 PolarHBondContact O-N 2.77Å; I853-M856 PolarHBondContact O-N 2.92Å; I853-T857 HydrophobicContact CG2-CG2 3.82Å; I853-T857 VanDerWaalsContact O-CB 3.3Å; I853-T857 WeakPolarHBondContact O-CB 3.14Å; I853-T857 VanDerWaalsContact O-CG2 3.27Å; I853-T857 WeakPolarHBondContact O-CG2 3.47Å; I853-T857 PolarHBondContact O-N 3.26Å; I853-T857 PolarHBondContact O-OG1 3.11Å; I853-I911 HydrophobicContact CG1-CD1 4.39Å
854	A	85	Confident	85.4	Confident	14 Å²	14	40.5 Å²	40.5	12%	0.116	21%	0.206	C	C	.	.	H	α-helix	trans	-58.5	-46.6	179.6	0	0	0	0	0	112.8	L777 L850 Y851 R852 G858 A859 I861	L777-A854 HydrophobicContact CD1-CB 3.58Å; L850-A854 WeakPolarHBondContact O-CB 3.48Å; L850-A854 PolarHBondContact O-N 3.24Å; Y851-A854 PolarHBondContact O-N 2.72Å; R852-A854 VanDerWaalsContact C-N 3.32Å; R852-A854 PolarHBondContact O-N 2.91Å; A854-G858 CarbonylContact O-C 3.35Å; A854-G858 WeakPolarHBondContact O-CA 3.36Å; A854-G858 PolarHBondContact O-N 3.08Å; A854-A859 PolarHBondContact O-N 2.94Å; A854-I861 HydrophobicContact CB-CD1 3.91Å; A854-I861 HydrophobicContact CB-CG1 3.91Å
855	R	77.6	Confident	84.9	Confident	55 Å²	55	36.7 Å²	36.7	21%	0.208	19%	0.186	C	C	.	.	H	α-helix	trans	-63.1	-45.8	179.1	-75.6	-171.1	-57.5	-150.4	13.1	113.3	Y734 Y735 Y851 R852 I853 E933	Y734-R855 PolarHBondContact O-NH2 2.78Å; Y735-R855 VanDerWaalsContact CE1-CZ 3.46Å; Y851-R855 WeakPolarHBondContact O-CG 3.42Å; Y851-R855 PolarHBondContact O-N 3.43Å; Y851-R855 VanDerWaalsContact O-N 3.08Å; R852-R855 PolarHBondContact O-N 3.07Å; I853-R855 PolarHBondContact O-N 2.77Å; R855-E933 IonicContact CZ-OE1 2.68Å; R855-E933 IonicContact NE-OE1 2.69Å; R855-E933 PolarHBondContact NE-OE1 3.1Å; R855-E933 IonicContact NH2-OE1 3.23Å; R855-E933 PolarHBondContact NH2-OE1 3.39Å
856	M	76.5	Confident	84.1	Confident	4 Å²	4	39.7 Å²	39.7	2%	0.02	20%	0.202	C	C	.	.	H	α-helix	trans	-76.1	-26.1	-177.9	176.1	-170.6	58.7	0	0	114	L755 R852 I853 I911 N913 I930	L755-M856 HydrophobicContact CB-CE 3.62Å; L755-M856 HydrophobicContact CB-SD 3.67Å; L755-M856 HydrophobicContact CD2-CE 3.86Å; L755-M856 HydrophobicContact CG-CE 4.38Å; R852-M856 WeakPolarHBondContact O-CB 3.41Å; R852-M856 PolarHBondContact O-N 3.18Å; I853-M856 PolarHBondContact O-N 2.92Å; M856-I911 HydrophobicContact CE-CB 3.76Å; M856-I911 HydrophobicContact CE-CG2 3.46Å; M856-I911 VanDerWaalsContact CE-CG2 3.46Å; M856-I911 HydrophobicContact SD-CG2 4.36Å; M856-N913 HydrophobicContact CG-CB 4.17Å; M856-N913 PolarHBondContact O-ND2 3.45Å; M856-I930 WeakPolarHBondContact O-CG2 3.21Å
857	T	82.9	Confident	83.2	Confident	5 Å²	5	38.3 Å²	38.3	3%	0.031	19%	0.192	C	C	.	.	H	α-helix	trans	-105.4	-12.4	-177.7	65	0	0	0	0	113.8	I775 I853 A859 G888 V889 C890	I775-T857 HydrophobicContact CD1-CG2 3.74Å; I853-T857 HydrophobicContact CG2-CG2 3.82Å; I853-T857 VanDerWaalsContact O-CB 3.3Å; I853-T857 WeakPolarHBondContact O-CB 3.14Å; I853-T857 VanDerWaalsContact O-CG2 3.27Å; I853-T857 WeakPolarHBondContact O-CG2 3.47Å; I853-T857 PolarHBondContact O-N 3.26Å; I853-T857 PolarHBondContact O-OG1 3.11Å; T857-A859 VanDerWaalsContact C-N 3.28Å; T857-A859 PolarHBondContact O-N 2.98Å; T857-G888 VanDerWaalsContact O-CA 3.25Å; T857-G888 WeakPolarHBondContact O-CA 3.45Å; T857-V889 WeakPolarHBondContact CA-O 3.25Å; T857-V889 WeakPolarHBondContact CB-O 3.45Å; T857-V889 PolarHBondContact O-N 3.45Å; T857-V889 VanDerWaalsContact O-N 3.16Å; T857-C890 HydrophobicContact CG2-CB 4.3Å
858	G	76.6	Confident	82.1	Confident	5 Å²	5	36 Å²	36	5%	0.052	18%	0.182	C	C	.	.			trans	76.8	6.4	-175.9	0	0	0	0	0	115.4	A854	A854-G858 CarbonylContact O-C 3.35Å; A854-G858 WeakPolarHBondContact O-CA 3.36Å; A854-G858 PolarHBondContact O-N 3.08Å
859	A	83.6	Confident	80.5	Confident	4 Å²	4	36.9 Å²	36.9	3%	0.033	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-63.4	153.9	-177.5	0	0	0	0	0	113.9	L777 A854 T857 R886 R928	L777-A859 HydrophobicContact CD1-CB 3.72Å; L777-A859 HydrophobicContact CG-CB 4.08Å; A854-A859 PolarHBondContact O-N 2.94Å; T857-A859 VanDerWaalsContact C-N 3.28Å; T857-A859 PolarHBondContact O-N 2.98Å; A859-R886 CarbonylContact C-O 3.58Å; A859-R886 WeakPolarHBondContact CA-O 3.35Å; A859-R928 PolarHBondContact O-NH1 2.86Å
860	D	84	Confident	78.7	Confident	43 Å²	43	39.7 Å²	39.7	23%	0.23	20%	0.2	C	C	.	.	P	Polyproline II helix	trans	-83.1	140.9	157.6	-72.3	-49.8	0	0	0	111	T885 R886 R928	D860-T885 HydrophobicContact CB-CG2 4.17Å; D860-R886 PolarHBondContact N-O 3.5Å; D860-R886 WeakPolarHBondContact OD2-CB 3.26Å; D860-R886 PolarHBondContact OD2-N 2.81Å; D860-R928 IonicContact OD1-CZ 3.83Å; D860-R928 IonicContact OD1-NH1 2.68Å; D860-R928 PolarHBondContact OD1-NH1 3.47Å; D860-R928 IonicContact OD1-NH2 3.99Å; D860-R928 PolarHBondContact OD1-NH2 3.27Å
861	I	87.4	Confident	76.5	Confident	32 Å²	32	45.4 Å²	45.4	16%	0.164	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	120.7	165.6	-60.4	173.4	0	0	0	107.3	L777 D779 L850 Y851 A854	L777-I861 HydrophobicContact CB-CB 4.45Å; L777-I861 HydrophobicContact CB-CG1 3.94Å; L777-I861 HydrophobicContact CD1-CG1 3.83Å; D779-I861 HydrophobicContact CB-CG2 3.91Å; L850-I861 HydrophobicContact CB-CD1 4.21Å; Y851-I861 HydrophobicContact CD1-CD1 3.4Å; Y851-I861 HydrophobicContact CE1-CD1 3.66Å; Y851-I861 HydrophobicContact CG-CD1 4.24Å; A854-I861 HydrophobicContact CB-CD1 3.91Å; A854-I861 HydrophobicContact CB-CG1 3.91Å
862	L	86.6	Confident	73.9	Confident	5 Å²	5	45.2 Å²	45.2	3%	0.026	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	119.1	174.5	-67.9	-179.9	0	0	0	110.6	L776 L777 L778 D779 S864 R867 L868 T885	L776-L862 HydrophobicContact CD1-CD1 4.11Å; L777-L862 PolarHBondContact O-N 2.74Å; L778-L862 HydrophobicContact CD2-CB 3.85Å; L778-L862 HydrophobicContact CD2-CD1 3.84Å; L778-L862 HydrophobicContact CD2-CG 4.33Å; D779-L862 PolarHBondContact N-O 3.23Å; L862-S864 VanDerWaalsContact C-N 3.32Å; L862-S864 PolarHBondContact O-N 2.92Å; L862-R867 HydrophobicContact CD2-CB 4.42Å; L862-R867 HydrophobicContact CD2-CG 4.5Å; L862-L868 HydrophobicContact CD1-CD1 3.92Å; L862-L868 HydrophobicContact CD1-CD2 3.98Å; L862-L868 HydrophobicContact CD1-CG 3.85Å; L862-T885 HydrophobicContact CD1-CG2 4.2Å; L862-T885 HydrophobicContact CD2-CG2 3.75Å; L862-T885 HydrophobicContact CG-CG2 4.05Å
863	D	84.2	Confident	71.1	Confident	61 Å²	61	48.7 Å²	48.7	33%	0.326	27%	0.271	S	S	.	.	S	Bend	trans	-60.2	-40.5	173.3	-66.5	-54.2	0	0	0	111.8	K723 S780 R867	K723-D863 IonicContact NZ-OD1 3.43Å; K723-D863 PolarHBondContact NZ-OD1 2.87Å; K723-D863 IonicContact NZ-OD2 2.97Å; K723-D863 PolarHBondContact NZ-OD2 3.33Å; S780-D863 WeakPolarHBondContact CB-O 3.42Å; S780-D863 PolarHBondContact N-O 2.72Å; S780-D863 PolarHBondContact OG-O 2.83Å; D863-R867 IonicContact OD2-NH1 3Å; D863-R867 PolarHBondContact OD2-NH1 3.38Å
864	S	80.6	Confident	68.3	Low	43 Å²	43	56.5 Å²	56.5	30%	0.301	30%	0.3	S	S	.	.			trans	-141.9	155.7	174.8	67.7	0	0	0	0	111.7	S780 L862 D866 R867	S780-S864 WeakPolarHBondContact OG-CA 3.37Å; L862-S864 VanDerWaalsContact C-N 3.32Å; L862-S864 PolarHBondContact O-N 2.92Å; S864-D866 PolarHBondContact O-N 3.36Å; S864-R867 VanDerWaalsContact O-CB 3.28Å; S864-R867 WeakPolarHBondContact O-CB 3.38Å; S864-R867 PolarHBondContact O-N 3.38Å; S864-R867 PolarHBondContact OG-N 3.01Å
865	I	81.2	Confident	65.6	Low	5 Å²	5	64.4 Å²	64.4	3%	0.026	33%	0.332	C	S	.	.	G	3₁₀ helix	trans	-63.3	-34.7	171.3	-51.5	175.3	0	0	0	110	I782 C808 I812 R867 L868	I782-I865 HydrophobicContact CB-CD1 4.3Å; I782-I865 HydrophobicContact CG1-CD1 4.09Å; I782-I865 HydrophobicContact CG2-CD1 3.95Å; C808-I865 HydrophobicContact CB-CD1 4.05Å; C808-I865 HydrophobicContact CB-CG2 4.09Å; I812-I865 HydrophobicContact CD1-CD1 4.38Å; I865-R867 PolarHBondContact O-N 2.67Å; I865-R867 VanDerWaalsContact O-N 3.12Å; I865-L868 HydrophobicContact CG2-CD1 4.36Å; I865-L868 VanDerWaalsContact O-CB 3.26Å; I865-L868 WeakPolarHBondContact O-CB 3.35Å; I865-L868 PolarHBondContact O-N 3.36Å
866	D	74.8	Confident	63.3	Low	71 Å²	71	66.6 Å²	66.6	38%	0.38	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-66	-13	178.5	-52.2	-69.2	0	0	0	113.5	S864 L868 M869	S864-D866 PolarHBondContact O-N 3.36Å; D866-L868 PolarHBondContact O-N 3.04Å; D866-M869 WeakPolarHBondContact O-CA 3.41Å; D866-M869 VanDerWaalsContact O-CB 3.27Å; D866-M869 WeakPolarHBondContact O-CB 3.38Å; D866-M869 PolarHBondContact O-N 3.25Å
867	R	72.4	Confident	61.1	Low	135 Å²	135	73.6 Å²	73.6	51%	0.509	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-66.1	-15.2	167.5	-162.7	169.3	-178.9	168.8	-0.6	113.1	L862 D863 S864 I865	L862-R867 HydrophobicContact CD2-CB 4.42Å; L862-R867 HydrophobicContact CD2-CG 4.5Å; D863-R867 IonicContact OD2-NH1 3Å; D863-R867 PolarHBondContact OD2-NH1 3.38Å; S864-R867 VanDerWaalsContact O-CB 3.28Å; S864-R867 WeakPolarHBondContact O-CB 3.38Å; S864-R867 PolarHBondContact O-N 3.38Å; S864-R867 PolarHBondContact OG-N 3.01Å; I865-R867 PolarHBondContact O-N 2.67Å; I865-R867 VanDerWaalsContact O-N 3.12Å
868	L	65.2	Low	58.5	Low	40 Å²	40	80.1 Å²	80.1	21%	0.209	43%	0.428	C	S	.	.	G	3₁₀ helix	trans	-80.9	-22.3	166.7	-62	165.2	0	0	0	112.4	K811 L815 L862 I865 D866	K811-L868 HydrophobicContact CB-CD1 4.44Å; L815-L868 HydrophobicContact CD1-CD1 4.15Å; L815-L868 HydrophobicContact CD1-CD2 4Å; L815-L868 HydrophobicContact CD2-CD2 4.36Å; L862-L868 HydrophobicContact CD1-CD1 3.92Å; L862-L868 HydrophobicContact CD1-CD2 3.98Å; L862-L868 HydrophobicContact CD1-CG 3.85Å; I865-L868 HydrophobicContact CG2-CD1 4.36Å; I865-L868 VanDerWaalsContact O-CB 3.26Å; I865-L868 WeakPolarHBondContact O-CB 3.35Å; I865-L868 PolarHBondContact O-N 3.36Å; D866-L868 PolarHBondContact O-N 3.04Å
869	M	52	Low	56.5	Low	95 Å²	95	87.7 Å²	87.7	47%	0.468	47%	0.467	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-19.8	-179.8	-69.2	-73.6	-72	0	0	113.5	K811 D866 N871 P872	K811-M869 HydrophobicContact CD-CG 4.23Å; K811-M869 HydrophobicContact CD-SD 3.78Å; K811-M869 WeakPolarHBondContact CE-SD 3.37Å; K811-M869 PolarHBondContact NZ-SD 2.75Å; D866-M869 WeakPolarHBondContact O-CA 3.41Å; D866-M869 VanDerWaalsContact O-CB 3.27Å; D866-M869 WeakPolarHBondContact O-CB 3.38Å; D866-M869 PolarHBondContact O-N 3.25Å; M869-N871 PolarHBondContact O-N 3.31Å; M869-N871 VanDerWaalsContact O-N 3.12Å; M869-P872 VanDerWaalsContact O-CD 3.24Å; M869-P872 WeakPolarHBondContact O-CD 3.4Å; M869-P872 VanDerWaalsContact O-CG 3.3Å; M869-P872 WeakPolarHBondContact O-CG 3.36Å
870	S	52.9	Low	54	Low	83 Å²	83	92.5 Å²	92.5	58%	0.58	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	14	-171.4	73.8	0	0	0	0	115.3
871	N	42.4	Very low	51.6	Low	120 Å²	120	97.1 Å²	97.1	64%	0.642	52%	0.516	S	S	*	.			trans	-135.2	40.1	-178.8	-89.5	-40.7	0	0	0	116.8	M869	M869-N871 PolarHBondContact O-N 3.31Å; M869-N871 VanDerWaalsContact O-N 3.12Å
872	P	32.7	Very low	49.1	Very low	106 Å²	106	103.3 Å²	103.3	69%	0.688	54%	0.542	S	S	*	.			trans	-89.8	117	176.6	10	13	0	0	0	111.1	M869	M869-P872 VanDerWaalsContact O-CD 3.24Å; M869-P872 WeakPolarHBondContact O-CD 3.4Å; M869-P872 VanDerWaalsContact O-CG 3.3Å; M869-P872 WeakPolarHBondContact O-CG 3.36Å
873	S	27.8	Very low	47.1	Very low	97 Å²	97	107.7 Å²	107.7	68%	0.678	57%	0.573	S	S	*	*			trans	52.3	87.8	160.4	-174.4	0	0	0	0	118.7
874	R	27.5	Very low	45.8	Very low	164 Å²	164	108.9 Å²	108.9	62%	0.619	59%	0.591	S	S	*	*			trans	-111.4	125.3	132.2	-74.8	-166.6	179.4	-176	2.7	109.9	V711 K882	V711-R874 PolarHBondContact O-NH2 3.09Å; R874-K882 PolarHBondContact O-NZ 2.7Å
875	K	28.6	Very low	45.3	Very low	180 Å²	180	108.6 Å²	108.6	78%	0.783	59%	0.588	S	S	*	*			trans	-83.1	157	170.1	-62.4	178.6	179.4	178.4	0	108.8
876	S	30	Very low	44.9	Very low	100 Å²	100	113.6 Å²	113.6	70%	0.699	61%	0.606	S	S	*	*			trans	38.7	101.9	170.4	53.1	0	0	0	0	115.3
877	D	29.4	Very low	45.4	Very low	151 Å²	151	111.4 Å²	111.4	81%	0.807	60%	0.595	S	S	*	*				-153	-174	75	-80.1	-34.2	0	0	0	114.3
878	N	28.7	Very low	46	Very low	142 Å²	142	105 Å²	105	76%	0.759	57%	0.57	S	S	*	*	S	Bend	trans	-75.3	149.5	-157.4	-65.4	-50.1	0	0	0	116	T880	N878-T880 PolarHBondContact O-N 3.28Å
879	N	34.5	Very low	46.8	Very low	165 Å²	165	106.2 Å²	106.2	88%	0.882	58%	0.579	S	S	*	*	S	Bend	trans	58.3	41	155.3	-64.8	-10.3	0	0	0	119
880	T	31.3	Very low	48.4	Very low	105 Å²	105	101.7 Å²	101.7	64%	0.644	56%	0.557	S	S	*	*			trans	-119	123	153.7	47.8	0	0	0	0	110.9	N878 K882	N878-T880 PolarHBondContact O-N 3.28Å; T880-K882 PolarHBondContact O-N 3.07Å
881	Q	33.5	Very low	49.9	Very low	140 Å²	140	100.3 Å²	100.3	65%	0.654	54%	0.543	S	S	*	.			trans	-74.5	121.5	-174.2	-66.3	-171.6	-57.5	0	0	111.2	S924	Q881-S924 PolarHBondContact NE2-O 3.03Å
882	K	35.6	Very low	51.9	Low	161 Å²	161	97.2 Å²	97.2	70%	0.7	53%	0.525	S	S	*	.			trans	-79.4	129.8	-176.3	-63.5	177.1	179.3	179.1	0	110.9	R874 T880 A884	R874-K882 PolarHBondContact O-NZ 2.7Å; T880-K882 PolarHBondContact O-N 3.07Å; K882-A884 PolarHBondContact O-N 2.77Å
883	S	44.3	Very low	54.7	Low	98 Å²	98	92.2 Å²	92.2	69%	0.685	49%	0.492	S	S	*	.			trans	-77.4	78	-179.1	41.4	0	0	0	0	112.8
884	A	57.7	Low	57.7	Low	85 Å²	85	89.4 Å²	89.4	70%	0.702	47%	0.468	S	S	*	.			trans	-62.4	143.8	165.3	0	0	0	0	0	110.9	K882 R886	K882-A884 PolarHBondContact O-N 2.77Å; A884-R886 PolarHBondContact O-N 3.08Å
885	T	68.3	Low	60.7	Low	38 Å²	38	82.3 Å²	82.3	23%	0.233	44%	0.443	C	S	.	.			trans	-68	123.8	177.5	-63.2	0	0	0	0	109.9	D860 L862 L887	D860-T885 HydrophobicContact CB-CG2 4.17Å; L862-T885 HydrophobicContact CD1-CG2 4.2Å; L862-T885 HydrophobicContact CD2-CG2 3.75Å; L862-T885 HydrophobicContact CG-CG2 4.05Å; T885-L887 PolarHBondContact O-N 3.35Å
886	R	74.5	Confident	63.5	Low	109 Å²	109	79.8 Å²	79.8	41%	0.411	43%	0.429	S	S	.	.			trans	-84.3	110.6	-178.3	-163.5	177.2	-167.4	-132.8	5.6	110.8	A859 D860 A884	A859-R886 CarbonylContact C-O 3.58Å; A859-R886 WeakPolarHBondContact CA-O 3.35Å; D860-R886 PolarHBondContact N-O 3.5Å; D860-R886 WeakPolarHBondContact OD2-CB 3.26Å; D860-R886 PolarHBondContact OD2-N 2.81Å; A884-R886 PolarHBondContact O-N 3.08Å
887	L	84.4	Confident	66	Low	25 Å²	25	79.8 Å²	79.8	13%	0.131	42%	0.418	C	S	.	.			trans	-65	145.6	163.7	-70.3	176.8	0	0	0	110.5	R774 I775 L776 L815 P817 T885	R774-L887 HydrophobicContact CB-CD1 4.3Å; I775-L887 WeakPolarHBondContact O-CD2 3.21Å; L776-L887 HydrophobicContact CB-CD2 3.6Å; L776-L887 HydrophobicContact CD1-CD2 3.7Å; L776-L887 HydrophobicContact CG-CD2 4.2Å; L815-L887 HydrophobicContact CB-CD1 4.09Å; L815-L887 WeakPolarHBondContact O-CD1 3.41Å; P817-L887 HydrophobicContact CB-CD1 4.47Å; P817-L887 HydrophobicContact CB-CD2 4.32Å; T885-L887 PolarHBondContact O-N 3.35Å
888	G	84.1	Confident	68.4	Low	0 Å²	0	75.2 Å²	75.2	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	162.3	171.4	0	0	0	0	0	112.3	R774 I775 T857	R774-G888 CarbonylContact C-O 3.54Å; R774-G888 WeakPolarHBondContact CA-O 3.46Å; I775-G888 PolarHBondContact N-O 3.31Å; I775-G888 PolarHBondContact O-N 2.86Å; T857-G888 VanDerWaalsContact O-CA 3.25Å; T857-G888 WeakPolarHBondContact O-CA 3.45Å
889	V	83.6	Confident	70.7	Confident	66 Å²	66	74.4 Å²	74.4	40%	0.4	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	148.2	170.9	-173.9	0	0	0	0	108.9	T857	T857-V889 WeakPolarHBondContact CA-O 3.25Å; T857-V889 WeakPolarHBondContact CB-O 3.45Å; T857-V889 PolarHBondContact O-N 3.45Å; T857-V889 VanDerWaalsContact O-N 3.16Å
890	C	84.3	Confident	72.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.349	C	S	.	.			trans	-141.4	156.2	165	69.1	0	0	0	0	109.5	N772 P773 I775 T857 I911 N913	N772-C890 CarbonylContact C-O 3.52Å; N772-C890 WeakPolarHBondContact CA-O 3.3Å; P773-C890 WeakPolarHBondContact CD-O 3.37Å; I775-C890 HydrophobicContact CD1-CB 4.34Å; T857-C890 HydrophobicContact CG2-CB 4.3Å; C890-I911 HydrophobicContact CB-CG2 3.8Å; C890-I911 VanDerWaalsContact SG-CG2 3.54Å; C890-N913 HydrophobicContact CB-CB 4.44Å
891	N	84.3	Confident	74.3	Confident	54 Å²	54	67.2 Å²	67.2	29%	0.289	35%	0.347	S	S	.	.	S	Bend	trans	-73	-35	-175.8	-59.8	32.6	0	0	0	112	N771 N772 K912 N913 N914	N771-N891 WeakPolarHBondContact CA-O 3.27Å; N772-N891 PolarHBondContact N-O 2.82Å; N772-N891 WeakPolarHBondContact OD1-CA 3.39Å; N772-N891 PolarHBondContact OD1-O 3.29Å; N891-K912 PolarHBondContact N-O 3.47Å; N891-K912 VanDerWaalsContact N-O 3.1Å; N891-N913 PolarHBondContact OD1-OD1 3.16Å; N891-N914 HydrophobicContact CB-CB 4.42Å
892	H	86	Confident	76.1	Confident	56 Å²	56	66 Å²	66	26%	0.259	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	138.8	-174.7	-172.4	67.4	0	0	0	112.5	N771 E894 K912	N771-H892 PolarHBondContact OD1-ND1 3.48Å; H892-E894 IonicContact NE2-OE2 3.94Å; H892-K912 HydrophobicContact CB-CB 4.34Å; H892-K912 PolarHBondContact N-O 2.84Å; H892-K912 VanDerWaalsContact N-O 3.13Å; H892-K912 PolarHBondContact O-N 3.47Å
893	F	91.1	Very high	77.8	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	134	176.5	164.6	-84.2	0	0	0	108.7	V769 L770 P773 I819 F821 I840 F842 V895 T909 I911	V769-F893 CarbonylContact C-O 3.49Å; V769-F893 WeakPolarHBondContact CA-O 3.44Å; L770-F893 HydrophobicContact CB-CB 4.42Å; L770-F893 HydrophobicContact CB-CD1 4.25Å; L770-F893 PolarHBondContact N-O 3.11Å; L770-F893 PolarHBondContact O-N 3.21Å; P773-F893 HydrophobicContact CG-CB 4Å; I819-F893 HydrophobicContact CD1-CB 4.06Å; I819-F893 HydrophobicContact CD1-CD1 4Å; I819-F893 HydrophobicContact CD1-CD2 3.48Å; I819-F893 VanDerWaalsContact CD1-CD2 3.48Å; I819-F893 HydrophobicContact CD1-CE1 4.35Å; I819-F893 HydrophobicContact CD1-CE2 3.87Å; I819-F893 HydrophobicContact CD1-CG 3.57Å; I819-F893 HydrophobicContact CD1-CZ 4.29Å; F821-F893 HydrophobicContact CZ-CE2 4.39Å; I840-F893 HydrophobicContact CD1-CD1 4.15Å; I840-F893 HydrophobicContact CD1-CE1 3.57Å; I840-F893 HydrophobicContact CD1-CZ 4.14Å; I840-F893 HydrophobicContact CG2-CZ 4.37Å; F842-F893 AromaticContact CE2-CE2 3.71Å; F842-F893 HydrophobicContact CE2-CE2 3.71Å; F842-F893 AromaticContact CE2-CZ 3.61Å; F842-F893 HydrophobicContact CE2-CZ 3.61Å; F842-F893 AromaticContact CZ-CE2 3.9Å; F842-F893 HydrophobicContact CZ-CE2 3.9Å; F842-F893 AromaticContact CZ-CZ 3.7Å; F842-F893 HydrophobicContact CZ-CZ 3.7Å; F893-V895 HydrophobicContact CE1-CG2 4.02Å; F893-V895 HydrophobicContact CZ-CG2 3.7Å; F893-T909 HydrophobicContact CD2-CG2 4.2Å; F893-T909 HydrophobicContact CE2-CG2 3.52Å; F893-T909 HydrophobicContact CZ-CG2 4.1Å; F893-I911 HydrophobicContact CD2-CD1 4.21Å; F893-I911 HydrophobicContact CD2-CG1 3.99Å
894	E	91	Very high	79.4	Confident	38 Å²	38	63.5 Å²	63.5	18%	0.178	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.4	144	-177.8	-176	-177.4	-173.8	0	0	111.3	T768 V769 H892 R896 T909 F910	T768-E894 CarbonylContact O-C 2.99Å; T768-E894 VanDerWaalsContact O-CA 3.31Å; T768-E894 WeakPolarHBondContact O-CA 3.36Å; V769-E894 HydrophobicContact CG2-CG 4.24Å; H892-E894 IonicContact NE2-OE2 3.94Å; E894-R896 HydrophobicContact CG-CG 4.06Å; E894-R896 WeakPolarHBondContact OE1-CG 3.41Å; E894-R896 IonicContact OE1-CZ 3.7Å; E894-R896 IonicContact OE1-NE 3.89Å; E894-R896 PolarHBondContact OE1-NE 3.2Å; E894-R896 IonicContact OE1-NH2 3.91Å; E894-R896 PolarHBondContact OE1-NH2 2.91Å; E894-R896 IonicContact OE2-CZ 3.34Å; E894-R896 VanDerWaalsContact OE2-CZ 3.29Å; E894-R896 IonicContact OE2-NE 2.68Å; E894-R896 PolarHBondContact OE2-NE 3Å; E894-R896 VanDerWaalsContact OE2-NE 3.07Å; E894-R896 IonicContact OE2-NH2 3.07Å; E894-R896 PolarHBondContact OE2-NH2 3.33Å; E894-T909 CarbonylContact O-C 3.59Å; E894-T909 WeakPolarHBondContact O-CA 3.29Å; E894-F910 HydrophobicContact CB-CB 4.38Å; E894-F910 PolarHBondContact N-O 3.49Å; E894-F910 PolarHBondContact O-N 3.38Å
895	V	89.6	Confident	80.3	Confident	15 Å²	15	62.8 Å²	62.8	9%	0.091	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	108.4	171.5	-175	0	0	0	0	109.3	P761 T768 F842 F893 F907 L908 T909	P761-V895 HydrophobicContact CG-CG2 4.41Å; T768-V895 HydrophobicContact CG2-CB 4.3Å; T768-V895 PolarHBondContact O-N 3.5Å; F842-V895 HydrophobicContact CZ-CG2 4.34Å; F893-V895 HydrophobicContact CE1-CG2 4.02Å; F893-V895 HydrophobicContact CZ-CG2 3.7Å; V895-F907 HydrophobicContact CG1-CD1 4.36Å; V895-L908 WeakPolarHBondContact CA-O 3.37Å; V895-T909 HydrophobicContact CG2-CG2 4.06Å
896	R	87	Confident	80.9	Confident	127 Å²	127	64.2 Å²	64.2	48%	0.479	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	146.7	175.1	-55	-174.7	179.8	166.5	9.3	111.3	E894 F907 L908 F910	E894-R896 HydrophobicContact CG-CG 4.06Å; E894-R896 WeakPolarHBondContact OE1-CG 3.41Å; E894-R896 IonicContact OE1-CZ 3.7Å; E894-R896 IonicContact OE1-NE 3.89Å; E894-R896 PolarHBondContact OE1-NE 3.2Å; E894-R896 IonicContact OE1-NH2 3.91Å; E894-R896 PolarHBondContact OE1-NH2 2.91Å; E894-R896 IonicContact OE2-CZ 3.34Å; E894-R896 VanDerWaalsContact OE2-CZ 3.29Å; E894-R896 IonicContact OE2-NE 2.68Å; E894-R896 PolarHBondContact OE2-NE 3Å; E894-R896 VanDerWaalsContact OE2-NE 3.07Å; E894-R896 IonicContact OE2-NH2 3.07Å; E894-R896 PolarHBondContact OE2-NH2 3.33Å; R896-F907 WeakPolarHBondContact O-CA 3.4Å; R896-L908 PolarHBondContact N-O 2.93Å; R896-L908 PolarHBondContact O-N 2.95Å; R896-F910 HydrophobicContact CB-CE2 3.87Å; R896-F910 HydrophobicContact CG-CD2 4.12Å; R896-F910 HydrophobicContact CG-CE2 3.75Å
897	Q	83	Confident	81.4	Confident	100 Å²	100	62.5 Å²	62.5	47%	0.467	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	130	164	-179.1	173.7	-42.2	0	0	108.4	H899 T905 F907	Q897-H899 PolarHBondContact NE2-NE2 3.02Å; Q897-T905 HydrophobicContact CG-CG2 4.17Å; Q897-F907 HydrophobicContact CB-CD1 4.15Å; Q897-F907 HydrophobicContact CB-CE1 3.78Å; Q897-F907 HydrophobicContact CB-CZ 4.32Å; Q897-F907 HydrophobicContact CG-CE1 4.02Å; Q897-F907 HydrophobicContact CG-CZ 4.04Å; Q897-F907 VanDerWaalsContact OE1-CZ 3.23Å
898	L	79	Confident	81.6	Confident	56 Å²	56	61.6 Å²	61.6	29%	0.293	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	125.3	178.8	-169.7	147.9	0	0	0	108.4	L741 L900 K906 L908	L741-L898 HydrophobicContact CD1-CD1 3.97Å; L741-L898 HydrophobicContact CD2-CD2 4.31Å; L898-L900 HydrophobicContact CD2-CD2 3.96Å; L898-K906 PolarHBondContact N-O 3.27Å; L898-K906 PolarHBondContact O-N 3.16Å; L898-L908 HydrophobicContact CB-CD1 4.4Å; L898-L908 HydrophobicContact CD1-CD1 4Å
899	H	77.5	Confident	81.9	Confident	124 Å²	124	61.6 Å²	61.6	57%	0.574	32%	0.317	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.4	135.8	175.5	-60.8	87.6	0	0	0	108.9	Q897 T905	Q897-H899 PolarHBondContact NE2-NE2 3.02Å; H899-T905 WeakPolarHBondContact CD2-CG2 3.4Å; H899-T905 WeakPolarHBondContact NE2-CG2 3.48Å
900	L	74.4	Confident	82.2	Confident	28 Å²	28	59.2 Å²	59.2	15%	0.147	30%	0.301	C	S	.	.			trans	-97.1	164.2	174.7	-63.8	174.8	0	0	0	110	L898 D902 D903 S904 K906	L898-L900 HydrophobicContact CD2-CD2 3.96Å; L900-D902 PolarHBondContact O-N 3.07Å; L900-D902 VanDerWaalsContact O-N 3.16Å; L900-D903 PolarHBondContact O-N 3.42Å; L900-S904 WeakPolarHBondContact CB-O 3.33Å; L900-S904 PolarHBondContact N-O 3.19Å; L900-K906 HydrophobicContact CD1-CB 4.23Å; L900-K906 HydrophobicContact CD1-CD 4.18Å; L900-K906 HydrophobicContact CD2-CD 4.29Å; L900-K906 HydrophobicContact CG-CB 4.33Å
901	P	67.8	Low	82.4	Confident	91 Å²	91	59.2 Å²	59.2	59%	0.591	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-30.2	175.5	-27.2	36.3	0	0	0	113.9	L742 D903	L742-P901 HydrophobicContact CB-CG 3.99Å; P901-D903 PolarHBondContact O-N 3.38Å
902	D	71.4	Confident	82.4	Confident	115 Å²	115	59.7 Å²	59.7	62%	0.615	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	23.7	178.7	-30.4	-58.5	0	0	0	113.7	L900 S904	L900-D902 PolarHBondContact O-N 3.07Å; L900-D902 VanDerWaalsContact O-N 3.16Å; D902-S904 PolarHBondContact O-N 3.12Å
903	D	71.6	Confident	81.8	Confident	150 Å²	150	58.5 Å²	58.5	80%	0.802	30%	0.296	S	S	*	.	S	Bend	trans	52.7	-9.6	-163.4	-78.6	-41.9	0	0	0	116.3	L900 P901	L900-D903 PolarHBondContact O-N 3.42Å; P901-D903 PolarHBondContact O-N 3.38Å
904	S	77.3	Confident	80	Confident	56 Å²	56	62.5 Å²	62.5	39%	0.392	32%	0.318	S	S	.	.			trans	-73.4	138.3	-170	71.4	0	0	0	0	112.9	L900 D902	L900-S904 WeakPolarHBondContact CB-O 3.33Å; L900-S904 PolarHBondContact N-O 3.19Å; D902-S904 PolarHBondContact O-N 3.12Å
905	T	75.3	Confident	78.1	Confident	70 Å²	70	62 Å²	62	43%	0.429	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	130.8	-174.1	47.3	0	0	0	0	113	Q897 H899	Q897-T905 HydrophobicContact CG-CG2 4.17Å; H899-T905 WeakPolarHBondContact CD2-CG2 3.4Å; H899-T905 WeakPolarHBondContact NE2-CG2 3.48Å
906	K	81.6	Confident	76	Confident	69 Å²	69	66.8 Å²	66.8	30%	0.3	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	109.9	-175.1	-164.9	-177.1	-142.6	155.1	0	110.9	L741 L898 L900	L741-K906 HydrophobicContact CD2-CD 4.48Å; L898-K906 PolarHBondContact N-O 3.27Å; L898-K906 PolarHBondContact O-N 3.16Å; L900-K906 HydrophobicContact CD1-CB 4.23Å; L900-K906 HydrophobicContact CD1-CD 4.18Å; L900-K906 HydrophobicContact CD2-CD 4.29Å; L900-K906 HydrophobicContact CG-CB 4.33Å
907	F	85.5	Confident	73.6	Confident	73 Å²	73	68.6 Å²	68.6	32%	0.32	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	135.3	174	-65.5	-88.4	0	0	0	111.2	S758 V895 R896 Q897	S758-F907 WeakPolarHBondContact CA-O 3.42Å; S758-F907 PolarHBondContact OG-O 3.13Å; V895-F907 HydrophobicContact CG1-CD1 4.36Å; R896-F907 WeakPolarHBondContact O-CA 3.4Å; Q897-F907 HydrophobicContact CB-CD1 4.15Å; Q897-F907 HydrophobicContact CB-CE1 3.78Å; Q897-F907 HydrophobicContact CB-CZ 4.32Å; Q897-F907 HydrophobicContact CG-CE1 4.02Å; Q897-F907 HydrophobicContact CG-CZ 4.04Å; Q897-F907 VanDerWaalsContact OE1-CZ 3.23Å
908	L	88.6	Confident	71.3	Confident	6 Å²	6	68.6 Å²	68.6	3%	0.031	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	117.3	177.9	-68.7	174.5	0	0	0	109	K739 I756 F757 S758 V895 R896 L898 F910	K739-L908 HydrophobicContact CD-CD2 4.37Å; I756-L908 HydrophobicContact CG2-CB 4Å; I756-L908 HydrophobicContact CG2-CD2 4.01Å; I756-L908 HydrophobicContact CG2-CG 4.45Å; F757-L908 WeakPolarHBondContact O-CA 3.42Å; S758-L908 WeakPolarHBondContact OG-CD2 3.4Å; V895-L908 WeakPolarHBondContact CA-O 3.37Å; R896-L908 PolarHBondContact N-O 2.93Å; R896-L908 PolarHBondContact O-N 2.95Å; L898-L908 HydrophobicContact CB-CD1 4.4Å; L898-L908 HydrophobicContact CD1-CD1 4Å; L908-F910 HydrophobicContact CB-CD2 4.27Å; L908-F910 HydrophobicContact CB-CE2 3.5Å; L908-F910 HydrophobicContact CB-CZ 4.03Å; L908-F910 HydrophobicContact CD1-CE2 4.48Å; L908-F910 HydrophobicContact CD1-CZ 4.23Å; L908-F910 VanDerWaalsContact O-CD2 3.3Å; L908-F910 WeakPolarHBondContact O-CD2 3.41Å; L908-F910 WeakPolarHBondContact O-CE2 3.31Å
909	T	90.2	Very high	69.2	Low	0 Å²	0	67.9 Å²	67.9	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	121.1	170.9	-51.2	0	0	0	0	108.7	I756 F757 K759 F842 F893 E894 V895 I911	I756-T909 VanDerWaalsContact CA-O 3.29Å; I756-T909 WeakPolarHBondContact CA-O 3.35Å; F757-T909 HydrophobicContact CE1-CG2 3.66Å; F757-T909 HydrophobicContact CE2-CG2 4.14Å; F757-T909 HydrophobicContact CZ-CG2 3.42Å; F757-T909 VanDerWaalsContact CZ-CG2 3.42Å; F757-T909 PolarHBondContact N-O 3.41Å; F757-T909 PolarHBondContact O-N 3.46Å; K759-T909 PolarHBondContact O-OG1 3.28Å; F842-T909 HydrophobicContact CE1-CG2 4.44Å; F842-T909 HydrophobicContact CZ-CG2 3.94Å; F893-T909 HydrophobicContact CD2-CG2 4.2Å; F893-T909 HydrophobicContact CE2-CG2 3.52Å; F893-T909 HydrophobicContact CZ-CG2 4.1Å; E894-T909 CarbonylContact O-C 3.59Å; E894-T909 WeakPolarHBondContact O-CA 3.29Å; V895-T909 HydrophobicContact CG2-CG2 4.06Å; T909-I911 HydrophobicContact CG2-CG1 4.3Å
910	F	89.7	Confident	66.8	Low	16 Å²	16	68.3 Å²	68.3	7%	0.07	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	135	176.1	-61.3	-105.7	0	0	0	108.8	F752 L755 I756 E894 R896 L908	F752-F910 HydrophobicContact CD2-CD1 4.19Å; F752-F910 HydrophobicContact CE1-CB 4.4Å; F752-F910 HydrophobicContact CE1-CD1 4.25Å; F752-F910 AromaticContact CE2-CD1 3.86Å; F752-F910 HydrophobicContact CE2-CD1 3.86Å; F752-F910 HydrophobicContact CZ-CB 3.98Å; F752-F910 AromaticContact CZ-CD1 3.89Å; F752-F910 HydrophobicContact CZ-CD1 3.89Å; F752-F910 HydrophobicContact CZ-CG 4.44Å; L755-F910 CarbonylContact O-C 3.49Å; L755-F910 WeakPolarHBondContact O-CA 3.48Å; I756-F910 HydrophobicContact CB-CD1 4.5Å; I756-F910 HydrophobicContact CD1-CD1 3.7Å; I756-F910 HydrophobicContact CD1-CE1 3.45Å; I756-F910 VanDerWaalsContact CD1-CE1 3.45Å; I756-F910 HydrophobicContact CD1-CZ 4.36Å; I756-F910 HydrophobicContact CG1-CD1 3.62Å; I756-F910 HydrophobicContact CG1-CE1 3.86Å; I756-F910 HydrophobicContact CG1-CG 4.35Å; I756-F910 HydrophobicContact CG2-CD1 4.14Å; I756-F910 HydrophobicContact CG2-CD2 4.44Å; I756-F910 HydrophobicContact CG2-CE1 4.06Å; I756-F910 HydrophobicContact CG2-CE2 4.34Å; I756-F910 HydrophobicContact CG2-CG 4.32Å; I756-F910 HydrophobicContact CG2-CZ 4.15Å; E894-F910 HydrophobicContact CB-CB 4.38Å; E894-F910 PolarHBondContact N-O 3.49Å; E894-F910 PolarHBondContact O-N 3.38Å; R896-F910 HydrophobicContact CB-CE2 3.87Å; R896-F910 HydrophobicContact CG-CD2 4.12Å; R896-F910 HydrophobicContact CG-CE2 3.75Å; L908-F910 HydrophobicContact CB-CD2 4.27Å; L908-F910 HydrophobicContact CB-CE2 3.5Å; L908-F910 HydrophobicContact CB-CZ 4.03Å; L908-F910 HydrophobicContact CD1-CE2 4.48Å; L908-F910 HydrophobicContact CD1-CZ 4.23Å; L908-F910 VanDerWaalsContact O-CD2 3.3Å; L908-F910 WeakPolarHBondContact O-CD2 3.41Å; L908-F910 WeakPolarHBondContact O-CE2 3.31Å
911	I	88.7	Confident	64.6	Low	0 Å²	0	71.7 Å²	71.7	0%	0	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	123.1	172.9	-51.6	-173.4	0	0	0	107.7	G754 L755 F757 F821 I853 M856 C890 F893 T909	G754-I911 WeakPolarHBondContact CA-O 3.18Å; L755-I911 HydrophobicContact CB-CB 4.41Å; L755-I911 HydrophobicContact CD2-CD1 4.43Å; L755-I911 PolarHBondContact N-O 2.83Å; L755-I911 PolarHBondContact O-N 3.12Å; F757-I911 HydrophobicContact CE1-CD1 3.86Å; F757-I911 HydrophobicContact CE1-CG1 4.23Å; F757-I911 HydrophobicContact CZ-CD1 4.36Å; F821-I911 HydrophobicContact CE2-CD1 4.4Å; F821-I911 HydrophobicContact CZ-CD1 3.88Å; I853-I911 HydrophobicContact CG1-CD1 4.39Å; M856-I911 HydrophobicContact CE-CB 3.76Å; M856-I911 HydrophobicContact CE-CG2 3.46Å; M856-I911 VanDerWaalsContact CE-CG2 3.46Å; M856-I911 HydrophobicContact SD-CG2 4.36Å; C890-I911 HydrophobicContact CB-CG2 3.8Å; C890-I911 VanDerWaalsContact SG-CG2 3.54Å; F893-I911 HydrophobicContact CD2-CD1 4.21Å; F893-I911 HydrophobicContact CD2-CG1 3.99Å; T909-I911 HydrophobicContact CG2-CG1 4.3Å
912	K	83.4	Confident	62.9	Low	64 Å²	64	74.8 Å²	74.8	28%	0.278	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	129.6	-175.5	-149	-169.9	-169.2	-154.4	0	110.3	F752 P753 N891 H892 N914	F752-K912 HydrophobicContact CZ-CB 4.05Å; F752-K912 HydrophobicContact CZ-CG 4.04Å; P753-K912 WeakPolarHBondContact O-CG 3.22Å; N891-K912 PolarHBondContact N-O 3.47Å; N891-K912 VanDerWaalsContact N-O 3.1Å; H892-K912 HydrophobicContact CB-CB 4.34Å; H892-K912 PolarHBondContact N-O 2.84Å; H892-K912 VanDerWaalsContact N-O 3.13Å; H892-K912 PolarHBondContact O-N 3.47Å; K912-N914 WeakPolarHBondContact CD-OD1 3.3Å; K912-N914 WeakPolarHBondContact CE-OD1 3.35Å; K912-N914 PolarHBondContact NZ-OD1 2.91Å
913	N	73.7	Confident	60.9	Low	30 Å²	30	75.5 Å²	75.5	16%	0.16	43%	0.427	C	S	.	.			trans	-119.8	121.1	170.7	-167.8	-3.6	0	0	0	108.1	M856 C890 N891	M856-N913 HydrophobicContact CG-CB 4.17Å; M856-N913 PolarHBondContact O-ND2 3.45Å; C890-N913 HydrophobicContact CB-CB 4.44Å; N891-N913 PolarHBondContact OD1-OD1 3.16Å
914	N	54.2	Low	58.9	Low	84 Å²	84	73.2 Å²	73.2	45%	0.449	42%	0.423	S	S	.	.			trans	-128.5	5.9	-157.5	-140.6	100	0	0	0	113.5	N891 K912	N891-N914 HydrophobicContact CB-CB 4.42Å; K912-N914 WeakPolarHBondContact CD-OD1 3.3Å; K912-N914 WeakPolarHBondContact CE-OD1 3.35Å; K912-N914 PolarHBondContact NZ-OD1 2.91Å
915	S	51.7	Low	56.6	Low	29 Å²	29	75.2 Å²	75.2	20%	0.203	43%	0.43	C	S	.	.			trans	-76	132.3	175.2	54.1	0	0	0	0	112.1	T918 R932	S915-T918 PolarHBondContact OG-OG1 2.83Å; S915-R932 PolarHBondContact O-NH2 3.24Å
916	T	44.9	Very low	54.6	Low	114 Å²	114	75.9 Å²	75.9	70%	0.699	44%	0.435	S	S	*	.	S	Bend	trans	-81.2	-34.5	151.7	40.9	0	0	0	0	110.4
917	E	37.1	Very low	52.5	Low	165 Å²	165	76.4 Å²	76.4	77%	0.771	44%	0.44	S	S	*	.			trans	-124.5	86.8	-167.9	-70.1	159.4	-151.6	0	0	111.7
918	T	33.5	Very low	50.5	Low	100 Å²	100	77.2 Å²	77.2	61%	0.613	44%	0.441	S	S	*	.			trans	-143.8	63.4	163.9	49.3	0	0	0	0	110.5	S915	S915-T918 PolarHBondContact OG-OG1 2.83Å
919	G	34.6	Very low	48.6	Very low	42 Å²	42	82 Å²	82	43%	0.433	46%	0.46	S	S	.	.	S	Bend	trans	-97.2	-11.6	165.3	0	0	0	0	0	113.7
920	L	28.3	Very low	46.8	Very low	132 Å²	132	85.1 Å²	85.1	69%	0.691	48%	0.476	S	S	*	.	S	Bend	trans	-108.6	153.8	-175.2	-60.7	174.5	0	0	0	111.2
921	A	28.5	Very low	45.4	Very low	99 Å²	99	84.8 Å²	84.8	82%	0.818	48%	0.475	S	S	*	.	S	Bend	trans	58.4	71.6	178.1	0	0	0	0	0	116.5
922	L	30.4	Very low	44.4	Very low	157 Å²	157	88.8 Å²	88.8	82%	0.822	49%	0.49	S	S	*	.	S	Bend	trans	-170.6	97.9	138.5	-103.4	164.8	0	0	0	110.7
923	D	29.6	Very low	44.2	Very low	129 Å²	129	85.9 Å²	85.9	69%	0.69	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	28.8	89.7	165.2	-59.9	-11.5	0	0	0	120.2	N925	D923-N925 VanDerWaalsContact C-N 3.29Å; D923-N925 PolarHBondContact O-N 2.93Å; D923-N925 PolarHBondContact O-ND2 3.04Å
924	S	30.4	Very low	44.7	Very low	103 Å²	103	84.5 Å²	84.5	72%	0.72	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.7	28.9	141.2	71.1	0	0	0	0	119.5	Q881	Q881-S924 PolarHBondContact NE2-O 3.03Å
925	N	28.8	Very low	46.4	Very low	98 Å²	98	80.5 Å²	80.5	52%	0.524	45%	0.449	S	S	.	.			trans	-120.2	146	175.2	-91.2	-75.7	0	0	0	112.6	D923 I927	D923-N925 VanDerWaalsContact C-N 3.29Å; D923-N925 PolarHBondContact O-N 2.93Å; D923-N925 PolarHBondContact O-ND2 3.04Å; N925-I927 PolarHBondContact O-N 3.44Å; N925-I927 VanDerWaalsContact O-N 3.17Å
926	P	33.6	Very low	48.4	Very low	84 Å²	84	79.1 Å²	79.1	55%	0.545	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-64.3	119.3	-176.7	24.9	-33.4	0	0	0	111.4	R687 R928	R687-P926 PolarHBondContact NH2-O 3.33Å; P926-R928 PolarHBondContact O-N 2.94Å
927	I	37.5	Very low	50.5	Low	79 Å²	79	74.7 Å²	74.7	41%	0.405	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-54.1	127.1	-176.3	-60.9	168.4	0	0	0	110.9	R687 N925	R687-I927 PolarHBondContact NH2-O 3.07Å; N925-I927 PolarHBondContact O-N 3.44Å; N925-I927 VanDerWaalsContact O-N 3.17Å
928	R	42.6	Very low	53.2	Low	90 Å²	90	66.9 Å²	66.9	34%	0.34	37%	0.374	S	S	.	.	P	Polyproline II helix	trans	-79.2	120.4	156.3	-84	-168.2	-176.6	137.3	7.2	106.7	A859 D860 P926 I930	A859-R928 PolarHBondContact O-NH1 2.86Å; D860-R928 IonicContact OD1-CZ 3.83Å; D860-R928 IonicContact OD1-NH1 2.68Å; D860-R928 PolarHBondContact OD1-NH1 3.47Å; D860-R928 IonicContact OD1-NH2 3.99Å; D860-R928 PolarHBondContact OD1-NH2 3.27Å; P926-R928 PolarHBondContact O-N 2.94Å; R928-I930 PolarHBondContact O-N 2.98Å
929	Y	49.2	Very low	55.9	Low	107 Å²	107	65 Å²	65	42%	0.42	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-58.1	131.8	166.6	-62	-99.4	0	0	0	108.4	Y1403	Y929-Y1403 PolarHBondContact OH-O 3.4Å
930	I	52.4	Low	58.4	Low	65 Å²	65	64.1 Å²	64.1	33%	0.333	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-87.9	121	179	-64.3	176.6	0	0	0	107.1	M856 R928	M856-I930 WeakPolarHBondContact O-CG2 3.21Å; R928-I930 PolarHBondContact O-N 2.98Å
931	T	59.6	Low	61	Low	9 Å²	9	62.7 Å²	62.7	6%	0.055	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-81.8	122.3	173.6	40.1	0	0	0	0	108.1	F679 E933	F679-T931 HydrophobicContact CD2-CG2 3.96Å; F679-T931 HydrophobicContact CE1-CG2 4.17Å; F679-T931 HydrophobicContact CE2-CG2 3.41Å; F679-T931 VanDerWaalsContact CE2-CG2 3.41Å; F679-T931 HydrophobicContact CZ-CG2 3.54Å; T931-E933 PolarHBondContact O-N 2.95Å
932	R	67.9	Low	63.5	Low	84 Å²	84	61.1 Å²	61.1	32%	0.317	31%	0.312	S	S	.	.	P	Polyproline II helix	trans	-72.4	126	-179	-73.7	-177.3	171.9	175.7	-3.1	108.9	S915	S915-R932 PolarHBondContact O-NH2 3.24Å
933	E	79.4	Confident	66.1	Low	4 Å²	4	58.1 Å²	58.1	2%	0.019	30%	0.296	C	S	.	.			trans	-104.7	153.5	174.9	-69.9	-150.5	-177.7	0	0	111.8	G754 R852 R855 T931	G754-E933 WeakPolarHBondContact CA-O 3.42Å; G754-E933 PolarHBondContact N-O 2.93Å; G754-E933 VanDerWaalsContact N-O 3.1Å; R852-E933 WeakPolarHBondContact CA-OE1 3.32Å; R852-E933 VanDerWaalsContact CB-OE2 3.32Å; R852-E933 WeakPolarHBondContact CB-OE2 3.24Å; R852-E933 WeakPolarHBondContact CG-OE2 3.32Å; R852-E933 IonicContact CZ-OE2 2.82Å; R852-E933 IonicContact NE-OE2 3.91Å; R852-E933 PolarHBondContact NE-OE2 3.48Å; R852-E933 IonicContact NH2-OE2 3.63Å; R852-E933 PolarHBondContact NH2-OE2 2.96Å; R855-E933 IonicContact CZ-OE1 2.68Å; R855-E933 IonicContact NE-OE1 2.69Å; R855-E933 PolarHBondContact NE-OE1 3.1Å; R855-E933 IonicContact NH2-OE1 3.23Å; R855-E933 PolarHBondContact NH2-OE1 3.39Å; T931-E933 PolarHBondContact O-N 2.95Å
934	A	85.1	Confident	68.6	Low	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	153.6	-179.2	0	0	0	0	0	112.2	V677 Y735 V736 H737 L751 G754 R852	V677-A934 HydrophobicContact CG2-CB 3.58Å; Y735-A934 PolarHBondContact O-N 2.82Å; Y735-A934 VanDerWaalsContact O-N 3.08Å; V736-A934 HydrophobicContact CG2-CB 4.45Å; H737-A934 PolarHBondContact N-O 3.41Å; L751-A934 HydrophobicContact CD1-CB 3.84Å; G754-A934 CarbonylContact O-C 3.49Å; R852-A934 PolarHBondContact NH2-O 3.33Å
935	T	90.1	Very high	71.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	110.4	167.9	-52.5	0	0	0	0	110.2	H737 K739 F752 G754 L755 I756	H737-T935 HydrophobicContact CB-CG2 4.22Å; H737-T935 WeakPolarHBondContact ND1-CG2 3.42Å; H737-T935 CarbonylContact O-C 3.56Å; H737-T935 VanDerWaalsContact O-CA 3.28Å; H737-T935 WeakPolarHBondContact O-CA 3.49Å; H737-T935 WeakPolarHBondContact O-CG2 3.44Å; K739-T935 HydrophobicContact CG-CG2 3.96Å; F752-T935 WeakPolarHBondContact CB-O 3.24Å; F752-T935 PolarHBondContact N-O 3.34Å; F752-T935 PolarHBondContact O-N 3.15Å; G754-T935 WeakPolarHBondContact O-CB 3.47Å; G754-T935 PolarHBondContact O-N 3.49Å; G754-T935 VanDerWaalsContact O-N 3.07Å; G754-T935 PolarHBondContact O-OG1 2.95Å; L755-T935 WeakPolarHBondContact CA-OG1 3.43Å; I756-T935 HydrophobicContact CB-CG2 3.8Å; I756-T935 HydrophobicContact CD1-CG2 4.02Å; I756-T935 HydrophobicContact CG1-CG2 3.93Å; I756-T935 PolarHBondContact N-OG1 3.21Å
936	V	92.6	Very high	74.2	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	137.6	174.7	178.5	0	0	0	0	109.1	L669 V673 V736 H737 I738 K739 L751 L938 F953	L669-V936 HydrophobicContact CD1-CG1 4.36Å; V673-V936 HydrophobicContact CG2-CG2 3.66Å; V736-V936 HydrophobicContact CG1-CG2 3.95Å; H737-V936 PolarHBondContact O-N 2.7Å; I738-V936 WeakPolarHBondContact CA-O 3.44Å; K739-V936 PolarHBondContact N-O 3.43Å; L751-V936 HydrophobicContact CD1-CG2 4.09Å; V936-L938 HydrophobicContact CG1-CD2 3.94Å; V936-L938 HydrophobicContact CG1-CG 4.25Å; V936-F953 HydrophobicContact CB-CE1 4.46Å; V936-F953 HydrophobicContact CG1-CE1 4.48Å; V936-F953 HydrophobicContact CG1-CZ 4.38Å; V936-F953 HydrophobicContact CG2-CE1 3.93Å; V936-F953 HydrophobicContact CG2-CZ 3.79Å
937	I	90	Very high	76.8	Confident	22 Å²	22	44.7 Å²	44.7	11%	0.113	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	108.6	173.2	-55.8	178	0	0	0	107.1	K739 L741 S749 D750 I756 R939	K739-I937 HydrophobicContact CB-CG1 4.47Å; L741-I937 HydrophobicContact CD1-CG2 3.66Å; L741-I937 HydrophobicContact CG-CG2 4.11Å; S749-I937 CarbonylContact C-O 3.51Å; S749-I937 VanDerWaalsContact CA-O 3.23Å; S749-I937 WeakPolarHBondContact CA-O 3.26Å; S749-I937 WeakPolarHBondContact CB-O 3.5Å; D750-I937 PolarHBondContact N-O 3.08Å; D750-I937 PolarHBondContact O-N 3.05Å; I756-I937 HydrophobicContact CD1-CD1 3.83Å; I756-I937 HydrophobicContact CD1-CG1 4.13Å; I937-R939 HydrophobicContact CG2-CG 4.13Å
938	L	93.2	Very high	79.3	Confident	0 Å²	0	44.4 Å²	44.4	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	136.5	169.2	-60.8	-179.7	0	0	0	109.4	W662 L669 I738 K739 L741 V936 L946 K950	W662-L938 HydrophobicContact CZ3-CD2 4.37Å; L669-L938 HydrophobicContact CD1-CD2 4.07Å; I738-L938 HydrophobicContact CG2-CD1 3.63Å; I738-L938 HydrophobicContact CG2-CG 3.88Å; K739-L938 PolarHBondContact O-N 3.05Å; L741-L938 PolarHBondContact N-O 3Å; V936-L938 HydrophobicContact CG1-CD2 3.94Å; V936-L938 HydrophobicContact CG1-CG 4.25Å; L938-L946 HydrophobicContact CB-CD2 3.72Å; L938-K950 HydrophobicContact CD1-CB 4.06Å
939	R	89.4	Confident	81.6	Confident	62 Å²	62	40.1 Å²	40.1	23%	0.234	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	145.1	-179.5	-57.1	-155.7	-139.8	-170.2	6.7	110.2	W662 L741 D743 N746 K748 S749 I937	W662-R939 WeakPolarHBondContact CH2-O 3.15Å; L741-R939 WeakPolarHBondContact O-CA 3.45Å; D743-R939 HydrophobicContact CB-CB 4.16Å; D743-R939 HydrophobicContact CB-CG 4.39Å; D743-R939 WeakPolarHBondContact OD2-CD 3.44Å; D743-R939 IonicContact OD2-CZ 2.75Å; D743-R939 IonicContact OD2-NE 3.75Å; D743-R939 IonicContact OD2-NH1 3.37Å; D743-R939 PolarHBondContact OD2-NH1 2.87Å; N746-R939 VanDerWaalsContact CA-O 3.24Å; N746-R939 WeakPolarHBondContact CA-O 3.28Å; N746-R939 WeakPolarHBondContact CB-O 3.24Å; K748-R939 VanDerWaalsContact O-CZ 3.3Å; K748-R939 PolarHBondContact O-NE 3.21Å; K748-R939 PolarHBondContact O-NH2 3.16Å; K748-R939 VanDerWaalsContact O-NH2 3.14Å; S749-R939 PolarHBondContact OG-N 2.89Å; S749-R939 PolarHBondContact OG-O 2.91Å; I937-R939 HydrophobicContact CG2-CG 4.13Å
940	D	87.5	Confident	83.7	Confident	22 Å²	22	38.4 Å²	38.4	12%	0.118	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.5	167.4	174	-151.8	-18.1	0	0	0	108.7	W662 L742 D743 S945 L946	W662-D940 HydrophobicContact CZ2-CB 4.15Å; W662-D940 WeakPolarHBondContact CZ2-OD2 3.49Å; L742-D940 WeakPolarHBondContact CA-O 3.21Å; D743-D940 PolarHBondContact N-O 3.23Å; D743-D940 VanDerWaalsContact N-O 3.09Å; D743-D940 CarbonylContact O-C 3.54Å; D743-D940 WeakPolarHBondContact O-CA 3.44Å; D743-D940 PolarHBondContact O-N 3.46Å; D940-S945 VanDerWaalsContact OD2-CB 3.24Å; D940-S945 WeakPolarHBondContact OD2-CB 3.12Å; D940-L946 HydrophobicContact CB-CD1 3.94Å; D940-L946 HydrophobicContact CB-CD2 3.89Å; D940-L946 HydrophobicContact CB-CG 3.53Å
941	N	82.5	Confident	85.4	Confident	102 Å²	102	41.4 Å²	41.4	55%	0.545	20%	0.197	S	C	.	.	S	Bend	trans	-74.2	-36.7	168.2	-85.2	-45.1	0	0	0	112.5	E744	E744-N941 WeakPolarHBondContact CA-OD1 3.38Å; E744-N941 PolarHBondContact O-ND2 3.38Å
942	D	82.4	Confident	86.9	Confident	67 Å²	67	41 Å²	41	36%	0.358	20%	0.195	S	C	.	.			trans	-98.4	126	-173.8	170.3	30.8	0	0	0	113.2	A944 S945 L946	D942-A944 VanDerWaalsContact C-N 3.3Å; D942-A944 PolarHBondContact O-N 3.42Å; D942-A944 WeakPolarHBondContact OD1-CB 3.49Å; D942-A944 PolarHBondContact OD1-N 2.84Å; D942-S945 PolarHBondContact O-N 3.45Å; D942-S945 VanDerWaalsContact OD2-CB 3.24Å; D942-S945 WeakPolarHBondContact OD2-CB 3.28Å; D942-S945 PolarHBondContact OD2-N 3.38Å; D942-S945 PolarHBondContact OD2-OG 3.26Å; D942-L946 WeakPolarHBondContact O-CB 3.49Å; D942-L946 WeakPolarHBondContact O-CG 3.23Å; D942-L946 PolarHBondContact O-N 2.84Å
943	L	84.3	Confident	88.3	Confident	93 Å²	93	37 Å²	37	49%	0.487	18%	0.18	S	C	.	.	H	α-helix	trans	-65	-31.7	176.4	-171.4	65.7	0	0	0	112.9	K740 L742 I947	K740-L943 PolarHBondContact NZ-O 3.37Å; L742-L943 HydrophobicContact CD2-CB 4.24Å; L742-L943 HydrophobicContact CD2-CD1 4.42Å; L943-I947 VanDerWaalsContact O-CG1 3.31Å; L943-I947 WeakPolarHBondContact O-CG1 3.23Å; L943-I947 PolarHBondContact O-N 2.6Å; L943-I947 VanDerWaalsContact O-N 3.11Å
944	A	82.2	Confident	88.9	Confident	35 Å²	35	39.1 Å²	39.1	29%	0.289	19%	0.191	S	C	.	.	H	α-helix	trans	-73.2	-46.3	177.5	0	0	0	0	0	111	D942 L946 I947 R948	D942-A944 VanDerWaalsContact C-N 3.3Å; D942-A944 PolarHBondContact O-N 3.42Å; D942-A944 WeakPolarHBondContact OD1-CB 3.49Å; D942-A944 PolarHBondContact OD1-N 2.84Å; A944-L946 VanDerWaalsContact C-N 3.29Å; A944-L946 PolarHBondContact O-N 3.13Å; A944-I947 CarbonylContact O-C 3.21Å; A944-I947 WeakPolarHBondContact O-CA 3.36Å; A944-I947 VanDerWaalsContact O-CB 3.28Å; A944-I947 WeakPolarHBondContact O-CB 3.37Å; A944-I947 PolarHBondContact O-N 3.37Å; A944-R948 WeakPolarHBondContact O-CG 3.47Å; A944-R948 PolarHBondContact O-N 3.31Å
945	S	87.1	Confident	89.2	Confident	22 Å²	22	39.3 Å²	39.3	15%	0.154	19%	0.192	C	C	.	.	H	α-helix	trans	-57.1	-41.7	171.1	-63.5	0	0	0	0	111.1	D940 D942 I947 R948 A949	D940-S945 VanDerWaalsContact OD2-CB 3.24Å; D940-S945 WeakPolarHBondContact OD2-CB 3.12Å; D942-S945 PolarHBondContact O-N 3.45Å; D942-S945 VanDerWaalsContact OD2-CB 3.24Å; D942-S945 WeakPolarHBondContact OD2-CB 3.28Å; D942-S945 PolarHBondContact OD2-N 3.38Å; D942-S945 PolarHBondContact OD2-OG 3.26Å; S945-I947 VanDerWaalsContact C-N 3.28Å; S945-I947 PolarHBondContact O-N 3.49Å; S945-R948 PolarHBondContact O-N 3.39Å; S945-R948 VanDerWaalsContact O-N 3.13Å; S945-A949 VanDerWaalsContact O-CB 3.26Å; S945-A949 WeakPolarHBondContact O-CB 3.32Å; S945-A949 PolarHBondContact O-N 2.94Å
946	L	90.7	Very high	89.3	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-62.8	-25.2	169.1	-78.2	165.7	0	0	0	115	K740 L741 L742 L938 D940 D942 A944 K950	K740-L946 HydrophobicContact CB-CB 4.46Å; K740-L946 HydrophobicContact CB-CD1 4.46Å; K740-L946 HydrophobicContact CD-CB 4.04Å; K740-L946 WeakPolarHBondContact CD-O 3.19Å; L741-L946 VanDerWaalsContact O-CD1 3.24Å; L741-L946 WeakPolarHBondContact O-CD1 3.46Å; L742-L946 HydrophobicContact CD2-CD1 3.74Å; L938-L946 HydrophobicContact CB-CD2 3.72Å; D940-L946 HydrophobicContact CB-CD1 3.94Å; D940-L946 HydrophobicContact CB-CD2 3.89Å; D940-L946 HydrophobicContact CB-CG 3.53Å; D942-L946 WeakPolarHBondContact O-CB 3.49Å; D942-L946 WeakPolarHBondContact O-CG 3.23Å; D942-L946 PolarHBondContact O-N 2.84Å; A944-L946 VanDerWaalsContact C-N 3.29Å; A944-L946 PolarHBondContact O-N 3.13Å; L946-K950 VanDerWaalsContact O-CB 3.26Å; L946-K950 WeakPolarHBondContact O-CB 3.49Å; L946-K950 PolarHBondContact O-N 3.4Å
947	I	88.2	Confident	89.3	Confident	76 Å²	76	39.3 Å²	39.3	39%	0.39	19%	0.192	S	C	.	.	H	α-helix	trans	-74.7	-45	170.8	-69.4	166.7	0	0	0	110	L943 A944 S945 K950 R951	L943-I947 VanDerWaalsContact O-CG1 3.31Å; L943-I947 WeakPolarHBondContact O-CG1 3.23Å; L943-I947 PolarHBondContact O-N 2.6Å; L943-I947 VanDerWaalsContact O-N 3.11Å; A944-I947 CarbonylContact O-C 3.21Å; A944-I947 WeakPolarHBondContact O-CA 3.36Å; A944-I947 VanDerWaalsContact O-CB 3.28Å; A944-I947 WeakPolarHBondContact O-CB 3.37Å; A944-I947 PolarHBondContact O-N 3.37Å; S945-I947 VanDerWaalsContact C-N 3.28Å; S945-I947 PolarHBondContact O-N 3.49Å; I947-K950 PolarHBondContact O-N 2.91Å; I947-R951 WeakPolarHBondContact O-CG 3.26Å; I947-R951 PolarHBondContact O-N 2.89Å
948	R	88.4	Confident	89.3	Confident	72 Å²	72	39 Å²	39	27%	0.272	19%	0.189	S	C	.	.	H	α-helix	trans	-67.9	-50.7	-179.8	-58.1	-167.7	-158.8	107.8	-1.2	111	N656 L658 A944 S945 K950 R951 C952	N656-R948 HydrophobicContact CB-CB 4.41Å; N656-R948 WeakPolarHBondContact O-CD 3.34Å; L658-R948 HydrophobicContact CD1-CB 3.97Å; L658-R948 HydrophobicContact CD2-CB 3.95Å; L658-R948 HydrophobicContact CG-CB 3.95Å; A944-R948 WeakPolarHBondContact O-CG 3.47Å; A944-R948 PolarHBondContact O-N 3.31Å; S945-R948 PolarHBondContact O-N 3.39Å; S945-R948 VanDerWaalsContact O-N 3.13Å; R948-K950 PolarHBondContact O-N 2.88Å; R948-R951 WeakPolarHBondContact O-CA 3.41Å; R948-R951 VanDerWaalsContact O-CB 3.29Å; R948-R951 WeakPolarHBondContact O-CB 3.44Å; R948-R951 PolarHBondContact O-N 3.14Å; R948-C952 PolarHBondContact O-N 3.44Å
949	A	91.8	Very high	89.2	Confident	0 Å²	0	39 Å²	39	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-57.1	-34.4	175.7	0	0	0	0	0	112.4	L658 W662 S945 C952 F953	L658-A949 HydrophobicContact CD1-CB 4.25Å; W662-A949 HydrophobicContact CD2-CB 4.01Å; W662-A949 HydrophobicContact CE3-CB 3.98Å; W662-A949 HydrophobicContact CH2-CB 3.95Å; W662-A949 HydrophobicContact CZ2-CB 3.97Å; W662-A949 HydrophobicContact CZ3-CB 3.96Å; S945-A949 VanDerWaalsContact O-CB 3.26Å; S945-A949 WeakPolarHBondContact O-CB 3.32Å; S945-A949 PolarHBondContact O-N 2.94Å; A949-C952 PolarHBondContact O-N 3.36Å; A949-F953 VanDerWaalsContact O-CB 3.31Å; A949-F953 WeakPolarHBondContact O-CB 3.14Å; A949-F953 PolarHBondContact O-N 2.86Å
950	K	94.1	Very high	89.3	Confident	71 Å²	71	36 Å²	36	31%	0.309	18%	0.178	S	C	.	.	H	α-helix	trans	-65.4	-34.4	171.3	175.9	168.4	178.4	169.7	0	113.4	I738 K740 L938 L946 I947 R948 L954	I738-K950 HydrophobicContact CB-CD 4.18Å; I738-K950 HydrophobicContact CD1-CD 4.4Å; I738-K950 HydrophobicContact CD1-CG 3.96Å; I738-K950 HydrophobicContact CG2-CD 3.91Å; I738-K950 HydrophobicContact CG2-CG 4.08Å; K740-K950 HydrophobicContact CD-CD 4.38Å; L938-K950 HydrophobicContact CD1-CB 4.06Å; L946-K950 VanDerWaalsContact O-CB 3.26Å; L946-K950 WeakPolarHBondContact O-CB 3.49Å; L946-K950 PolarHBondContact O-N 3.4Å; I947-K950 PolarHBondContact O-N 2.91Å; R948-K950 PolarHBondContact O-N 2.88Å; K950-L954 HydrophobicContact CG-CD1 4.26Å; K950-L954 WeakPolarHBondContact O-CG 3.24Å; K950-L954 PolarHBondContact O-N 3.49Å
951	R	87.1	Confident	89.4	Confident	128 Å²	128	35.9 Å²	35.9	48%	0.483	18%	0.176	S	C	.	.	H	α-helix	trans	-68.4	-46.8	174.1	-62.7	172.1	-172.2	177.4	3.9	110.3	I947 R948 L954 F955	I947-R951 WeakPolarHBondContact O-CG 3.26Å; I947-R951 PolarHBondContact O-N 2.89Å; R948-R951 WeakPolarHBondContact O-CA 3.41Å; R948-R951 VanDerWaalsContact O-CB 3.29Å; R948-R951 WeakPolarHBondContact O-CB 3.44Å; R948-R951 PolarHBondContact O-N 3.14Å; R951-L954 PolarHBondContact O-N 2.96Å; R951-F955 PolarHBondContact O-N 3.26Å
952	C	92.1	Very high	89.8	Confident	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-64.8	-39.3	178.4	-57.4	0	0	0	0	111.9	D652 L658 L666 R948 A949 L954 F955 T956	D652-C952 VanDerWaalsContact OD2-CA 3.31Å; D652-C952 WeakPolarHBondContact OD2-CA 3.26Å; D652-C952 WeakPolarHBondContact OD2-CB 3.29Å; D652-C952 PolarHBondContact OD2-SG 3.18Å; L658-C952 HydrophobicContact CD1-CB 4.43Å; L666-C952 HydrophobicContact CD1-CB 3.64Å; R948-C952 PolarHBondContact O-N 3.44Å; A949-C952 PolarHBondContact O-N 3.36Å; C952-L954 PolarHBondContact O-N 2.88Å; C952-F955 PolarHBondContact O-N 2.8Å; C952-T956 WeakPolarHBondContact O-CB 3.47Å; C952-T956 PolarHBondContact O-N 3.31Å; C952-T956 PolarHBondContact O-OG1 3.1Å
953	F	95.4	Very high	90.1	Very high	0 Å²	0	28 Å²	28	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.7	-46.2	174.1	-174.1	-100.4	0	0	0	112.8	L666 L669 A670 V673 V736 I738 V936 A949 F955 T956 L957	L666-F953 HydrophobicContact CD2-CB 3.61Å; L666-F953 HydrophobicContact CD2-CD2 3.88Å; L666-F953 HydrophobicContact CD2-CG 4.23Å; L669-F953 HydrophobicContact CB-CD2 4.32Å; L669-F953 HydrophobicContact CB-CE2 3.59Å; L669-F953 HydrophobicContact CB-CZ 4.4Å; A670-F953 HydrophobicContact CB-CE2 4.28Å; V673-F953 HydrophobicContact CG2-CZ 4.26Å; V736-F953 HydrophobicContact CG1-CE1 4.27Å; I738-F953 HydrophobicContact CD1-CD1 3.61Å; I738-F953 HydrophobicContact CD1-CE1 4.23Å; I738-F953 HydrophobicContact CG1-CD1 4.19Å; I738-F953 HydrophobicContact CG1-CE1 4.44Å; V936-F953 HydrophobicContact CB-CE1 4.46Å; V936-F953 HydrophobicContact CG1-CE1 4.48Å; V936-F953 HydrophobicContact CG1-CZ 4.38Å; V936-F953 HydrophobicContact CG2-CE1 3.93Å; V936-F953 HydrophobicContact CG2-CZ 3.79Å; A949-F953 VanDerWaalsContact O-CB 3.31Å; A949-F953 WeakPolarHBondContact O-CB 3.14Å; A949-F953 PolarHBondContact O-N 2.86Å; F953-F955 PolarHBondContact O-N 3.49Å; F953-T956 PolarHBondContact O-N 2.89Å; F953-L957 HydrophobicContact CE1-CB 4.34Å; F953-L957 HydrophobicContact CE1-CD2 4.05Å; F953-L957 HydrophobicContact CZ-CB 4.43Å; F953-L957 VanDerWaalsContact O-CB 3.27Å; F953-L957 WeakPolarHBondContact O-CB 3.23Å; F953-L957 PolarHBondContact O-N 2.84Å
954	L	92	Very high	90.3	Very high	49 Å²	49	25.9 Å²	25.9	26%	0.257	12%	0.121	S	C	.	.	H	α-helix	trans	-67.4	-20.3	178.9	-74.4	169.3	0	0	0	113.3	R733 I738 K950 R951 C952	R733-L954 HydrophobicContact CB-CD2 4.2Å; R733-L954 VanDerWaalsContact CD-O 3.31Å; R733-L954 WeakPolarHBondContact CD-O 3.1Å; R733-L954 HydrophobicContact CG-CD2 3.95Å; I738-L954 HydrophobicContact CD1-CD1 4.08Å; I738-L954 HydrophobicContact CD1-CD2 3.61Å; I738-L954 HydrophobicContact CD1-CG 3.59Å; K950-L954 HydrophobicContact CG-CD1 4.26Å; K950-L954 WeakPolarHBondContact O-CG 3.24Å; K950-L954 PolarHBondContact O-N 3.49Å; R951-L954 PolarHBondContact O-N 2.96Å; C952-L954 PolarHBondContact O-N 2.88Å
955	F	91.6	Very high	90.6	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.018	11%	0.108	C	C	.	.	H	α-helix	trans	-81.5	-53.6	169.8	177.9	-114.2	0	0	0	110.7	D652 R951 C952 F953 L957 R958 L959 P1294 R1295 Q1298	D652-F955 HydrophobicContact CB-CD1 4.06Å; D652-F955 HydrophobicContact CB-CE1 4.15Å; R951-F955 PolarHBondContact O-N 3.26Å; C952-F955 PolarHBondContact O-N 2.8Å; F953-F955 PolarHBondContact O-N 3.49Å; F955-L957 VanDerWaalsContact C-N 3.32Å; F955-L957 PolarHBondContact O-N 2.96Å; F955-R958 WeakPolarHBondContact O-CA 3.14Å; F955-R958 WeakPolarHBondContact O-CB 3.37Å; F955-R958 PolarHBondContact O-N 3.29Å; F955-L959 HydrophobicContact CD1-CD1 4.17Å; F955-L959 HydrophobicContact CD1-CG 4.48Å; F955-L959 HydrophobicContact CE1-CD1 3.74Å; F955-L959 HydrophobicContact CE1-CD2 4.26Å; F955-L959 HydrophobicContact CE1-CG 4.21Å; F955-L959 HydrophobicContact CE2-CD2 4.06Å; F955-L959 HydrophobicContact CZ-CD1 4.13Å; F955-L959 HydrophobicContact CZ-CD2 3.81Å; F955-L959 HydrophobicContact CZ-CG 4.24Å; F955-L959 PolarHBondContact O-N 3.15Å; F955-P1294 HydrophobicContact CE1-CB 4.46Å; F955-P1294 HydrophobicContact CE2-CB 4.09Å; F955-P1294 HydrophobicContact CZ-CB 3.57Å; F955-P1294 HydrophobicContact CZ-CG 4.49Å; F955-R1295 HydrophobicContact CD2-CG 3.72Å; F955-R1295 HydrophobicContact CE2-CG 3.97Å; F955-Q1298 VanDerWaalsContact CE2-NE2 3.28Å
956	T	93.3	Very high	90.7	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-51.1	-46.2	177.1	-51.6	0	0	0	0	112.3	V649 L666 I667 A670 C952 F953 R958 L959 C960	V649-T956 HydrophobicContact CG2-CG2 3.8Å; L666-T956 HydrophobicContact CB-CG2 4.32Å; I667-T956 HydrophobicContact CG1-CG2 3.9Å; A670-T956 HydrophobicContact CB-CG2 3.7Å; C952-T956 WeakPolarHBondContact O-CB 3.47Å; C952-T956 PolarHBondContact O-N 3.31Å; C952-T956 PolarHBondContact O-OG1 3.1Å; F953-T956 PolarHBondContact O-N 2.89Å; T956-R958 VanDerWaalsContact C-N 3.27Å; T956-R958 PolarHBondContact O-N 3.3Å; T956-L959 WeakPolarHBondContact O-CA 3.28Å; T956-L959 WeakPolarHBondContact O-CB 3.14Å; T956-L959 PolarHBondContact O-N 2.69Å; T956-C960 PolarHBondContact O-N 2.92Å
957	L	92.2	Very high	90.4	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-59.4	-35.6	176.5	176.3	61.9	0	0	0	112.9	V673 I732 R733 V736 F953 F955 Y961	V673-L957 HydrophobicContact CB-CD1 4.04Å; V673-L957 HydrophobicContact CG1-CD1 3.5Å; V673-L957 VanDerWaalsContact CG1-CD1 3.5Å; V673-L957 HydrophobicContact CG1-CD2 4.41Å; I732-L957 HydrophobicContact CD1-CD1 4.04Å; I732-L957 HydrophobicContact CG1-CD1 4.4Å; I732-L957 HydrophobicContact CG2-CD1 4.21Å; I732-L957 HydrophobicContact CG2-CD2 4.24Å; I732-L957 HydrophobicContact CG2-CG 3.85Å; R733-L957 HydrophobicContact CG-CD2 4.14Å; V736-L957 HydrophobicContact CB-CD2 4.02Å; V736-L957 HydrophobicContact CG1-CD2 4.04Å; V736-L957 HydrophobicContact CG2-CD2 3.94Å; F953-L957 HydrophobicContact CE1-CB 4.34Å; F953-L957 HydrophobicContact CE1-CD2 4.05Å; F953-L957 HydrophobicContact CZ-CB 4.43Å; F953-L957 VanDerWaalsContact O-CB 3.27Å; F953-L957 WeakPolarHBondContact O-CB 3.23Å; F953-L957 PolarHBondContact O-N 2.84Å; F955-L957 VanDerWaalsContact C-N 3.32Å; F955-L957 PolarHBondContact O-N 2.96Å; L957-Y961 VanDerWaalsContact O-CB 3.28Å; L957-Y961 WeakPolarHBondContact O-CB 3.29Å; L957-Y961 PolarHBondContact O-N 3.37Å; L957-Y961 VanDerWaalsContact O-N 3.16Å
958	R	89.8	Confident	90.2	Very high	15 Å²	15	21 Å²	21	6%	0.057	9%	0.092	C	C	.	.	H	α-helix	trans	-74.5	-31.4	175.5	-165.9	177.1	-176.8	-171.7	5	111.5	F955 T956 N962 Q1298 F1328	F955-R958 WeakPolarHBondContact O-CA 3.14Å; F955-R958 WeakPolarHBondContact O-CB 3.37Å; F955-R958 PolarHBondContact O-N 3.29Å; T956-R958 VanDerWaalsContact C-N 3.27Å; T956-R958 PolarHBondContact O-N 3.3Å; R958-N962 VanDerWaalsContact O-CB 3.32Å; R958-N962 WeakPolarHBondContact O-CB 3.38Å; R958-N962 PolarHBondContact O-N 3.13Å; R958-N962 VanDerWaalsContact O-N 3.1Å; R958-Q1298 VanDerWaalsContact NH1-CB 3.29Å; R958-Q1298 PolarHBondContact NH2-O 2.74Å; R958-F1328 PolarHBondContact NH2-O 3.14Å
959	L	90.7	Very high	90.1	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-65	-58.2	172.4	-58	-177.3	0	0	0	111.2	I645 L648 V649 F955 T956 Y961 N962 A963 V1063	I645-L959 HydrophobicContact CG1-CB 4.37Å; I645-L959 HydrophobicContact CG2-CB 4.39Å; I645-L959 HydrophobicContact CG2-CD1 4.35Å; L648-L959 HydrophobicContact CB-CD1 3.86Å; L648-L959 HydrophobicContact CD1-CD1 3.98Å; L648-L959 HydrophobicContact CD1-CD2 4.12Å; V649-L959 HydrophobicContact CG2-CD1 3.91Å; F955-L959 HydrophobicContact CD1-CD1 4.17Å; F955-L959 HydrophobicContact CD1-CG 4.48Å; F955-L959 HydrophobicContact CE1-CD1 3.74Å; F955-L959 HydrophobicContact CE1-CD2 4.26Å; F955-L959 HydrophobicContact CE1-CG 4.21Å; F955-L959 HydrophobicContact CE2-CD2 4.06Å; F955-L959 HydrophobicContact CZ-CD1 4.13Å; F955-L959 HydrophobicContact CZ-CD2 3.81Å; F955-L959 HydrophobicContact CZ-CG 4.24Å; F955-L959 PolarHBondContact O-N 3.15Å; T956-L959 WeakPolarHBondContact O-CA 3.28Å; T956-L959 WeakPolarHBondContact O-CB 3.14Å; T956-L959 PolarHBondContact O-N 2.69Å; L959-Y961 VanDerWaalsContact C-N 3.33Å; L959-Y961 PolarHBondContact O-N 3.5Å; L959-N962 PolarHBondContact O-N 3.06Å; L959-A963 WeakPolarHBondContact O-CB 3.3Å; L959-A963 PolarHBondContact O-N 2.88Å; L959-V1063 HydrophobicContact CD2-CB 4.15Å; L959-V1063 HydrophobicContact CD2-CG1 3.77Å; L959-V1063 HydrophobicContact CD2-CG2 3.85Å
960	C	91.5	Very high	89.3	Confident	0 Å²	0	18.4 Å²	18.4	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-59.8	-41.1	-177.8	-62.8	0	0	0	0	112.1	A670 W671 T956 A963 Q964	A670-C960 HydrophobicContact CB-CB 4.21Å; W671-C960 HydrophobicContact CD2-CB 4.08Å; W671-C960 HydrophobicContact CE3-CB 4.22Å; W671-C960 HydrophobicContact CZ2-CB 4.46Å; W671-C960 HydrophobicContact CZ3-CB 4.45Å; T956-C960 PolarHBondContact O-N 2.92Å; C960-A963 PolarHBondContact O-N 3.43Å; C960-Q964 PolarHBondContact O-N 2.83Å
961	Y	90.7	Very high	88.1	Confident	19 Å²	19	16.9 Å²	16.9	8%	0.075	8%	0.079	C	C	.	.	H	α-helix	trans	-68.5	-40	177.5	-172.2	-115.8	0	0	0	112.7	I732 L957 L959 Q964 L965	I732-Y961 HydrophobicContact CB-CD1 3.92Å; I732-Y961 HydrophobicContact CB-CD2 4.43Å; I732-Y961 HydrophobicContact CB-CE1 4.16Å; I732-Y961 HydrophobicContact CB-CG 4.06Å; I732-Y961 HydrophobicContact CD1-CD2 3.67Å; I732-Y961 HydrophobicContact CD1-CE2 4.12Å; I732-Y961 HydrophobicContact CD1-CG 3.97Å; I732-Y961 HydrophobicContact CG2-CD1 3.83Å; I732-Y961 HydrophobicContact CG2-CG 3.9Å; L957-Y961 VanDerWaalsContact O-CB 3.28Å; L957-Y961 WeakPolarHBondContact O-CB 3.29Å; L957-Y961 PolarHBondContact O-N 3.37Å; L957-Y961 VanDerWaalsContact O-N 3.16Å; L959-Y961 VanDerWaalsContact C-N 3.33Å; L959-Y961 PolarHBondContact O-N 3.5Å; Y961-Q964 PolarHBondContact O-N 3Å; Y961-L965 HydrophobicContact CD1-CD1 4.13Å; Y961-L965 HydrophobicContact CE1-CD1 3.63Å; Y961-L965 HydrophobicContact CE2-CD1 4.38Å; Y961-L965 HydrophobicContact CE2-CG 4.47Å; Y961-L965 WeakPolarHBondContact O-CG 3.15Å; Y961-L965 PolarHBondContact O-N 3.08Å
962	N	90.5	Very high	87.1	Confident	2 Å²	2	11.2 Å²	11.2	1%	0.011	6%	0.058	C	C	.	.	H	α-helix	trans	-61.7	-46.4	172.1	-178.6	86.1	0	0	0	111.2	R958 L959 Q964 L965 E966 V1063 Y1329	R958-N962 VanDerWaalsContact O-CB 3.32Å; R958-N962 WeakPolarHBondContact O-CB 3.38Å; R958-N962 PolarHBondContact O-N 3.13Å; R958-N962 VanDerWaalsContact O-N 3.1Å; L959-N962 PolarHBondContact O-N 3.06Å; N962-Q964 VanDerWaalsContact C-N 3.31Å; N962-Q964 PolarHBondContact O-N 3.33Å; N962-L965 PolarHBondContact O-N 3.19Å; N962-L965 VanDerWaalsContact O-N 3.16Å; N962-E966 PolarHBondContact ND2-OE2 2.99Å; N962-E966 VanDerWaalsContact O-CB 3.26Å; N962-E966 WeakPolarHBondContact O-CB 3.29Å; N962-E966 PolarHBondContact O-N 3.03Å; N962-V1063 HydrophobicContact CB-CG1 4Å; N962-Y1329 HydrophobicContact CB-CE2 4.11Å; N962-Y1329 WeakPolarHBondContact OD1-CE2 3.27Å; N962-Y1329 PolarHBondContact OD1-OH 3.31Å
963	A	89.2	Confident	84.9	Confident	1 Å²	1	15 Å²	15	1%	0.008	8%	0.079	C	C	.	.	H	α-helix	trans	-58.9	-40.5	179.7	0	0	0	0	0	112.3	F641 I645 L959 C960 L967	F641-A963 HydrophobicContact CD1-CB 3.61Å; F641-A963 HydrophobicContact CE1-CB 4.24Å; F641-A963 HydrophobicContact CG-CB 4.48Å; I645-A963 HydrophobicContact CD1-CB 3.76Å; L959-A963 WeakPolarHBondContact O-CB 3.3Å; L959-A963 PolarHBondContact O-N 2.88Å; C960-A963 PolarHBondContact O-N 3.43Å; A963-L967 VanDerWaalsContact O-CB 3.24Å; A963-L967 WeakPolarHBondContact O-CB 3.26Å; A963-L967 VanDerWaalsContact O-CG 3.28Å; A963-L967 WeakPolarHBondContact O-CG 3.12Å; A963-L967 PolarHBondContact O-N 2.89Å
964	Q	87.1	Confident	82.6	Confident	49 Å²	49	19.9 Å²	19.9	23%	0.229	10%	0.101	C	C	.	.	H	α-helix	trans	-60	-47.9	173.5	-177	-179	-29.7	0	0	112.2	W671 C960 Y961 N962 A968 D1430	W671-Q964 HydrophobicContact CZ3-CB 4.19Å; C960-Q964 PolarHBondContact O-N 2.83Å; Y961-Q964 PolarHBondContact O-N 3Å; N962-Q964 VanDerWaalsContact C-N 3.31Å; N962-Q964 PolarHBondContact O-N 3.33Å; Q964-A968 WeakPolarHBondContact O-CB 3.29Å; Q964-A968 PolarHBondContact O-N 3.43Å; Q964-D1430 PolarHBondContact NE2-OD2 3.42Å
965	L	89.6	Confident	80.7	Confident	2 Å²	2	17.7 Å²	17.7	1%	0.01	9%	0.09	C	C	.	.	H	α-helix	trans	-71.2	-32.6	-178.1	-62.4	178.4	0	0	0	112.7	Y961 N962 Y969 Y1329 D1430 H1433 L1434	Y961-L965 HydrophobicContact CD1-CD1 4.13Å; Y961-L965 HydrophobicContact CE1-CD1 3.63Å; Y961-L965 HydrophobicContact CE2-CD1 4.38Å; Y961-L965 HydrophobicContact CE2-CG 4.47Å; Y961-L965 WeakPolarHBondContact O-CG 3.15Å; Y961-L965 PolarHBondContact O-N 3.08Å; N962-L965 PolarHBondContact O-N 3.19Å; N962-L965 VanDerWaalsContact O-N 3.16Å; L965-Y969 PolarHBondContact O-N 3.04Å; L965-Y969 VanDerWaalsContact O-N 3.12Å; L965-Y1329 HydrophobicContact CD1-CD1 4.32Å; L965-Y1329 HydrophobicContact CD1-CE1 3.49Å; L965-Y1329 VanDerWaalsContact CD1-CE1 3.49Å; L965-D1430 HydrophobicContact CD2-CB 3.96Å; L965-D1430 WeakPolarHBondContact CD2-O 3.38Å; L965-H1433 HydrophobicContact CD2-CB 4.15Å; L965-L1434 HydrophobicContact CB-CD1 4.02Å
966	E	88.3	Confident	78.8	Confident	1 Å²	1	18 Å²	18	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-72.1	-47.2	176.7	-171.3	170.6	141.6	0	0	111.2	F641 N962 Y969 S970 S1064 S1066 K1438 L1442	F641-E966 HydrophobicContact CE1-CB 4.3Å; F641-E966 HydrophobicContact CE1-CG 4.16Å; F641-E966 HydrophobicContact CZ-CB 4.46Å; F641-E966 HydrophobicContact CZ-CG 3.98Å; F641-E966 WeakPolarHBondContact CZ-OE1 3.28Å; N962-E966 PolarHBondContact ND2-OE2 2.99Å; N962-E966 VanDerWaalsContact O-CB 3.26Å; N962-E966 WeakPolarHBondContact O-CB 3.29Å; N962-E966 PolarHBondContact O-N 3.03Å; E966-Y969 WeakPolarHBondContact O-CB 3.32Å; E966-Y969 PolarHBondContact O-N 3.47Å; E966-Y969 VanDerWaalsContact O-N 3.14Å; E966-S970 PolarHBondContact O-N 2.92Å; E966-S970 PolarHBondContact O-OG 3.45Å; E966-S1064 VanDerWaalsContact OE1-CB 3.32Å; E966-S1064 WeakPolarHBondContact OE1-CB 3.3Å; E966-S1064 PolarHBondContact OE1-OG 2.68Å; E966-S1064 WeakPolarHBondContact OE2-CB 3.3Å; E966-S1064 PolarHBondContact OE2-OG 2.59Å; E966-S1066 PolarHBondContact OE1-OG 3.17Å; E966-K1438 WeakPolarHBondContact OE2-CE 3.4Å; E966-K1438 IonicContact OE2-NZ 3.27Å; E966-L1442 HydrophobicContact CG-CD1 4.07Å; E966-L1442 HydrophobicContact CG-CD2 4.26Å
967	L	84.8	Confident	76.3	Confident	13 Å²	13	21.9 Å²	21.9	7%	0.068	11%	0.109	C	C	.	.	H	α-helix	trans	-56.4	-51.1	168.6	-75.7	167.4	0	0	0	110.1	M637 F641 A963 Y969 S970 N971	M637-L967 HydrophobicContact CB-CD2 4.19Å; F641-L967 HydrophobicContact CB-CD1 4.33Å; F641-L967 HydrophobicContact CD2-CD1 4.36Å; F641-L967 HydrophobicContact CD2-CD2 3.66Å; F641-L967 HydrophobicContact CD2-CG 4Å; F641-L967 HydrophobicContact CE2-CD2 3.73Å; F641-L967 HydrophobicContact CE2-CG 4.1Å; F641-L967 HydrophobicContact CG-CD1 4.22Å; F641-L967 HydrophobicContact CG-CD2 4.33Å; F641-L967 HydrophobicContact CG-CG 4.21Å; F641-L967 HydrophobicContact CZ-CD2 4.45Å; F641-L967 HydrophobicContact CZ-CG 4.4Å; A963-L967 VanDerWaalsContact O-CB 3.24Å; A963-L967 WeakPolarHBondContact O-CB 3.26Å; A963-L967 VanDerWaalsContact O-CG 3.28Å; A963-L967 WeakPolarHBondContact O-CG 3.12Å; A963-L967 PolarHBondContact O-N 2.89Å; L967-Y969 PolarHBondContact O-N 3.07Å; L967-S970 CarbonylContact O-C 3.55Å; L967-S970 WeakPolarHBondContact O-CA 3.14Å; L967-S970 WeakPolarHBondContact O-CB 3.41Å; L967-S970 PolarHBondContact O-N 3.01Å; L967-N971 WeakPolarHBondContact O-CB 3.39Å; L967-N971 PolarHBondContact O-N 2.85Å; L967-N971 PolarHBondContact O-ND2 3.35Å; L967-N971 PolarHBondContact O-OD1 2.7Å
968	A	83.1	Confident	73.7	Confident	16 Å²	16	23.6 Å²	23.6	13%	0.132	12%	0.118	C	C	.	.	H	α-helix	trans	-59.9	-18.7	179.1	0	0	0	0	0	114.5	Q964 N972 D1430 T1431	Q964-A968 WeakPolarHBondContact O-CB 3.29Å; Q964-A968 PolarHBondContact O-N 3.43Å; A968-N972 PolarHBondContact O-ND2 3.34Å; A968-D1430 HydrophobicContact CB-CB 3.51Å; A968-T1431 PolarHBondContact O-OG1 3.39Å
969	Y	86.2	Confident	70.8	Confident	5 Å²	5	26 Å²	26	2%	0.02	14%	0.135	C	C	.	.	H	α-helix	trans	-77.8	-47.1	169.1	-177.7	-132.4	0	0	0	112.4	L965 E966 L967 N971 N972 F976 M1411 T1431 L1434 F1439 H1508	L965-Y969 PolarHBondContact O-N 3.04Å; L965-Y969 VanDerWaalsContact O-N 3.12Å; E966-Y969 WeakPolarHBondContact O-CB 3.32Å; E966-Y969 PolarHBondContact O-N 3.47Å; E966-Y969 VanDerWaalsContact O-N 3.14Å; L967-Y969 PolarHBondContact O-N 3.07Å; Y969-N971 VanDerWaalsContact C-N 3.34Å; Y969-N971 PolarHBondContact O-N 3.2Å; Y969-N972 PolarHBondContact O-ND2 3.5Å; Y969-F976 HydrophobicContact CD1-CZ 4.25Å; Y969-F976 HydrophobicContact CE1-CE2 4.22Å; Y969-F976 AromaticContact CE1-CZ 3.7Å; Y969-F976 HydrophobicContact CE1-CZ 3.7Å; Y969-F976 HydrophobicContact CE2-CE2 4.44Å; Y969-F976 AromaticContact CZ-CZ 3.9Å; Y969-M1411 HydrophobicContact CE2-CE 4.24Å; Y969-M1411 HydrophobicContact CE2-SD 4.2Å; Y969-T1431 HydrophobicContact CD2-CG2 3.51Å; Y969-T1431 HydrophobicContact CE2-CG2 4.22Å; Y969-T1431 HydrophobicContact CG-CG2 4.37Å; Y969-L1434 HydrophobicContact CD1-CD2 4.12Å; Y969-L1434 HydrophobicContact CG-CD2 3.98Å; Y969-F1439 HydrophobicContact CE1-CD2 4.05Å; Y969-F1439 HydrophobicContact CE1-CE2 4.3Å; Y969-H1508 PolarHBondContact OH-ND1 2.87Å
970	S	75.7	Confident	67.8	Low	11 Å²	11	29.6 Å²	29.6	8%	0.077	15%	0.152	C	C	.	.	H	α-helix	trans	-60	-42.5	173.4	-58	0	0	0	0	112.2	E966 L967 N972 F976	E966-S970 PolarHBondContact O-N 2.92Å; E966-S970 PolarHBondContact O-OG 3.45Å; L967-S970 CarbonylContact O-C 3.55Å; L967-S970 WeakPolarHBondContact O-CA 3.14Å; L967-S970 WeakPolarHBondContact O-CB 3.41Å; L967-S970 PolarHBondContact O-N 3.01Å; S970-N972 PolarHBondContact O-N 3.09Å; S970-F976 WeakPolarHBondContact O-CD2 3.19Å
971	N	68.2	Low	64.7	Low	40 Å²	40	35.1 Å²	35.1	21%	0.214	18%	0.181	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	30.8	-177.1	-44.5	-11	0	0	0	113.2	M634 L967 Y969 D973	M634-N971 VanDerWaalsContact CE-CG 3.5Å; M634-N971 WeakPolarHBondContact CE-ND2 3.37Å; M634-N971 HydrophobicContact SD-CB 4.05Å; M634-N971 PolarHBondContact SD-OD1 3.01Å; L967-N971 WeakPolarHBondContact O-CB 3.39Å; L967-N971 PolarHBondContact O-N 2.85Å; L967-N971 PolarHBondContact O-ND2 3.35Å; L967-N971 PolarHBondContact O-OD1 2.7Å; Y969-N971 VanDerWaalsContact C-N 3.34Å; Y969-N971 PolarHBondContact O-N 3.2Å; N971-D973 VanDerWaalsContact C-OD1 3.27Å; N971-D973 VanDerWaalsContact CA-OD1 3.23Å; N971-D973 WeakPolarHBondContact CA-OD1 3.37Å; N971-D973 WeakPolarHBondContact CB-OD1 3.45Å; N971-D973 PolarHBondContact O-N 3.44Å
972	N	66.1	Low	61.6	Low	8 Å²	8	42 Å²	42	4%	0.043	22%	0.218	C	C	.	.	S	Bend	trans	-88.4	74.7	160.5	-66.6	-88.5	0	0	0	105.3	A968 Y969 S970 H974 I975 M1411 S1428 T1431	A968-N972 PolarHBondContact O-ND2 3.34Å; Y969-N972 PolarHBondContact O-ND2 3.5Å; S970-N972 PolarHBondContact O-N 3.09Å; N972-H974 PolarHBondContact O-N 3.03Å; N972-I975 HydrophobicContact CB-CD1 3.96Å; N972-I975 WeakPolarHBondContact O-CG1 3.34Å; N972-I975 PolarHBondContact O-N 2.86Å; N972-M1411 HydrophobicContact CB-SD 4.47Å; N972-S1428 PolarHBondContact OD1-N 3.01Å; N972-T1431 PolarHBondContact ND2-OG1 3.35Å
973	D	47.8	Very low	58.5	Low	80 Å²	80	48.5 Å²	48.5	43%	0.428	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.3	14.4	-137.3	-49.9	-64.4	0	0	0	120.9	N971 K1425	N971-D973 VanDerWaalsContact C-OD1 3.27Å; N971-D973 VanDerWaalsContact CA-OD1 3.23Å; N971-D973 WeakPolarHBondContact CA-OD1 3.37Å; N971-D973 WeakPolarHBondContact CB-OD1 3.45Å; N971-D973 PolarHBondContact O-N 3.44Å; D973-K1425 VanDerWaalsContact N-NZ 3.13Å
974	H	47.1	Very low	55.4	Low	103 Å²	103	55.6 Å²	55.6	48%	0.477	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.6	21	171.8	-50	-29.5	0	0	0	111.9	N972 P1423 K1425	N972-H974 PolarHBondContact O-N 3.03Å; H974-P1423 HydrophobicContact CB-CG 3.41Å; H974-P1423 VanDerWaalsContact CB-CG 3.41Å; H974-P1423 WeakPolarHBondContact O-CD 3.48Å; H974-K1425 WeakPolarHBondContact CD2-CE 3.48Å; H974-K1425 PolarHBondContact CD2-NZ 3.4Å; H974-K1425 VanDerWaalsContact CD2-NZ 3.31Å; H974-K1425 PolarHBondContact NE2-NZ 3.34Å
975	I	51.4	Low	52.3	Low	3 Å²	3	58.6 Å²	58.6	2%	0.015	31%	0.312	C	S	.	.	S	Bend	trans	-106.3	-38.6	-179.8	-63.1	-176.6	0	0	0	110.9	N972 M1411 L1413	N972-I975 HydrophobicContact CB-CD1 3.96Å; N972-I975 WeakPolarHBondContact O-CG1 3.34Å; N972-I975 PolarHBondContact O-N 2.86Å; I975-M1411 HydrophobicContact CD1-CG 3.77Å; I975-M1411 HydrophobicContact CD1-SD 3.64Å; I975-L1413 HydrophobicContact CG2-CD1 3.37Å; I975-L1413 HydrophobicContact CG2-CG 3.64Å; I975-L1413 VanDerWaalsContact O-CD1 3.3Å; I975-L1413 WeakPolarHBondContact O-CD1 3.47Å
976	F	51.8	Low	49	Very low	11 Å²	11	64.6 Å²	64.6	5%	0.048	34%	0.344	C	S	.	.			trans	-122.5	135.4	177.8	-57.8	-101	0	0	0	109.5	Y969 S970 V1502 Y1503	Y969-F976 HydrophobicContact CD1-CZ 4.25Å; Y969-F976 HydrophobicContact CE1-CE2 4.22Å; Y969-F976 AromaticContact CE1-CZ 3.7Å; Y969-F976 HydrophobicContact CE1-CZ 3.7Å; Y969-F976 HydrophobicContact CE2-CE2 4.44Å; Y969-F976 AromaticContact CZ-CZ 3.9Å; S970-F976 WeakPolarHBondContact O-CD2 3.19Å; F976-V1502 HydrophobicContact CD1-CB 4.32Å; F976-V1502 HydrophobicContact CD1-CG1 3.6Å; F976-V1502 HydrophobicContact CE1-CB 4.36Å; F976-V1502 HydrophobicContact CE1-CG1 3.35Å; F976-V1502 HydrophobicContact CZ-CG1 4.23Å; F976-Y1503 AromaticContact CE1-CE1 3.8Å; F976-Y1503 HydrophobicContact CE1-CE1 3.8Å; F976-Y1503 AromaticContact CE1-CZ 3.78Å; F976-Y1503 HydrophobicContact CZ-CE1 4.32Å
977	Q	39.5	Very low	45.9	Very low	80 Å²	80	68.4 Å²	68.4	37%	0.374	37%	0.367	S	S	.	.	B	Isolated β-bridge	trans	-144	97.5	168.4	-170.5	173.1	50.8	0	0	108	Y1452 L1455	Q977-Y1452 VanDerWaalsContact O-O 3.09Å; Q977-L1455 HydrophobicContact CG-CD1 4.48Å; Q977-L1455 HydrophobicContact CG-CG 4.22Å
978	L	38.2	Very low	43.1	Very low	37 Å²	37	71.1 Å²	71.1	19%	0.194	38%	0.38	C	S	.	.			trans	-59.2	143.9	178	-106.2	70.6	0	0	0	110.8	Y633 M637 H980 L1450 A1451	Y633-L978 HydrophobicContact CE2-CB 3.96Å; Y633-L978 PolarHBondContact OH-N 3.49Å; Y633-L978 VanDerWaalsContact OH-N 3.15Å; M637-L978 HydrophobicContact SD-CD2 3.96Å; L978-H980 PolarHBondContact O-N 3.21Å; L978-H980 VanDerWaalsContact O-N 3.1Å; L978-L1450 VanDerWaalsContact CD1-O 3.28Å; L978-L1450 WeakPolarHBondContact CD1-O 3.4Å; L978-L1450 WeakPolarHBondContact CD2-O 3.48Å; L978-L1450 WeakPolarHBondContact CG-O 3.43Å; L978-A1451 HydrophobicContact CD1-CB 4.25Å
979	P	29.9	Very low	40.3	Very low	64 Å²	64	74.6 Å²	74.6	42%	0.416	40%	0.403	S	S	.	.			trans	-66.4	112.3	172.6	-14.4	27.4	0	0	0	111	L981 Y1452	P979-L981 PolarHBondContact O-N 2.84Å; P979-Y1452 HydrophobicContact CG-CD2 3.58Å; P979-Y1452 HydrophobicContact CG-CE2 4.48Å; P979-Y1452 HydrophobicContact CG-CG 4.24Å
980	H	27.4	Very low	37.2	Very low	77 Å²	77	82.3 Å²	82.3	36%	0.356	43%	0.432	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	81.5	156	-88.9	-98	0	0	0	109	Y633 L978	Y633-H980 AromaticContact CD2-CD2 3.88Å; Y633-H980 AromaticContact CD2-NE2 3.56Å; L978-H980 PolarHBondContact O-N 3.21Å; L978-H980 VanDerWaalsContact O-N 3.1Å
981	L	26.2	Very low	34.8	Very low	116 Å²	116	84.8 Å²	84.8	61%	0.607	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-159.4	8.9	168.5	-114.8	176.7	0	0	0	116.6	P979 T985	P979-L981 PolarHBondContact O-N 2.84Å; L981-T985 HydrophobicContact CD2-CG2 4.12Å
982	L	26.6	Very low	32.5	Very low	162 Å²	162	86.6 Å²	86.6	85%	0.848	45%	0.453	S	S	*	.	S	Bend	trans	-122.8	1.6	173.6	-76.7	179.1	0	0	0	115.2
983	L	24.7	Very low	30.4	Very low	139 Å²	139	88.4 Å²	88.4	73%	0.728	47%	0.465	S	S	*	.	S	Bend	trans	-130.8	137.8	153.2	-76	92.9	0	0	0	107.8
984	N	23.1	Very low	29.4	Very low	150 Å²	150	93.3 Å²	93.3	80%	0.802	48%	0.482	S	S	*	.			trans	64	79.7	178.7	-56.6	10	0	0	0	115.4	D986	N984-D986 PolarHBondContact O-N 3.49Å
985	T	21.8	Very low	28.3	Very low	113 Å²	113	91 Å²	91	69%	0.693	48%	0.477	S	S	*	.			trans	-81.4	86	151	50.5	0	0	0	0	109.6	L981	L981-T985 HydrophobicContact CD2-CG2 4.12Å
986	D	22.1	Very low	26.9	Very low	127 Å²	127	97.5 Å²	97.5	68%	0.679	51%	0.511	S	S	*	.			trans	-146	103.7	167.4	-91.2	-46.4	0	0	0	112.5	N984	N984-D986 PolarHBondContact O-N 3.49Å
987	T	22.8	Very low	25.6	Very low	81 Å²	81	103.5 Å²	103.5	50%	0.497	54%	0.544	S	S	.	.			trans	70.9	140.3	151.5	70.5	0	0	0	0	122.2
988	H	25	Very low	24.7	Very low	70 Å²	70	105.6 Å²	105.6	32%	0.324	55%	0.552	S	S	.	*			trans	61.8	81	153.1	-59.8	-41.9	0	0	0	122.8	D411	D411-H988 PolarHBondContact O-CE1 2.63Å; D411-H988 PolarHBondContact O-NE2 2.75Å
989	S	24.6	Very low	23.8	Very low	90 Å²	90	112.5 Å²	112.5	63%	0.629	59%	0.585	S	S	*	*			trans	-142.6	53.2	132.8	66.1	0	0	0	0	113	S991	S989-S991 PolarHBondContact O-N 2.94Å
990	R	21.5	Very low	23.3	Very low	166 Å²	166	115.2 Å²	115.2	63%	0.626	61%	0.605	S	S	*	*			trans	-70.2	125.6	171.1	-69.7	178.8	-179.9	166.9	4.1	110.7	D411	D411-R990 IonicContact OD2-CZ 3.17Å; D411-R990 IonicContact OD2-NH1 2.64Å; D411-R990 PolarHBondContact OD2-NH1 3.37Å; D411-R990 IonicContact OD2-NH2 2.69Å; D411-R990 PolarHBondContact OD2-NH2 3.3Å
991	S	24.5	Very low	23	Very low	63 Å²	63	117.6 Å²	117.6	44%	0.441	62%	0.619	S	S	.	*	S	Bend	trans	-165	-40	144.6	60.9	0	0	0	0	116.5	N623 S989	N623-S991 WeakPolarHBondContact OD1-CB 3.24Å; N623-S991 PolarHBondContact OD1-OG 2.89Å; S989-S991 PolarHBondContact O-N 2.94Å
992	R	20.6	Very low	22.7	Very low	78 Å²	78	119.1 Å²	119.1	29%	0.294	62%	0.623	S	S	.	*	S	Bend	trans	-133.5	58.1	-171.4	-134.3	177.8	-176.6	171.5	0.1	118.9	N623 S1460 D1461	N623-R992 HydrophobicContact CB-CB 4.32Å; N623-R992 WeakPolarHBondContact ND2-CB 3.48Å; R992-S1460 WeakPolarHBondContact CD-OG 3.25Å; R992-S1460 VanDerWaalsContact CZ-OG 3.32Å; R992-S1460 PolarHBondContact NE-OG 3.01Å; R992-S1460 PolarHBondContact NH1-OG 2.86Å; R992-D1461 IonicContact CZ-OD1 3.29Å; R992-D1461 VanDerWaalsContact CZ-OD1 3.3Å; R992-D1461 IonicContact CZ-OD2 2.71Å; R992-D1461 IonicContact NE-OD1 3.83Å; R992-D1461 IonicContact NE-OD2 3.48Å; R992-D1461 IonicContact NH1-OD2 3.35Å; R992-D1461 PolarHBondContact NH1-OD2 3.49Å; R992-D1461 IonicContact NH2-OD1 3.37Å; R992-D1461 PolarHBondContact NH2-OD1 3.44Å; R992-D1461 IonicContact NH2-OD2 3.32Å; R992-D1461 PolarHBondContact NH2-OD2 3.32Å
993	V	22.3	Very low	22.4	Very low	46 Å²	46	117.9 Å²	117.9	28%	0.279	62%	0.617	S	S	.	*				-125.4	97.9	127.7	165.6	0	0	0	0	108.7	L996 K1458	V993-L996 HydrophobicContact CG1-CB 3.98Å; V993-K1458 HydrophobicContact CB-CD 4.1Å; V993-K1458 HydrophobicContact CG2-CB 3.46Å; V993-K1458 VanDerWaalsContact CG2-CB 3.46Å; V993-K1458 HydrophobicContact CG2-CD 3.51Å; V993-K1458 HydrophobicContact CG2-CG 3.9Å
994	K	26.5	Very low	22.1	Very low	184 Å²	184	118.6 Å²	118.6	80%	0.8	62%	0.622	S	S	*	*			trans	-126.1	7.8	164.5	-90.5	-170	170	-174.1	0	112.4
995	S	24.2	Very low	22	Very low	53 Å²	53	116 Å²	116	37%	0.371	62%	0.621	S	S	.	*	S	Bend	trans	-87.6	-52.1	174.7	45	0	0	0	0	112.3	N997 K998 M999	S995-N997 PolarHBondContact O-N 3.27Å; S995-K998 PolarHBondContact O-N 2.85Å; S995-M999 PolarHBondContact O-N 3.34Å
996	L	22	Very low	21.9	Very low	140 Å²	140	118.7 Å²	118.7	73%	0.733	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-13	180	-96.2	163.1	0	0	0	115.2	V993	V993-L996 HydrophobicContact CG1-CB 3.98Å
997	N	23.9	Very low	21.8	Very low	138 Å²	138	120.4 Å²	120.4	74%	0.738	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.3	24.3	171.5	-87.9	41.3	0	0	0	113.1	S995	S995-N997 PolarHBondContact O-N 3.27Å
998	K	22	Very low	21.9	Very low	123 Å²	123	121.8 Å²	121.8	54%	0.535	64%	0.635	S	S	.	*	T	Hydrogen-bonded Turn	trans	-137.8	8.3	163.1	-130.3	-158.6	178.4	-146.7	0	116.9	S995 C1000 L1001	S995-K998 PolarHBondContact O-N 2.85Å; K998-C1000 PolarHBondContact O-N 2.63Å; K998-L1001 HydrophobicContact CG-CB 4.32Å
999	M	18.6	Very low	21.8	Very low	182 Å²	182	123.3 Å²	123.3	90%	0.897	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	17.7	160.3	-74.2	-174.4	71.3	0	0	113.6	S995	S995-M999 PolarHBondContact O-N 3.34Å
1000	C	19.3	Very low	21.5	Very low	121 Å²	121	128.7 Å²	128.7	82%	0.818	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-160.3	73.6	155	-162.7	0	0	0	0	109.9	K998	K998-C1000 PolarHBondContact O-N 2.63Å
1001	L	21.1	Very low	21.6	Very low	128 Å²	128	125.5 Å²	125.5	67%	0.67	66%	0.664	S	S	*	*			trans	-159.3	67.3	167	-111	-176.3	0	0	0	111.1	K998	K998-L1001 HydrophobicContact CG-CB 4.32Å
1002	Q	19.8	Very low	21.3	Very low	148 Å²	148	127.9 Å²	127.9	69%	0.692	68%	0.681	S	S	*	*			trans	-177.5	126.9	167.7	-97.5	171.1	-76.8	0	0	104.1
1003	N	19.7	Very low	21.5	Very low	135 Å²	135	129.4 Å²	129.4	72%	0.722	70%	0.7	S	S	*	*			cis	-133	-168.3	5.8	-64.4	-40.5	0	0	0	111.9
1004	D	18.9	Very low	21.4	Very low	155 Å²	155	133.5 Å²	133.5	83%	0.829	73%	0.725	S	S	*	*			trans	-76.5	-172.5	-170.7	-44	-93.9	0	0	0	116.4
1005	A	21.1	Very low	21.1	Very low	94 Å²	94	129.6 Å²	129.6	78%	0.777	72%	0.721	S	S	*	*			trans	91.6	84.4	162.7	0	0	0	0	0	121.4
1006	E	18.9	Very low	20.9	Very low	170 Å²	170	138.5 Å²	138.5	79%	0.794	75%	0.746	S	S	*	*				58.5	102.6	112.6	-147.8	167	-148.3	0	0	123.6
1007	Y	20.4	Very low	20.8	Very low	163 Å²	163	141.6 Å²	141.6	64%	0.639	75%	0.754	S	S	*	*			trans	67.4	168	145.3	-81.5	-117.4	0	0	0	119.9
1008	P	24.9	Very low	20.7	Very low	111 Å²	111	140.8 Å²	140.8	72%	0.721	74%	0.744	S	S	*	*			cis	-129.8	-137.4	-44.9	40.6	-20.8	0	0	0	113.8
1009	P	23.5	Very low	20.6	Very low	101 Å²	101	139.1 Å²	139.1	66%	0.656	75%	0.753	S	S	*	*				-138.4	167.2	-119.6	43.6	-22.4	0	0	0	120.5
1010	F	18.4	Very low	20.6	Very low	204 Å²	204	138.1 Å²	138.1	90%	0.895	75%	0.751	S	S	*	*			trans	64.7	170.8	160.4	-78.4	-67	0	0	0	117.7
1011	P	23.4	Very low	20.8	Very low	98 Å²	98	136.5 Å²	136.5	64%	0.636	74%	0.741	S	S	*	*			cis	-134.3	154	-17.1	31.9	-12.4	0	0	0	117
1012	S	18.5	Very low	20.9	Very low	114 Å²	114	137.2 Å²	137.2	80%	0.797	75%	0.745	S	S	*	*			trans	66.5	-176.6	147	71.9	0	0	0	0	118.6
1013	P	25.3	Very low	21.1	Very low	109 Å²	109	136.6 Å²	136.6	71%	0.708	75%	0.746	S	S	*	*				-134.2	-175.8	-70.9	40.4	-23.8	0	0	0	116.1
1014	V	19	Very low	21.2	Very low	132 Å²	132	137.2 Å²	137.2	80%	0.8	75%	0.749	S	S	*	*			trans	86.7	122.3	157.1	179.7	0	0	0	0	121.4
1015	S	20.2	Very low	21.4	Very low	102 Å²	102	132.8 Å²	132.8	71%	0.713	74%	0.74	S	S	*	*			trans	55.5	112.7	149.1	-65.4	0	0	0	0	125.9
1016	R	20.3	Very low	21.6	Very low	240 Å²	240	134.2 Å²	134.2	91%	0.906	74%	0.744	S	S	*	*			trans	42.9	101.4	130.5	-65.1	-179.5	174.7	168.7	-1.5	120.3
1017	K	20.5	Very low	21.7	Very low	205 Å²	205	130.3 Å²	130.3	89%	0.891	73%	0.732	S	S	*	*				-168.5	160.8	128.5	-109.8	165.1	-175.7	175.8	0	112.6
1018	K	20.8	Very low	21.6	Very low	122 Å²	122	129.9 Å²	129.9	53%	0.53	74%	0.739	S	S	.	*			trans	36.8	115.9	159.6	-77.9	-176	165.4	-169.5	0	121.9	E1475	K1018-E1475 VanDerWaalsContact CD-OE1 3.31Å; K1018-E1475 WeakPolarHBondContact CD-OE1 3.48Å; K1018-E1475 WeakPolarHBondContact CD-OE2 3.48Å; K1018-E1475 WeakPolarHBondContact CE-OE1 3.08Å; K1018-E1475 IonicContact NZ-OE1 3.35Å; K1018-E1475 PolarHBondContact NZ-OE1 2.96Å; K1018-E1475 IonicContact NZ-OE2 2.69Å; K1018-E1475 PolarHBondContact NZ-OE2 3.28Å
1019	A	19.8	Very low	21.4	Very low	88 Å²	88	129.4 Å²	129.4	73%	0.727	74%	0.739	S	S	*	*				54.4	129.4	113.9	0	0	0	0	0	123.8
1020	L	19.2	Very low	21.2	Very low	161 Å²	161	131.7 Å²	131.7	84%	0.843	74%	0.744	S	S	*	*			trans	78.1	149.1	153.3	-100.9	67.7	0	0	0	120.2
1021	S	23	Very low	21.3	Very low	87 Å²	87	125.5 Å²	125.5	61%	0.608	73%	0.726	S	S	*	*			trans	8.8	119.2	165.4	47	0	0	0	0	117.8
1022	D	23.7	Very low	21.2	Very low	143 Å²	143	126.9 Å²	126.9	77%	0.765	74%	0.737	S	S	*	*			cis	-128.7	128.6	38	-87.1	-37.6	0	0	0	117.2	N1024	D1022-N1024 VanDerWaalsContact C-N 3.33Å; D1022-N1024 PolarHBondContact O-N 3.47Å
1023	L	24.6	Very low	21.3	Very low	135 Å²	135	126 Å²	126	71%	0.707	73%	0.728	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.1	66.6	169.5	-83.5	71.4	0	0	0	111.1	V1027	L1023-V1027 HydrophobicContact CD2-CG2 4Å
1024	N	21.5	Very low	21.1	Very low	147 Å²	147	127.6 Å²	127.6	79%	0.786	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.7	-17	158.9	-82.6	-47.7	0	0	0	112.7	D1022 S1026	D1022-N1024 VanDerWaalsContact C-N 3.33Å; D1022-N1024 PolarHBondContact O-N 3.47Å; N1024-S1026 PolarHBondContact O-N 3.24Å
1025	G	22.3	Very low	21.2	Very low	62 Å²	62	128.6 Å²	128.6	64%	0.639	73%	0.725	S	S	*	*	S	Bend	trans	-64.7	120.1	154	0	0	0	0	0	109	V1027	G1025-V1027 PolarHBondContact O-N 2.92Å
1026	S	26.3	Very low	21.2	Very low	124 Å²	124	132.1 Å²	132.1	87%	0.867	73%	0.727	S	S	*	*			trans	-62.5	99.9	-177.2	-73.7	0	0	0	0	111.5	N1024 I1028	N1024-S1026 PolarHBondContact O-N 3.24Å; S1026-I1028 PolarHBondContact O-N 3.24Å
1027	V	19.9	Very low	21.3	Very low	89 Å²	89	125.6 Å²	125.6	54%	0.539	71%	0.714	S	S	.	*			trans	-0.8	110.5	157.1	-178.4	0	0	0	0	113.1	L1023 G1025 S1029	L1023-V1027 HydrophobicContact CD2-CG2 4Å; G1025-V1027 PolarHBondContact O-N 2.92Å; V1027-S1029 PolarHBondContact O-N 3.12Å
1028	I	19.1	Very low	21.4	Very low	154 Å²	154	118 Å²	118	79%	0.79	69%	0.687	S	S	*	*			trans	-64.1	86.2	161.6	-61.4	174.1	0	0	0	106.7	S1026 I1030	S1026-I1028 PolarHBondContact O-N 3.24Å; I1028-I1030 PolarHBondContact O-N 2.98Å
1029	S	20.8	Very low	21.6	Very low	101 Å²	101	115.9 Å²	115.9	71%	0.706	68%	0.68	S	S	*	*			trans	-70.5	76	168.4	-76.5	0	0	0	0	108.4	V1027 S1031	V1027-S1029 PolarHBondContact O-N 3.12Å; S1029-S1031 PolarHBondContact O-N 3.47Å
1030	I	18.7	Very low	21.8	Very low	149 Å²	149	113.4 Å²	113.4	76%	0.764	66%	0.658	S	S	*	*			trans	26	83.7	152.3	-52.5	178	0	0	0	111.7	I1028 S1032	I1028-I1030 PolarHBondContact O-N 2.98Å; I1030-S1032 PolarHBondContact O-N 2.76Å
1031	S	19.6	Very low	22	Very low	74 Å²	74	109.9 Å²	109.9	52%	0.517	64%	0.64	S	S	.	*			trans	-45.7	114.9	151.2	50.7	0	0	0	0	109.1	S1029 T1033	S1029-S1031 PolarHBondContact O-N 3.47Å; S1031-T1033 PolarHBondContact O-N 3.47Å; S1031-T1033 PolarHBondContact O-OG1 2.78Å
1032	S	21.9	Very low	22.2	Very low	126 Å²	126	108 Å²	108	88%	0.881	62%	0.623	S	S	*	*			trans	-63.8	72.9	139.3	24.7	0	0	0	0	106.9	I1030	I1030-S1032 PolarHBondContact O-N 2.76Å
1033	T	20.1	Very low	22.4	Very low	96 Å²	96	110.6 Å²	110.6	59%	0.589	63%	0.63	S	S	*	*			trans	-57	148.7	169.2	20.6	0	0	0	0	109.2	S1031	S1031-T1033 PolarHBondContact O-N 3.47Å; S1031-T1033 PolarHBondContact O-OG1 2.78Å
1034	I	21.5	Very low	22.5	Very low	143 Å²	143	110.1 Å²	110.1	73%	0.733	62%	0.62	S	S	*	*			trans	74.3	118.9	166.6	-61.6	154.8	0	0	0	111.8
1035	E	21	Very low	23	Very low	153 Å²	153	109.7 Å²	109.7	72%	0.715	62%	0.618	S	S	*	*			cis	-141.8	135.7	9.1	-139	149.2	-133.3	0	0	112.1
1036	K	21.6	Very low	23.6	Very low	176 Å²	176	116.7 Å²	116.7	77%	0.765	63%	0.63	S	S	*	*			trans	-65.6	140.2	160.2	-66.7	178.9	177.8	-178.1	0	107
1037	T	22.1	Very low	24.1	Very low	103 Å²	103	116.3 Å²	116.3	63%	0.632	62%	0.619	S	S	*	*			trans	-128.5	124.1	156	54.2	0	0	0	0	107.7	E1605	T1037-E1605 HydrophobicContact CG2-CB 3.9Å; T1037-E1605 HydrophobicContact CG2-CG 3.9Å
1038	S	22.7	Very low	24.9	Very low	45 Å²	45	116.7 Å²	116.7	32%	0.315	62%	0.623	S	S	.	*			trans	-96.5	173.8	-158	56.6	0	0	0	0	115.1	E1605	S1038-E1605 WeakPolarHBondContact CB-OE2 3.27Å; S1038-E1605 PolarHBondContact N-OE2 3.42Å; S1038-E1605 PolarHBondContact OG-OE2 2.86Å
1039	I	23.5	Very low	26.1	Very low	77 Å²	77	112.1 Å²	112.1	40%	0.395	60%	0.604	S	S	.	*			trans	77.6	92.7	168.2	-50	171.7	0	0	0	115.5	P358 L1604	P358-I1039 HydrophobicContact CG-CG2 4.3Å; I1039-L1604 HydrophobicContact CD1-CD1 4.04Å; I1039-L1604 HydrophobicContact CD1-CG 4.34Å
1040	S	24	Very low	27.5	Very low	36 Å²	36	108.4 Å²	108.4	25%	0.252	58%	0.578	S	S	.	*			trans	8.8	146.3	150.3	63.5	0	0	0	0	123	N357 P358	N357-S1040 WeakPolarHBondContact CB-OG 3.42Å; P358-S1040 WeakPolarHBondContact CG-OG 3.45Å
1041	N	24.4	Very low	29.1	Very low	88 Å²	88	107.1 Å²	107.1	47%	0.471	57%	0.573	S	S	.	*				-157.3	160.3	103.9	-89.5	-24.9	0	0	0	112.4	F356 R451	F356-N1041 VanDerWaalsContact CD1-OD1 3.28Å; F356-N1041 WeakPolarHBondContact CD1-OD1 3.39Å; F356-N1041 VanDerWaalsContact CE1-OD1 3.32Å; F356-N1041 WeakPolarHBondContact CE1-OD1 3.33Å; R451-N1041 PolarHBondContact NH2-O 3.14Å
1042	D	26.7	Very low	30.7	Very low	47 Å²	47	106.4 Å²	106.4	25%	0.251	56%	0.563	S	S	.	*			trans	-92.2	174.8	169.9	-81.8	-123	0	0	0	109.8	N357 R451 K455	N357-D1042 PolarHBondContact ND2-OD2 2.74Å; R451-D1042 IonicContact CZ-OD1 2.73Å; R451-D1042 IonicContact CZ-OD2 3.45Å; R451-D1042 VanDerWaalsContact CZ-OD2 3.29Å; R451-D1042 IonicContact NE-OD1 2.79Å; R451-D1042 PolarHBondContact NE-OD1 3.22Å; R451-D1042 VanDerWaalsContact NE-OD1 3.13Å; R451-D1042 IonicContact NE-OD2 2.68Å; R451-D1042 PolarHBondContact NE-OD2 2.97Å; R451-D1042 IonicContact NH2-OD1 2.68Å; R451-D1042 PolarHBondContact NH2-OD1 2.7Å; R451-D1042 IonicContact NH2-OD2 3.33Å; R451-D1042 PolarHBondContact NH2-OD2 3.24Å; K455-D1042 VanDerWaalsContact CE-OD1 3.32Å; K455-D1042 WeakPolarHBondContact CE-OD1 3.45Å; K455-D1042 IonicContact NZ-OD1 2.69Å; K455-D1042 PolarHBondContact NZ-OD1 2.69Å
1043	E	27.5	Very low	32.4	Very low	198 Å²	198	100.6 Å²	100.6	93%	0.925	52%	0.523	S	S	*	.			trans	76.2	11.4	176.5	-54.9	-159.2	128.8	0	0	119.6
1044	Y	28	Very low	34.1	Very low	125 Å²	125	101 Å²	101	49%	0.49	52%	0.519	S	S	.	.			trans	-108.5	69.8	165.2	-86.6	-76.6	0	0	0	112.9	L1610	Y1044-L1610 PolarHBondContact OH-O 2.86Å
1045	D	31.3	Very low	35.7	Very low	137 Å²	137	101.3 Å²	101.3	73%	0.733	51%	0.512	S	S	*	.			trans	-144.9	25.1	167.2	-118.7	-24.6	0	0	0	115	N1047	D1045-N1047 PolarHBondContact O-N 2.82Å
1046	K	34.5	Very low	37.7	Very low	209 Å²	209	94.4 Å²	94.4	91%	0.909	48%	0.48	S	S	*	.			trans	-87.2	42.5	154.7	-77.2	-170	176.6	-179.5	0	111
1047	N	37.6	Very low	39.7	Very low	116 Å²	116	92.7 Å²	92.7	62%	0.62	48%	0.475	S	S	*	.			trans	-73.8	123.3	172.3	-157.8	6.9	0	0	0	107.3	D1045 C1049	D1045-N1047 PolarHBondContact O-N 2.82Å; N1047-C1049 PolarHBondContact O-N 3.14Å
1048	P	37.1	Very low	41.8	Very low	98 Å²	98	91.6 Å²	91.6	64%	0.636	48%	0.484	S	S	*	.			trans	-69	96.2	-171.7	26.5	-34.5	0	0	0	110.9	S1050	P1048-S1050 PolarHBondContact O-N 2.84Å; P1048-S1050 VanDerWaalsContact O-N 3.17Å
1049	C	42.9	Very low	44.2	Very low	58 Å²	58	93.1 Å²	93.1	39%	0.392	48%	0.483	S	S	.	.			trans	-60.3	118	162.8	-153.6	0	0	0	0	106.7	N1047 A1053 M1054	N1047-C1049 PolarHBondContact O-N 3.14Å; C1049-A1053 VanDerWaalsContact SG-CB 3.56Å; C1049-M1054 HydrophobicContact CB-SD 4.34Å
1050	S	51.5	Low	46.9	Very low	23 Å²	23	91.6 Å²	91.6	16%	0.161	48%	0.475	C	S	.	.			trans	-52.5	143.2	-169.1	53.6	0	0	0	0	111.9	P1048 L1052 A1053 M1054 Q1080	P1048-S1050 PolarHBondContact O-N 2.84Å; P1048-S1050 VanDerWaalsContact O-N 3.17Å; S1050-L1052 CarbonylContact O-C 3.6Å; S1050-L1052 PolarHBondContact O-N 3.29Å; S1050-A1053 WeakPolarHBondContact O-CA 3.23Å; S1050-A1053 VanDerWaalsContact O-CB 3.31Å; S1050-A1053 WeakPolarHBondContact O-CB 3.33Å; S1050-A1053 PolarHBondContact O-N 3.07Å; S1050-M1054 PolarHBondContact O-N 3.05Å; S1050-Q1080 PolarHBondContact OG-NE2 3.2Å; S1050-Q1080 VanDerWaalsContact OG-NE2 3.09Å
1051	D	51.6	Low	49.6	Very low	121 Å²	121	90.7 Å²	90.7	65%	0.647	47%	0.467	S	S	*	.	H	α-helix	trans	-46.5	-39.6	-171.4	-64.3	-9	0	0	0	113.1	A1053 M1054 Y1055	D1051-A1053 VanDerWaalsContact C-N 3.34Å; D1051-A1053 PolarHBondContact O-N 2.9Å; D1051-M1054 PolarHBondContact O-N 3.1Å; D1051-Y1055 HydrophobicContact CB-CD2 4.24Å; D1051-Y1055 HydrophobicContact CB-CE2 4.19Å; D1051-Y1055 WeakPolarHBondContact O-CD2 3.37Å; D1051-Y1055 PolarHBondContact O-N 3.22Å
1052	L	52.6	Low	52.2	Low	60 Å²	60	87.2 Å²	87.2	31%	0.314	45%	0.45	S	S	.	.	H	α-helix	trans	-58.1	-40.1	176.1	-179.8	58.7	0	0	0	113.5	S1050 Y1055 L1056 A1075 I1291 L1292	S1050-L1052 CarbonylContact O-C 3.6Å; S1050-L1052 PolarHBondContact O-N 3.29Å; L1052-Y1055 PolarHBondContact O-N 3.03Å; L1052-L1056 HydrophobicContact CD1-CD1 4.01Å; L1052-L1056 HydrophobicContact CD1-CG 4.23Å; L1052-L1056 HydrophobicContact CG-CD1 3.95Å; L1052-L1056 WeakPolarHBondContact O-CB 3.32Å; L1052-L1056 WeakPolarHBondContact O-CD1 3.42Å; L1052-L1056 WeakPolarHBondContact O-CG 3.46Å; L1052-L1056 PolarHBondContact O-N 2.93Å; L1052-A1075 HydrophobicContact CD2-CB 4.24Å; L1052-A1075 HydrophobicContact CG-CB 4.48Å; L1052-I1291 HydrophobicContact CD1-CG2 3.95Å; L1052-L1292 HydrophobicContact CD1-CD2 4.49Å
1053	A	58	Low	54.8	Low	4 Å²	4	85.5 Å²	85.5	3%	0.033	44%	0.441	C	S	.	.	H	α-helix	trans	-65.5	-42.3	175	0	0	0	0	0	111.2	C1049 S1050 D1051 L1056 Q1057 L1071	C1049-A1053 VanDerWaalsContact SG-CB 3.56Å; S1050-A1053 WeakPolarHBondContact O-CA 3.23Å; S1050-A1053 VanDerWaalsContact O-CB 3.31Å; S1050-A1053 WeakPolarHBondContact O-CB 3.33Å; S1050-A1053 PolarHBondContact O-N 3.07Å; D1051-A1053 VanDerWaalsContact C-N 3.34Å; D1051-A1053 PolarHBondContact O-N 2.9Å; A1053-L1056 PolarHBondContact O-N 3.4Å; A1053-Q1057 PolarHBondContact O-N 2.81Å; A1053-L1071 HydrophobicContact CB-CD1 4.26Å
1054	M	55.9	Low	57.4	Low	103 Å²	103	76.1 Å²	76.1	51%	0.507	40%	0.397	S	S	.	.	H	α-helix	trans	-62.9	-41.6	173.2	-66.9	-53.5	-48.2	0	0	112.3	C1049 S1050 D1051 L1056 Q1057	C1049-M1054 HydrophobicContact CB-SD 4.34Å; S1050-M1054 PolarHBondContact O-N 3.05Å; D1051-M1054 PolarHBondContact O-N 3.1Å; M1054-L1056 VanDerWaalsContact C-N 3.27Å; M1054-L1056 PolarHBondContact O-N 3.11Å; M1054-Q1057 PolarHBondContact O-N 2.88Å
1055	Y	55.7	Low	59.9	Low	150 Å²	150	71.6 Å²	71.6	59%	0.588	38%	0.384	S	S	*	.	H	α-helix	trans	-68.3	-21.7	176	-79.8	-62.6	0	0	0	114.4	D1051 L1052 R1059	D1051-Y1055 HydrophobicContact CB-CD2 4.24Å; D1051-Y1055 HydrophobicContact CB-CE2 4.19Å; D1051-Y1055 WeakPolarHBondContact O-CD2 3.37Å; D1051-Y1055 PolarHBondContact O-N 3.22Å; L1052-Y1055 PolarHBondContact O-N 3.03Å; Y1055-R1059 VanDerWaalsContact O-CD 3.24Å; Y1055-R1059 WeakPolarHBondContact O-CD 3.24Å; Y1055-R1059 PolarHBondContact O-NE 3.43Å; Y1055-R1059 VanDerWaalsContact O-NE 3.08Å
1056	L	63.6	Low	62.2	Low	9 Å²	9	65.9 Å²	65.9	5%	0.047	35%	0.354	C	S	.	.	H	α-helix	trans	-88.7	-26.9	174.6	-72.9	167.3	0	0	0	112.3	L1052 A1053 M1054 G1058 R1059 L1061 L1071 P1072 I1291 L1292 W2654	L1052-L1056 HydrophobicContact CD1-CD1 4.01Å; L1052-L1056 HydrophobicContact CD1-CG 4.23Å; L1052-L1056 HydrophobicContact CG-CD1 3.95Å; L1052-L1056 WeakPolarHBondContact O-CB 3.32Å; L1052-L1056 WeakPolarHBondContact O-CD1 3.42Å; L1052-L1056 WeakPolarHBondContact O-CG 3.46Å; L1052-L1056 PolarHBondContact O-N 2.93Å; A1053-L1056 PolarHBondContact O-N 3.4Å; M1054-L1056 VanDerWaalsContact C-N 3.27Å; M1054-L1056 PolarHBondContact O-N 3.11Å; L1056-G1058 PolarHBondContact O-N 3.17Å; L1056-R1059 PolarHBondContact O-N 3.5Å; L1056-R1059 VanDerWaalsContact O-N 3.13Å; L1056-L1061 HydrophobicContact CD2-CD1 3.9Å; L1056-L1061 HydrophobicContact CD2-CD2 4.48Å; L1056-L1071 HydrophobicContact CB-CD2 3.88Å; L1056-L1071 HydrophobicContact CD1-CD2 3.71Å; L1056-L1071 HydrophobicContact CG-CD2 4.44Å; L1056-P1072 HydrophobicContact CD1-CG 4.15Å; L1056-I1291 HydrophobicContact CD2-CG2 4.34Å; L1056-L1292 HydrophobicContact CD2-CD2 3.77Å; L1056-L1292 HydrophobicContact CG-CD2 4.19Å; L1056-W2654 HydrophobicContact CD2-CH2 4.49Å
1057	Q	62.3	Low	64.3	Low	140 Å²	140	56.2 Å²	56.2	65%	0.654	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	122.9	-178.3	-166.5	170.6	5.1	0	0	111.1	A1053 M1054 R1059	A1053-Q1057 PolarHBondContact O-N 2.81Å; M1054-Q1057 PolarHBondContact O-N 2.88Å; Q1057-R1059 VanDerWaalsContact C-N 3.3Å; Q1057-R1059 PolarHBondContact O-N 2.75Å
1058	G	66.7	Low	66	Low	80 Å²	80	55.9 Å²	55.9	83%	0.825	31%	0.307	S	S	*	.	T	Hydrogen-bonded Turn	trans	80	-5.7	-178.6	0	0	0	0	0	116.2	L1056	L1056-G1058 PolarHBondContact O-N 3.17Å
1059	R	73.7	Confident	67.7	Low	77 Å²	77	53.3 Å²	53.3	29%	0.291	29%	0.286	S	S	.	.			trans	-74.1	139.8	169.3	-72	-168.6	178.3	-102.2	-7.1	110.7	D655 Y1055 L1056 Q1057 L1061	D655-R1059 IonicContact OD1-NH1 3.78Å; D655-R1059 PolarHBondContact OD1-NH1 2.86Å; D655-R1059 IonicContact OD2-NH1 3.02Å; Y1055-R1059 VanDerWaalsContact O-CD 3.24Å; Y1055-R1059 WeakPolarHBondContact O-CD 3.24Å; Y1055-R1059 PolarHBondContact O-NE 3.43Å; Y1055-R1059 VanDerWaalsContact O-NE 3.08Å; L1056-R1059 PolarHBondContact O-N 3.5Å; L1056-R1059 VanDerWaalsContact O-N 3.13Å; Q1057-R1059 VanDerWaalsContact C-N 3.3Å; Q1057-R1059 PolarHBondContact O-N 2.75Å; R1059-L1061 HydrophobicContact CB-CD2 4.07Å; R1059-L1061 HydrophobicContact CB-CG 4.46Å
1060	L	79.6	Confident	69	Low	44 Å²	44	57.8 Å²	57.8	23%	0.23	30%	0.295	C	S	.	.			trans	-90.4	122.3	168.7	-65.4	-176	0	0	0	109.6	R647 L648 P1294	R647-L1060 HydrophobicContact CB-CD1 3.38Å; R647-L1060 HydrophobicContact CG-CD1 4.44Å; L648-L1060 HydrophobicContact CD2-CB 3.59Å; L648-L1060 HydrophobicContact CG-CB 4.16Å; L648-L1060 HydrophobicContact CG-CD1 4.26Å; L1060-P1294 WeakPolarHBondContact O-CG 3.39Å
1061	L	79.8	Confident	69.7	Low	17 Å²	17	60.1 Å²	60.1	9%	0.089	31%	0.305	C	S	.	.			trans	-115.7	-30.6	-174	-53.7	169.9	0	0	0	111.2	L1056 R1059 Y1297	L1056-L1061 HydrophobicContact CD2-CD1 3.9Å; L1056-L1061 HydrophobicContact CD2-CD2 4.48Å; R1059-L1061 HydrophobicContact CB-CD2 4.07Å; R1059-L1061 HydrophobicContact CB-CG 4.46Å; L1061-Y1297 HydrophobicContact CB-CD2 4.08Å; L1061-Y1297 HydrophobicContact CB-CE1 4.43Å; L1061-Y1297 HydrophobicContact CB-CE2 3.75Å; L1061-Y1297 HydrophobicContact CD2-CE2 3.77Å; L1061-Y1297 HydrophobicContact CG-CE2 4.21Å
1062	S	80.3	Confident	70.4	Confident	15 Å²	15	55.2 Å²	55.2	11%	0.105	28%	0.28	C	S	.	.			trans	-75.6	133.5	177.9	61.8	0	0	0	0	112.6	H644 L648 S1064 V1067	H644-S1062 PolarHBondContact CE1-OG 3.24Å; H644-S1062 PolarHBondContact NE2-O 2.88Å; H644-S1062 PolarHBondContact NE2-OG 3.09Å; L648-S1062 WeakPolarHBondContact CD1-O 3.32Å; S1062-S1064 WeakPolarHBondContact CB-O 3.3Å; S1062-S1064 PolarHBondContact O-N 3.11Å; S1062-S1064 PolarHBondContact OG-O 3.05Å; S1062-V1067 WeakPolarHBondContact CB-O 3.42Å
1063	V	80.6	Confident	71.4	Confident	12 Å²	12	53.5 Å²	53.5	7%	0.073	27%	0.269	C	S	.	.	S	Bend	trans	-68.8	-19.1	165.5	170.6	0	0	0	0	112.1	L959 N962 Q1298	L959-V1063 HydrophobicContact CD2-CB 4.15Å; L959-V1063 HydrophobicContact CD2-CG1 3.77Å; L959-V1063 HydrophobicContact CD2-CG2 3.85Å; N962-V1063 HydrophobicContact CB-CG1 4Å; V1063-Q1298 HydrophobicContact CG2-CG 3.92Å
1064	S	83.4	Confident	71.8	Confident	0 Å²	0	54.5 Å²	54.5	0%	0	27%	0.274	C	S	.	.	S	Bend	trans	-121.4	131.1	-171.9	160.2	0	0	0	0	109.8	E966 S1062 S1066 V1067 K1438	E966-S1064 VanDerWaalsContact OE1-CB 3.32Å; E966-S1064 WeakPolarHBondContact OE1-CB 3.3Å; E966-S1064 PolarHBondContact OE1-OG 2.68Å; E966-S1064 WeakPolarHBondContact OE2-CB 3.3Å; E966-S1064 PolarHBondContact OE2-OG 2.59Å; S1062-S1064 WeakPolarHBondContact CB-O 3.3Å; S1062-S1064 PolarHBondContact O-N 3.11Å; S1062-S1064 PolarHBondContact OG-O 3.05Å; S1064-S1066 PolarHBondContact O-N 3.05Å; S1064-S1066 VanDerWaalsContact OG-CB 3.31Å; S1064-S1066 WeakPolarHBondContact OG-CB 3.12Å; S1064-S1066 PolarHBondContact OG-N 2.8Å; S1064-S1066 PolarHBondContact OG-OG 2.75Å; S1064-V1067 PolarHBondContact O-N 3.3Å; S1064-K1438 VanDerWaalsContact CB-NZ 3.31Å
1065	P	80.3	Confident	72.2	Confident	31 Å²	31	49.8 Å²	49.8	20%	0.201	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-18.8	173	31.3	-34.7	0	0	0	112.1	I640 F641 H644 V1067	I640-P1065 HydrophobicContact CG2-CB 4.27Å; I640-P1065 HydrophobicContact CG2-CG 4.43Å; F641-P1065 HydrophobicContact CD1-CG 3.83Å; F641-P1065 HydrophobicContact CD2-CG 3.83Å; F641-P1065 HydrophobicContact CE1-CG 3.72Å; F641-P1065 HydrophobicContact CE2-CG 3.7Å; F641-P1065 HydrophobicContact CG-CG 3.91Å; F641-P1065 HydrophobicContact CZ-CG 3.65Å; H644-P1065 HydrophobicContact CB-CB 4.17Å; P1065-V1067 VanDerWaalsContact C-N 3.31Å
1066	S	78	Confident	72.8	Confident	16 Å²	16	43.9 Å²	43.9	11%	0.112	23%	0.232	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.4	-17.9	179.5	-35.6	0	0	0	0	113.3	E966 S1064 S1446	E966-S1066 PolarHBondContact OE1-OG 3.17Å; S1064-S1066 PolarHBondContact O-N 3.05Å; S1064-S1066 VanDerWaalsContact OG-CB 3.31Å; S1064-S1066 WeakPolarHBondContact OG-CB 3.12Å; S1064-S1066 PolarHBondContact OG-N 2.8Å; S1064-S1066 PolarHBondContact OG-OG 2.75Å; S1066-S1446 VanDerWaalsContact O-CA 3.32Å; S1066-S1446 WeakPolarHBondContact O-CA 3.3Å
1067	V	80.3	Confident	73.1	Confident	6 Å²	6	52.3 Å²	52.3	4%	0.036	26%	0.263	C	S	.	.	B	Isolated β-bridge	trans	-114.1	129	-170.8	173.2	0	0	0	0	111.5	S1062 S1064 P1065 F1069 L1442 N1445	S1062-V1067 WeakPolarHBondContact CB-O 3.42Å; S1064-V1067 PolarHBondContact O-N 3.3Å; P1065-V1067 VanDerWaalsContact C-N 3.31Å; V1067-F1069 HydrophobicContact CB-CE2 4.45Å; V1067-F1069 HydrophobicContact CG1-CD2 4.08Å; V1067-F1069 HydrophobicContact CG1-CE2 3.52Å; V1067-F1069 HydrophobicContact CG1-CZ 4.13Å; V1067-L1442 HydrophobicContact CG2-CD2 3.95Å; V1067-N1445 HydrophobicContact CG1-CB 3.64Å
1068	E	71.9	Confident	73.3	Confident	110 Å²	110	51.2 Å²	51.2	51%	0.514	26%	0.258	S	S	.	.			trans	-105.6	117.7	-176.8	-169.7	-169.8	149.7	0	0	111.2	R1070 N1445 S1447	E1068-R1070 PolarHBondContact O-N 2.98Å; E1068-N1445 PolarHBondContact N-O 3.17Å; E1068-S1447 VanDerWaalsContact OE2-CB 3.31Å; E1068-S1447 WeakPolarHBondContact OE2-CB 3.49Å
1069	F	72.3	Confident	73.6	Confident	44 Å²	44	47.4 Å²	47.4	19%	0.193	22%	0.219	C	C	.	.			trans	-89.7	102.2	176.1	-75.7	-99.1	0	0	0	110	V1067 Y1297 Q2653	V1067-F1069 HydrophobicContact CB-CE2 4.45Å; V1067-F1069 HydrophobicContact CG1-CD2 4.08Å; V1067-F1069 HydrophobicContact CG1-CE2 3.52Å; V1067-F1069 HydrophobicContact CG1-CZ 4.13Å; F1069-Y1297 AromaticContact CD1-CD1 3.46Å; F1069-Y1297 HydrophobicContact CD1-CD1 3.46Å; F1069-Y1297 VanDerWaalsContact CD1-CD1 3.46Å; F1069-Y1297 AromaticContact CD1-CE1 3.84Å; F1069-Y1297 HydrophobicContact CD1-CE1 3.84Å; F1069-Y1297 HydrophobicContact CD1-CG 4.3Å; F1069-Y1297 AromaticContact CE1-CD1 3.37Å; F1069-Y1297 HydrophobicContact CE1-CD1 3.37Å; F1069-Y1297 HydrophobicContact CE1-CE1 4.22Å; F1069-Y1297 AromaticContact CE1-CG 3.99Å; F1069-Y1297 HydrophobicContact CE1-CG 3.99Å; F1069-Y1297 HydrophobicContact CG-CD1 4.39Å; F1069-Y1297 HydrophobicContact CZ-CD1 4.22Å; F1069-Y1297 HydrophobicContact CZ-CG 4.42Å; F1069-Q2653 HydrophobicContact CD1-CB 4.42Å; F1069-Q2653 HydrophobicContact CD1-CG 4.21Å; F1069-Q2653 HydrophobicContact CE1-CB 4.26Å
1070	R	70.2	Confident	73.3	Confident	152 Å²	152	45.8 Å²	45.8	57%	0.574	22%	0.215	S	C	*	.	P	Polyproline II helix	trans	-60	153.2	168.7	-64.1	179.6	177.6	174.8	-1.5	110.2	E1068 Q2653 W2654	E1068-R1070 PolarHBondContact O-N 2.98Å; R1070-Q2653 PolarHBondContact O-NE2 3.47Å; R1070-W2654 WeakPolarHBondContact O-CZ2 3.32Å
1071	L	67.2	Low	72.8	Confident	72 Å²	72	50.4 Å²	50.4	38%	0.377	24%	0.239	S	C	.	.	P	Polyproline II helix	trans	-57.2	156	174.5	-71.4	172.9	0	0	0	111.7	A1053 L1056 Y1073	A1053-L1071 HydrophobicContact CB-CD1 4.26Å; L1056-L1071 HydrophobicContact CB-CD2 3.88Å; L1056-L1071 HydrophobicContact CD1-CD2 3.71Å; L1056-L1071 HydrophobicContact CG-CD2 4.44Å; L1071-Y1073 PolarHBondContact O-N 3.45Å
1072	P	66.3	Low	72.4	Confident	17 Å²	17	50.3 Å²	50.3	11%	0.11	24%	0.24	C	C	.	.	P	Polyproline II helix	trans	-50.8	140.2	164.3	-17.3	27	0	0	0	109.5	L1056 L1074 A1075 S1076 W2654	L1056-P1072 HydrophobicContact CD1-CG 4.15Å; P1072-L1074 VanDerWaalsContact C-N 3.34Å; P1072-L1074 PolarHBondContact O-N 3.14Å; P1072-A1075 HydrophobicContact CB-CB 4.15Å; P1072-A1075 HydrophobicContact CG-CB 4.17Å; P1072-A1075 CarbonylContact O-C 3.52Å; P1072-A1075 WeakPolarHBondContact O-CA 3.43Å; P1072-A1075 PolarHBondContact O-N 3.42Å; P1072-S1076 PolarHBondContact O-N 3.42Å; P1072-W2654 VanDerWaalsContact CA-NE1 3.29Å; P1072-W2654 HydrophobicContact CB-CD2 4.24Å; P1072-W2654 HydrophobicContact CB-CG 4.35Å; P1072-W2654 HydrophobicContact CB-CZ2 4.46Å; P1072-W2654 HydrophobicContact CG-CD2 3.9Å; P1072-W2654 HydrophobicContact CG-CE3 4.2Å; P1072-W2654 HydrophobicContact CG-CH2 3.87Å; P1072-W2654 HydrophobicContact CG-CZ2 3.59Å; P1072-W2654 HydrophobicContact CG-CZ3 4.18Å
1073	Y	73.7	Confident	71.9	Confident	25 Å²	25	53.6 Å²	53.6	10%	0.098	25%	0.25	C	S	.	.	G	3₁₀ helix	trans	-49.9	-55.3	-173.2	176.9	-105.4	0	0	0	111.7	L1071 A1075 S1076 E1078 G1079 S1082 E1528 R2555 H2557	L1071-Y1073 PolarHBondContact O-N 3.45Å; Y1073-A1075 PolarHBondContact O-N 3.06Å; Y1073-A1075 VanDerWaalsContact O-N 3.08Å; Y1073-S1076 WeakPolarHBondContact O-CB 3.45Å; Y1073-S1076 PolarHBondContact O-N 3.38Å; Y1073-S1076 PolarHBondContact O-OG 2.91Å; Y1073-S1076 VanDerWaalsContact O-OG 3.13Å; Y1073-E1078 HydrophobicContact CE2-CB 4.2Å; Y1073-E1078 HydrophobicContact CE2-CG 3.88Å; Y1073-E1078 WeakPolarHBondContact CE2-OE1 3.32Å; Y1073-G1079 WeakPolarHBondContact O-CA 3.5Å; Y1073-G1079 PolarHBondContact O-N 3.06Å; Y1073-S1082 WeakPolarHBondContact OH-CB 3.42Å; Y1073-E1528 HydrophobicContact CE1-CG 3.95Å; Y1073-E1528 WeakPolarHBondContact CE1-OE1 3.42Å; Y1073-R2555 VanDerWaalsContact CD2-NH2 3.29Å; Y1073-H2557 AromaticContact CD1-CE1 3.4Å; Y1073-H2557 WeakPolarHBondContact CD1-CE1 2.89Å; Y1073-H2557 AromaticContact CD1-NE2 3.94Å; Y1073-H2557 AromaticContact CE1-CE1 3.76Å
1074	L	67	Low	71.5	Confident	24 Å²	24	53.2 Å²	53.2	13%	0.126	25%	0.248	C	C	.	.	G	3₁₀ helix	trans	-62.1	-14.1	178.5	-63.4	167.8	0	0	0	114.8	P1072 Y1085 Y1088 I1092 H2557	P1072-L1074 VanDerWaalsContact C-N 3.34Å; P1072-L1074 PolarHBondContact O-N 3.14Å; L1074-Y1085 HydrophobicContact CB-CD2 4.49Å; L1074-Y1085 HydrophobicContact CD2-CD2 4.34Å; L1074-Y1085 WeakPolarHBondContact O-CE2 3.07Å; L1074-Y1088 HydrophobicContact CD1-CD1 4.31Å; L1074-Y1088 HydrophobicContact CD1-CD2 4.33Å; L1074-Y1088 HydrophobicContact CD1-CG 3.85Å; L1074-I1092 HydrophobicContact CD1-CD1 3.97Å; L1074-H2557 HydrophobicContact CD1-CB 4.42Å
1075	A	64.3	Low	70.9	Confident	4 Å²	4	55.9 Å²	55.9	3%	0.033	26%	0.258	C	S	.	.	G	3₁₀ helix	trans	-102.4	-4.7	173.8	0	0	0	0	0	112.9	L1052 P1072 Y1073 Q1080	L1052-A1075 HydrophobicContact CD2-CB 4.24Å; L1052-A1075 HydrophobicContact CG-CB 4.48Å; P1072-A1075 HydrophobicContact CB-CB 4.15Å; P1072-A1075 HydrophobicContact CG-CB 4.17Å; P1072-A1075 CarbonylContact O-C 3.52Å; P1072-A1075 WeakPolarHBondContact O-CA 3.43Å; P1072-A1075 PolarHBondContact O-N 3.42Å; Y1073-A1075 PolarHBondContact O-N 3.06Å; Y1073-A1075 VanDerWaalsContact O-N 3.08Å; A1075-Q1080 PolarHBondContact O-NE2 2.96Å
1076	S	68.1	Low	69.9	Low	26 Å²	26	58.7 Å²	58.7	18%	0.182	28%	0.277	C	S	.	.	S	Bend	trans	-82.2	160.4	169.1	98	0	0	0	0	110.2	P1072 Y1073 E1078 G1079 Q1080	P1072-S1076 PolarHBondContact O-N 3.42Å; Y1073-S1076 WeakPolarHBondContact O-CB 3.45Å; Y1073-S1076 PolarHBondContact O-N 3.38Å; Y1073-S1076 PolarHBondContact O-OG 2.91Å; Y1073-S1076 VanDerWaalsContact O-OG 3.13Å; S1076-E1078 PolarHBondContact O-N 3.23Å; S1076-E1078 WeakPolarHBondContact OG-CB 3.22Å; S1076-E1078 PolarHBondContact OG-N 2.71Å; S1076-E1078 VanDerWaalsContact OG-N 3.13Å; S1076-G1079 PolarHBondContact O-N 3.47Å; S1076-G1079 VanDerWaalsContact O-N 3.13Å; S1076-G1079 PolarHBondContact OG-N 3.47Å; S1076-Q1080 WeakPolarHBondContact O-CB 3.34Å; S1076-Q1080 VanDerWaalsContact O-CG 3.31Å; S1076-Q1080 WeakPolarHBondContact O-CG 3.38Å; S1076-Q1080 PolarHBondContact O-N 2.98Å
1077	R	69.2	Low	69	Low	186 Å²	186	60.3 Å²	60.3	70%	0.702	28%	0.28	S	S	*	.	H	α-helix	trans	-57.3	-32.8	173.6	-173.7	176.6	-178.7	161.5	3.5	112.7	L1081	R1077-L1081 HydrophobicContact CG-CD1 4.33Å; R1077-L1081 WeakPolarHBondContact O-CB 3.45Å; R1077-L1081 WeakPolarHBondContact O-CD1 3.12Å; R1077-L1081 VanDerWaalsContact O-CG 3.25Å; R1077-L1081 WeakPolarHBondContact O-CG 3.31Å; R1077-L1081 PolarHBondContact O-N 2.68Å
1078	E	66.6	Low	68	Low	118 Å²	118	61.2 Å²	61.2	55%	0.551	28%	0.283	S	S	*	.	H	α-helix	trans	-67.9	-44.2	176.7	-166.6	-164.9	153.9	0	0	111	Y1073 S1076 L1081 S1082 R2555	Y1073-E1078 HydrophobicContact CE2-CB 4.2Å; Y1073-E1078 HydrophobicContact CE2-CG 3.88Å; Y1073-E1078 WeakPolarHBondContact CE2-OE1 3.32Å; S1076-E1078 PolarHBondContact O-N 3.23Å; S1076-E1078 WeakPolarHBondContact OG-CB 3.22Å; S1076-E1078 PolarHBondContact OG-N 2.71Å; S1076-E1078 VanDerWaalsContact OG-N 3.13Å; E1078-L1081 CarbonylContact O-C 3.6Å; E1078-L1081 PolarHBondContact O-N 3.2Å; E1078-S1082 PolarHBondContact O-N 3.13Å; E1078-S1082 VanDerWaalsContact O-N 3.13Å; E1078-R2555 IonicContact OE1-NH2 3.13Å
1079	G	73.5	Confident	67	Low	0 Å²	0	57.7 Å²	57.7	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-78.6	-27.8	178.5	0	0	0	0	0	114.6	Y1073 S1076 L1081 S1082 Y1085	Y1073-G1079 WeakPolarHBondContact O-CA 3.5Å; Y1073-G1079 PolarHBondContact O-N 3.06Å; S1076-G1079 PolarHBondContact O-N 3.47Å; S1076-G1079 VanDerWaalsContact O-N 3.13Å; S1076-G1079 PolarHBondContact OG-N 3.47Å; G1079-L1081 PolarHBondContact O-N 3.03Å; G1079-S1082 VanDerWaalsContact O-CB 3.27Å; G1079-S1082 WeakPolarHBondContact O-CB 3.2Å; G1079-S1082 PolarHBondContact O-N 3.28Å; G1079-S1082 PolarHBondContact O-OG 3.25Å; G1079-Y1085 WeakPolarHBondContact O-CB 3.03Å; G1079-Y1085 WeakPolarHBondContact O-CD2 2.97Å
1080	Q	66.8	Low	65.8	Low	43 Å²	43	63.3 Å²	63.3	20%	0.201	29%	0.29	C	S	.	.	H	α-helix	trans	-64	-32	168.7	-73.7	164.2	-7.3	0	0	111.5	S1050 A1075 S1076 S1082 Y1085	S1050-Q1080 PolarHBondContact OG-NE2 3.2Å; S1050-Q1080 VanDerWaalsContact OG-NE2 3.09Å; A1075-Q1080 PolarHBondContact O-NE2 2.96Å; S1076-Q1080 WeakPolarHBondContact O-CB 3.34Å; S1076-Q1080 VanDerWaalsContact O-CG 3.31Å; S1076-Q1080 WeakPolarHBondContact O-CG 3.38Å; S1076-Q1080 PolarHBondContact O-N 2.98Å; Q1080-S1082 VanDerWaalsContact C-N 3.34Å; Q1080-Y1085 HydrophobicContact CG-CE2 4.06Å; Q1080-Y1085 WeakPolarHBondContact O-CD1 3.11Å
1081	L	68.8	Low	64.4	Low	141 Å²	141	57.1 Å²	57.1	74%	0.738	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-2.5	171.5	-66.7	172	0	0	0	113.2	R1077 E1078 G1079	R1077-L1081 HydrophobicContact CG-CD1 4.33Å; R1077-L1081 WeakPolarHBondContact O-CB 3.45Å; R1077-L1081 WeakPolarHBondContact O-CD1 3.12Å; R1077-L1081 VanDerWaalsContact O-CG 3.25Å; R1077-L1081 WeakPolarHBondContact O-CG 3.31Å; R1077-L1081 PolarHBondContact O-N 2.68Å; E1078-L1081 CarbonylContact O-C 3.6Å; E1078-L1081 PolarHBondContact O-N 3.2Å; G1079-L1081 PolarHBondContact O-N 3.03Å
1082	S	72.1	Confident	63.5	Low	15 Å²	15	57 Å²	57	11%	0.105	27%	0.269	C	S	.	.	S	Bend	trans	-74.4	145.9	-177.5	76.9	0	0	0	0	112.1	Y1073 E1078 G1079 Q1080 L1084 Y1085	Y1073-S1082 WeakPolarHBondContact OH-CB 3.42Å; E1078-S1082 PolarHBondContact O-N 3.13Å; E1078-S1082 VanDerWaalsContact O-N 3.13Å; G1079-S1082 VanDerWaalsContact O-CB 3.27Å; G1079-S1082 WeakPolarHBondContact O-CB 3.2Å; G1079-S1082 PolarHBondContact O-N 3.28Å; G1079-S1082 PolarHBondContact O-OG 3.25Å; Q1080-S1082 VanDerWaalsContact C-N 3.34Å; S1082-L1084 PolarHBondContact O-N 3.41Å; S1082-L1084 VanDerWaalsContact O-N 3.15Å; S1082-Y1085 WeakPolarHBondContact O-CB 3.23Å; S1082-Y1085 PolarHBondContact O-N 3.4Å
1083	Y	69.1	Low	62.2	Low	83 Å²	83	60.6 Å²	60.6	33%	0.325	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.5	-177.3	174.4	-91.3	0	0	0	114.1	V1530 M1531 P1532 P1533	Y1083-V1530 HydrophobicContact CD1-CB 4.35Å; Y1083-V1530 HydrophobicContact CD1-CG1 3.92Å; Y1083-V1530 HydrophobicContact CD1-CG2 4.38Å; Y1083-V1530 HydrophobicContact CD2-CG1 3.59Å; Y1083-V1530 HydrophobicContact CE1-CG1 4.04Å; Y1083-V1530 HydrophobicContact CE2-CG1 3.69Å; Y1083-V1530 HydrophobicContact CG-CB 4.31Å; Y1083-V1530 HydrophobicContact CG-CG1 3.71Å; Y1083-V1530 HydrophobicContact CG-CG2 4.05Å; Y1083-M1531 HydrophobicContact CE1-CB 4.03Å; Y1083-M1531 PolarHBondContact OH-O 3.05Å; Y1083-P1532 PolarHBondContact OH-O 3.47Å; Y1083-P1533 HydrophobicContact CE2-CB 4.23Å; Y1083-P1533 WeakPolarHBondContact OH-CA 3.42Å
1084	L	73	Confident	60.3	Low	4 Å²	4	67.3 Å²	67.3	2%	0.021	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	-0.4	178.7	-62.9	179	0	0	0	113.8	S1082 Y1087 Y1088 I1529 L2414 A2561	S1082-L1084 PolarHBondContact O-N 3.41Å; S1082-L1084 VanDerWaalsContact O-N 3.15Å; L1084-Y1087 PolarHBondContact O-N 3.02Å; L1084-Y1088 HydrophobicContact CB-CD2 3.94Å; L1084-Y1088 HydrophobicContact CB-CE2 4.27Å; L1084-Y1088 HydrophobicContact CD1-CE2 4.32Å; L1084-Y1088 PolarHBondContact O-N 3.37Å; L1084-I1529 HydrophobicContact CD1-CD1 4.35Å; L1084-I1529 HydrophobicContact CD1-CG1 3.9Å; L1084-L2414 HydrophobicContact CD2-CD1 4.32Å; L1084-L2414 HydrophobicContact CD2-CD2 4.5Å; L1084-A2561 HydrophobicContact CD1-CB 4.07Å
1085	Y	70.2	Confident	58.5	Low	56 Å²	56	67.5 Å²	67.5	22%	0.22	32%	0.315	C	S	.	.	H	α-helix	trans	-58.9	-44	-177.4	-175.9	-109.9	0	0	0	114.4	L1074 G1079 Q1080 S1082 Y1087 Y1088 T1089	L1074-Y1085 HydrophobicContact CB-CD2 4.49Å; L1074-Y1085 HydrophobicContact CD2-CD2 4.34Å; L1074-Y1085 WeakPolarHBondContact O-CE2 3.07Å; G1079-Y1085 WeakPolarHBondContact O-CB 3.03Å; G1079-Y1085 WeakPolarHBondContact O-CD2 2.97Å; Q1080-Y1085 HydrophobicContact CG-CE2 4.06Å; Q1080-Y1085 WeakPolarHBondContact O-CD1 3.11Å; S1082-Y1085 WeakPolarHBondContact O-CB 3.23Å; S1082-Y1085 PolarHBondContact O-N 3.4Å; Y1085-Y1087 PolarHBondContact O-N 3.24Å; Y1085-Y1088 PolarHBondContact O-N 2.93Å; Y1085-T1089 WeakPolarHBondContact CE1-OG1 3.01Å; Y1085-T1089 WeakPolarHBondContact CE2-OG1 3.22Å; Y1085-T1089 VanDerWaalsContact CZ-OG1 3.28Å; Y1085-T1089 WeakPolarHBondContact O-CB 3.46Å; Y1085-T1089 PolarHBondContact O-N 3.12Å; Y1085-T1089 PolarHBondContact O-OG1 3.14Å
1086	P	58.9	Low	56.9	Low	91 Å²	91	73.1 Å²	73.1	59%	0.591	34%	0.344	S	S	*	.	H	α-helix	trans	-64.7	-42.3	-179.8	-21.9	34.8	0	0	0	112.1	T1089 Y1090	P1086-T1089 PolarHBondContact O-N 3.03Å; P1086-Y1090 WeakPolarHBondContact O-CB 3.49Å; P1086-Y1090 PolarHBondContact O-N 2.67Å
1087	Y	59.1	Low	55	Low	49 Å²	49	73.8 Å²	73.8	19%	0.192	36%	0.355	C	S	.	.	H	α-helix	trans	-60.7	-46.3	174.4	172.1	-94.8	0	0	0	111.4	L1084 Y1085 V1091 L2414	L1084-Y1087 PolarHBondContact O-N 3.02Å; Y1085-Y1087 PolarHBondContact O-N 3.24Å; Y1087-V1091 HydrophobicContact CE1-CG2 4.25Å; Y1087-V1091 HydrophobicContact CE2-CG2 4.34Å; Y1087-V1091 WeakPolarHBondContact O-CB 3.2Å; Y1087-V1091 VanDerWaalsContact O-CG2 3.28Å; Y1087-V1091 WeakPolarHBondContact O-CG2 3.3Å; Y1087-V1091 PolarHBondContact O-N 3.43Å; Y1087-L2414 HydrophobicContact CD1-CD1 3.79Å; Y1087-L2414 HydrophobicContact CD2-CD1 3.79Å; Y1087-L2414 HydrophobicContact CD2-CD2 4.16Å; Y1087-L2414 HydrophobicContact CD2-CG 3.68Å; Y1087-L2414 HydrophobicContact CE1-CD1 3.72Å; Y1087-L2414 HydrophobicContact CE2-CD1 3.72Å; Y1087-L2414 HydrophobicContact CE2-CG 3.75Å; Y1087-L2414 HydrophobicContact CG-CD1 3.81Å; Y1087-L2414 HydrophobicContact CG-CD2 4.33Å; Y1087-L2414 HydrophobicContact CG-CG 4.1Å
1088	Y	59.7	Low	53.2	Low	25 Å²	25	68 Å²	68	10%	0.098	33%	0.333	C	S	.	.	H	α-helix	trans	-72.2	-30.5	178.8	-87	-69.2	0	0	0	113.7	L1074 L1084 Y1085 V1091 I1092 H2557	L1074-Y1088 HydrophobicContact CD1-CD1 4.31Å; L1074-Y1088 HydrophobicContact CD1-CD2 4.33Å; L1074-Y1088 HydrophobicContact CD1-CG 3.85Å; L1084-Y1088 HydrophobicContact CB-CD2 3.94Å; L1084-Y1088 HydrophobicContact CB-CE2 4.27Å; L1084-Y1088 HydrophobicContact CD1-CE2 4.32Å; L1084-Y1088 PolarHBondContact O-N 3.37Å; Y1085-Y1088 PolarHBondContact O-N 2.93Å; Y1088-V1091 CarbonylContact O-C 3.46Å; Y1088-V1091 PolarHBondContact O-N 2.9Å; Y1088-I1092 HydrophobicContact CD1-CD1 4.28Å; Y1088-I1092 WeakPolarHBondContact O-CB 3.47Å; Y1088-I1092 WeakPolarHBondContact O-CD1 3.34Å; Y1088-I1092 WeakPolarHBondContact O-CG1 3.35Å; Y1088-I1092 PolarHBondContact O-N 3.02Å; Y1088-H2557 HydrophobicContact CD2-CB 4.21Å; Y1088-H2557 AromaticContact CD2-CD2 3.71Å; Y1088-H2557 HydrophobicContact CE1-CB 4.16Å; Y1088-H2557 HydrophobicContact CE2-CB 3.67Å; Y1088-H2557 AromaticContact CE2-CD2 3.62Å; Y1088-H2557 PolarHBondContact OH-O 2.79Å
1089	T	51.9	Low	51.7	Low	36 Å²	36	70.5 Å²	70.5	22%	0.221	34%	0.337	C	S	.	.	H	α-helix	trans	-63.2	-50.1	172.9	-57.1	0	0	0	0	110	Y1085 P1086 V1091 I1092 D1093	Y1085-T1089 WeakPolarHBondContact CE1-OG1 3.01Å; Y1085-T1089 WeakPolarHBondContact CE2-OG1 3.22Å; Y1085-T1089 VanDerWaalsContact CZ-OG1 3.28Å; Y1085-T1089 WeakPolarHBondContact O-CB 3.46Å; Y1085-T1089 PolarHBondContact O-N 3.12Å; Y1085-T1089 PolarHBondContact O-OG1 3.14Å; P1086-T1089 PolarHBondContact O-N 3.03Å; T1089-V1091 PolarHBondContact O-N 2.98Å; T1089-V1091 VanDerWaalsContact O-N 3.16Å; T1089-I1092 PolarHBondContact O-N 3.48Å; T1089-D1093 VanDerWaalsContact CG2-OD2 3.24Å; T1089-D1093 WeakPolarHBondContact CG2-OD2 3.43Å; T1089-D1093 PolarHBondContact O-N 3.42Å
1090	Y	45.8	Very low	49.9	Very low	162 Å²	162	75.1 Å²	75.1	64%	0.635	36%	0.362	S	S	*	.	H	α-helix	trans	-54.3	-35.4	171.8	178.7	-112.5	0	0	0	113.2	P1086	P1086-Y1090 WeakPolarHBondContact O-CB 3.49Å; P1086-Y1090 PolarHBondContact O-N 2.67Å
1091	V	42.3	Very low	48.5	Very low	23 Å²	23	76.8 Å²	76.8	14%	0.139	37%	0.372	C	S	.	.	H	α-helix	trans	-84.6	-18.8	178	172.4	0	0	0	0	114	Y1087 Y1088 T1089 P1095	Y1087-V1091 HydrophobicContact CE1-CG2 4.25Å; Y1087-V1091 HydrophobicContact CE2-CG2 4.34Å; Y1087-V1091 WeakPolarHBondContact O-CB 3.2Å; Y1087-V1091 VanDerWaalsContact O-CG2 3.28Å; Y1087-V1091 WeakPolarHBondContact O-CG2 3.3Å; Y1087-V1091 PolarHBondContact O-N 3.43Å; Y1088-V1091 CarbonylContact O-C 3.46Å; Y1088-V1091 PolarHBondContact O-N 2.9Å; T1089-V1091 PolarHBondContact O-N 2.98Å; T1089-V1091 VanDerWaalsContact O-N 3.16Å; V1091-P1095 WeakPolarHBondContact O-CD 3.42Å
1092	I	46.5	Very low	47.1	Very low	70 Å²	70	73 Å²	73	36%	0.359	35%	0.352	S	S	.	.	H	α-helix	trans	-103.9	-26.7	-175.1	-70.4	168.8	0	0	0	112.8	L1074 Y1088 T1089 W1094 P1095	L1074-I1092 HydrophobicContact CD1-CD1 3.97Å; Y1088-I1092 HydrophobicContact CD1-CD1 4.28Å; Y1088-I1092 WeakPolarHBondContact O-CB 3.47Å; Y1088-I1092 WeakPolarHBondContact O-CD1 3.34Å; Y1088-I1092 WeakPolarHBondContact O-CG1 3.35Å; Y1088-I1092 PolarHBondContact O-N 3.02Å; T1089-I1092 PolarHBondContact O-N 3.48Å; I1092-W1094 VanDerWaalsContact C-N 3.31Å; I1092-P1095 VanDerWaalsContact C-CD 3.4Å; I1092-P1095 WeakPolarHBondContact O-CD 3.19Å; I1092-P1095 WeakPolarHBondContact O-CG 3.31Å
1093	D	39.7	Very low	45.5	Very low	92 Å²	92	76.2 Å²	76.2	49%	0.492	37%	0.368	S	S	.	.	H	α-helix	trans	-76	-26.6	168	-61.9	-24.8	0	0	0	110.7	T1089 P1095 L1096 G1097	T1089-D1093 VanDerWaalsContact CG2-OD2 3.24Å; T1089-D1093 WeakPolarHBondContact CG2-OD2 3.43Å; T1089-D1093 PolarHBondContact O-N 3.42Å; D1093-P1095 VanDerWaalsContact C-N 3.34Å; D1093-L1096 WeakPolarHBondContact O-CB 3.4Å; D1093-L1096 PolarHBondContact O-N 3.49Å; D1093-G1097 PolarHBondContact O-N 3.31Å
1094	W	33.4	Very low	44	Very low	165 Å²	165	76.9 Å²	76.9	63%	0.625	38%	0.375	S	S	*	.	H	α-helix	trans	-57.1	-36.2	171.1	-165.9	-91.8	0	0	0	113.9	I1092 G1097 R1098	I1092-W1094 VanDerWaalsContact C-N 3.31Å; W1094-G1097 CarbonylContact O-C 3.53Å; W1094-G1097 VanDerWaalsContact O-C 3.31Å; W1094-G1097 WeakPolarHBondContact O-CA 3.37Å; W1094-G1097 PolarHBondContact O-N 3.18Å; W1094-G1097 VanDerWaalsContact O-N 3.08Å; W1094-R1098 PolarHBondContact O-N 2.72Å
1095	P	30.3	Very low	42.6	Very low	29 Å²	29	81 Å²	81	19%	0.188	39%	0.393	C	S	.	.	H	α-helix	trans	-77.4	-7.2	168.9	17.4	-25.9	0	0	0	118.2	V1091 I1092 D1093 G1097 R1098 R1099	V1091-P1095 WeakPolarHBondContact O-CD 3.42Å; I1092-P1095 VanDerWaalsContact C-CD 3.4Å; I1092-P1095 WeakPolarHBondContact O-CD 3.19Å; I1092-P1095 WeakPolarHBondContact O-CG 3.31Å; D1093-P1095 VanDerWaalsContact C-N 3.34Å; P1095-G1097 VanDerWaalsContact C-N 3.28Å; P1095-R1098 HydrophobicContact CB-CB 4.13Å; P1095-R1098 HydrophobicContact CB-CG 4.34Å; P1095-R1098 PolarHBondContact O-N 2.79Å; P1095-R1099 VanDerWaalsContact O-CB 3.3Å; P1095-R1099 WeakPolarHBondContact O-CB 3.32Å; P1095-R1099 PolarHBondContact O-N 3.38Å
1096	L	29.5	Very low	41.3	Very low	122 Å²	122	84.4 Å²	84.4	64%	0.639	41%	0.406	S	S	*	.	H	α-helix	trans	-62.4	-46.1	153.1	-96.6	153.1	0	0	0	108.3	D1093 R1098 R1099 L1100	D1093-L1096 WeakPolarHBondContact O-CB 3.4Å; D1093-L1096 PolarHBondContact O-N 3.49Å; L1096-R1098 PolarHBondContact O-N 3.26Å; L1096-R1099 PolarHBondContact O-N 3.08Å; L1096-L1100 WeakPolarHBondContact O-CB 3.07Å; L1096-L1100 PolarHBondContact O-N 3.19Å
1097	G	29.6	Very low	40.6	Very low	40 Å²	40	86 Å²	86	41%	0.412	40%	0.403	S	S	.	.	H	α-helix	trans	-54.2	-41.3	166.4	0	0	0	0	0	114	D1093 W1094 P1095 N1101	D1093-G1097 PolarHBondContact O-N 3.31Å; W1094-G1097 CarbonylContact O-C 3.53Å; W1094-G1097 VanDerWaalsContact O-C 3.31Å; W1094-G1097 WeakPolarHBondContact O-CA 3.37Å; W1094-G1097 PolarHBondContact O-N 3.18Å; W1094-G1097 VanDerWaalsContact O-N 3.08Å; P1095-G1097 VanDerWaalsContact C-N 3.28Å; G1097-N1101 WeakPolarHBondContact O-CB 3.31Å; G1097-N1101 PolarHBondContact O-N 3.1Å
1098	R	30.4	Very low	40.1	Very low	65 Å²	65	88.3 Å²	88.3	25%	0.245	42%	0.416	C	S	.	.	H	α-helix	trans	-70.2	-37.9	173.9	-66.1	-165.5	-174.4	-177.6	5.8	113.6	W1094 P1095 L1096 L1100 N1101 D1102	W1094-R1098 PolarHBondContact O-N 2.72Å; P1095-R1098 HydrophobicContact CB-CB 4.13Å; P1095-R1098 HydrophobicContact CB-CG 4.34Å; P1095-R1098 PolarHBondContact O-N 2.79Å; L1096-R1098 PolarHBondContact O-N 3.26Å; R1098-L1100 VanDerWaalsContact C-N 3.32Å; R1098-N1101 CarbonylContact O-C 3.53Å; R1098-N1101 PolarHBondContact O-N 3.12Å; R1098-N1101 VanDerWaalsContact O-N 3.14Å; R1098-D1102 WeakPolarHBondContact O-CB 3.33Å; R1098-D1102 PolarHBondContact O-N 3.41Å
1099	R	35.2	Very low	39.5	Very low	169 Å²	169	93.4 Å²	93.4	64%	0.638	44%	0.438	S	S	*	.	H	α-helix	trans	-68.8	-36.3	179.5	-172.2	170.4	172.5	175.6	-6.6	110.4	P1095 L1096 L1103	P1095-R1099 VanDerWaalsContact O-CB 3.3Å; P1095-R1099 WeakPolarHBondContact O-CB 3.32Å; P1095-R1099 PolarHBondContact O-N 3.38Å; L1096-R1099 PolarHBondContact O-N 3.08Å; R1099-L1103 WeakPolarHBondContact O-CG 3.48Å; R1099-L1103 PolarHBondContact O-N 3.19Å
1100	L	35.1	Very low	39.6	Very low	97 Å²	97	93.1 Å²	93.1	51%	0.508	44%	0.435	S	S	.	.	H	α-helix	trans	-62.7	-48.2	163.9	179.9	61.2	0	0	0	111.4	L1096 R1098 D1102 L1103 M1104	L1096-L1100 WeakPolarHBondContact O-CB 3.07Å; L1096-L1100 PolarHBondContact O-N 3.19Å; R1098-L1100 VanDerWaalsContact C-N 3.32Å; L1100-D1102 VanDerWaalsContact C-N 3.29Å; L1100-D1102 PolarHBondContact O-N 3.08Å; L1100-L1103 CarbonylContact O-C 3.57Å; L1100-L1103 WeakPolarHBondContact O-CB 3.39Å; L1100-L1103 PolarHBondContact O-N 3.48Å; L1100-L1103 VanDerWaalsContact O-N 3.11Å; L1100-M1104 HydrophobicContact CD1-CG 4.23Å; L1100-M1104 HydrophobicContact CG-CG 4.37Å; L1100-M1104 WeakPolarHBondContact O-CB 3.4Å; L1100-M1104 VanDerWaalsContact O-CG 3.27Å; L1100-M1104 WeakPolarHBondContact O-CG 3.31Å; L1100-M1104 PolarHBondContact O-N 3.37Å
1101	N	37.3	Very low	39.8	Very low	79 Å²	79	89.9 Å²	89.9	42%	0.422	43%	0.428	S	S	.	.	H	α-helix	trans	-62.2	-32.3	179.2	-162.1	-91.6	0	0	0	113	G1097 R1098 K1105	G1097-N1101 WeakPolarHBondContact O-CB 3.31Å; G1097-N1101 PolarHBondContact O-N 3.1Å; R1098-N1101 CarbonylContact O-C 3.53Å; R1098-N1101 PolarHBondContact O-N 3.12Å; R1098-N1101 VanDerWaalsContact O-N 3.14Å; N1101-K1105 WeakPolarHBondContact O-CB 3.45Å; N1101-K1105 WeakPolarHBondContact O-CD 3.41Å; N1101-K1105 VanDerWaalsContact O-CG 3.26Å; N1101-K1105 WeakPolarHBondContact O-CG 3.08Å; N1101-K1105 PolarHBondContact O-N 3.41Å; N1101-K1105 WeakPolarHBondContact OD1-CE 3.42Å; N1101-K1105 PolarHBondContact OD1-NZ 2.74Å
1102	D	39.5	Very low	40.2	Very low	60 Å²	60	92.4 Å²	92.4	32%	0.321	44%	0.441	S	S	.	.	H	α-helix	trans	-78.1	-29.5	174.3	-86.7	-0.9	0	0	0	112.9	R1098 L1100 R1106	R1098-D1102 WeakPolarHBondContact O-CB 3.33Å; R1098-D1102 PolarHBondContact O-N 3.41Å; L1100-D1102 VanDerWaalsContact C-N 3.29Å; L1100-D1102 PolarHBondContact O-N 3.08Å; D1102-R1106 VanDerWaalsContact O-CG 3.24Å; D1102-R1106 WeakPolarHBondContact O-CG 3.37Å; D1102-R1106 PolarHBondContact O-N 3.23Å; D1102-R1106 VanDerWaalsContact O-N 3.17Å; D1102-R1106 PolarHBondContact O-NE 2.88Å
1103	L	39.6	Very low	40.2	Very low	84 Å²	84	90.7 Å²	90.7	44%	0.44	44%	0.435	S	S	.	.	H	α-helix	trans	-69.4	-44.8	166.9	-81.6	164.6	0	0	0	110.6	R1099 L1100 K1105 R1106 K1107	R1099-L1103 WeakPolarHBondContact O-CG 3.48Å; R1099-L1103 PolarHBondContact O-N 3.19Å; L1100-L1103 CarbonylContact O-C 3.57Å; L1100-L1103 WeakPolarHBondContact O-CB 3.39Å; L1100-L1103 PolarHBondContact O-N 3.48Å; L1100-L1103 VanDerWaalsContact O-N 3.11Å; L1103-K1105 PolarHBondContact O-N 2.77Å; L1103-R1106 WeakPolarHBondContact O-CA 3.36Å; L1103-R1106 WeakPolarHBondContact O-CB 3.32Å; L1103-R1106 PolarHBondContact O-N 3.11Å; L1103-K1107 PolarHBondContact O-N 2.94Å
1104	M	36.4	Very low	40.6	Very low	97 Å²	97	90.4 Å²	90.4	48%	0.478	43%	0.431	S	S	.	.	H	α-helix	trans	-59.6	-46.3	173.5	-69	-65.7	-82.8	0	0	110.4	L1100 R1106 K1107 E1108	L1100-M1104 HydrophobicContact CD1-CG 4.23Å; L1100-M1104 HydrophobicContact CG-CG 4.37Å; L1100-M1104 WeakPolarHBondContact O-CB 3.4Å; L1100-M1104 VanDerWaalsContact O-CG 3.27Å; L1100-M1104 WeakPolarHBondContact O-CG 3.31Å; L1100-M1104 PolarHBondContact O-N 3.37Å; M1104-R1106 PolarHBondContact O-N 3.31Å; M1104-K1107 CarbonylContact O-C 3.57Å; M1104-K1107 PolarHBondContact O-N 3.25Å; M1104-K1107 VanDerWaalsContact O-N 3.11Å; M1104-E1108 WeakPolarHBondContact O-CB 3.47Å; M1104-E1108 PolarHBondContact O-N 3.31Å
1105	K	44.2	Very low	41.2	Very low	90 Å²	90	86.5 Å²	86.5	39%	0.391	42%	0.422	S	S	.	.	H	α-helix	trans	-62.5	-22.3	172.5	-79.6	163.3	174.5	153.6	0	114.7	N1101 L1103 K1109	N1101-K1105 WeakPolarHBondContact O-CB 3.45Å; N1101-K1105 WeakPolarHBondContact O-CD 3.41Å; N1101-K1105 VanDerWaalsContact O-CG 3.26Å; N1101-K1105 WeakPolarHBondContact O-CG 3.08Å; N1101-K1105 PolarHBondContact O-N 3.41Å; N1101-K1105 WeakPolarHBondContact OD1-CE 3.42Å; N1101-K1105 PolarHBondContact OD1-NZ 2.74Å; L1103-K1105 PolarHBondContact O-N 2.77Å; K1105-K1109 WeakPolarHBondContact O-CB 3.45Å; K1105-K1109 WeakPolarHBondContact O-CD 3.3Å; K1105-K1109 WeakPolarHBondContact O-CG 3.45Å; K1105-K1109 PolarHBondContact O-N 3.47Å
1106	R	42.3	Very low	42.6	Very low	128 Å²	128	89 Å²	89	48%	0.483	44%	0.437	S	S	.	.	H	α-helix	trans	-78.9	-45.3	170.3	-71.4	167.1	-153	-174.5	6.8	110.4	D1102 L1103 M1104 K1109 I1110	D1102-R1106 VanDerWaalsContact O-CG 3.24Å; D1102-R1106 WeakPolarHBondContact O-CG 3.37Å; D1102-R1106 PolarHBondContact O-N 3.23Å; D1102-R1106 VanDerWaalsContact O-N 3.17Å; D1102-R1106 PolarHBondContact O-NE 2.88Å; L1103-R1106 WeakPolarHBondContact O-CA 3.36Å; L1103-R1106 WeakPolarHBondContact O-CB 3.32Å; L1103-R1106 PolarHBondContact O-N 3.11Å; M1104-R1106 PolarHBondContact O-N 3.31Å; R1106-K1109 PolarHBondContact O-N 3.48Å; R1106-K1109 VanDerWaalsContact O-N 3.14Å; R1106-I1110 WeakPolarHBondContact O-CG1 3.44Å; R1106-I1110 PolarHBondContact O-N 3.17Å
1107	K	44.4	Very low	43.4	Very low	125 Å²	125	85.4 Å²	85.4	54%	0.543	43%	0.425	S	S	.	.	H	α-helix	trans	-62.4	-42.6	175.4	-165.1	174.5	-176.9	178.7	0	111.5	L1103 M1104 K1109 I1110 L1111	L1103-K1107 PolarHBondContact O-N 2.94Å; M1104-K1107 CarbonylContact O-C 3.57Å; M1104-K1107 PolarHBondContact O-N 3.25Å; M1104-K1107 VanDerWaalsContact O-N 3.11Å; K1107-K1109 VanDerWaalsContact C-N 3.33Å; K1107-K1109 PolarHBondContact O-N 3.45Å; K1107-I1110 PolarHBondContact O-N 3.43Å; K1107-L1111 HydrophobicContact CG-CD1 4.19Å; K1107-L1111 WeakPolarHBondContact O-CB 3.47Å; K1107-L1111 WeakPolarHBondContact O-CG 3.32Å; K1107-L1111 PolarHBondContact O-N 3.1Å
1108	E	48.9	Very low	44	Very low	97 Å²	97	88.4 Å²	88.4	45%	0.453	43%	0.431	S	S	.	.	H	α-helix	trans	-60	-37.2	171.1	-170.6	-143.6	144.9	0	0	111.8	M1104 N1112	M1104-E1108 WeakPolarHBondContact O-CB 3.47Å; M1104-E1108 PolarHBondContact O-N 3.31Å; E1108-N1112 WeakPolarHBondContact O-CB 3.28Å; E1108-N1112 VanDerWaalsContact O-CG 3.31Å; E1108-N1112 PolarHBondContact O-N 2.99Å; E1108-N1112 PolarHBondContact O-ND2 3.47Å; E1108-N1112 PolarHBondContact OE1-ND2 3.4Å
1109	K	47.4	Very low	44.9	Very low	132 Å²	132	91.2 Å²	91.2	57%	0.574	45%	0.445	S	S	*	.	H	α-helix	trans	-74.1	-31.9	173.8	-80.2	173.3	-177.3	179.5	0	113.1	K1105 R1106 K1107 S1113	K1105-K1109 WeakPolarHBondContact O-CB 3.45Å; K1105-K1109 WeakPolarHBondContact O-CD 3.3Å; K1105-K1109 WeakPolarHBondContact O-CG 3.45Å; K1105-K1109 PolarHBondContact O-N 3.47Å; R1106-K1109 PolarHBondContact O-N 3.48Å; R1106-K1109 VanDerWaalsContact O-N 3.14Å; K1107-K1109 VanDerWaalsContact C-N 3.33Å; K1107-K1109 PolarHBondContact O-N 3.45Å; K1109-S1113 WeakPolarHBondContact O-CB 3.37Å; K1109-S1113 PolarHBondContact O-N 2.69Å; K1109-S1113 PolarHBondContact O-OG 3.39Å
1110	I	54.2	Low	45.4	Very low	29 Å²	29	90.2 Å²	90.2	15%	0.149	44%	0.442	C	S	.	.	H	α-helix	trans	-67.6	-54.5	171.4	-67.2	164	0	0	0	108.8	R1106 K1107 N1112 S1113 E1114	R1106-I1110 WeakPolarHBondContact O-CG1 3.44Å; R1106-I1110 PolarHBondContact O-N 3.17Å; K1107-I1110 PolarHBondContact O-N 3.43Å; I1110-N1112 VanDerWaalsContact C-N 3.35Å; I1110-N1112 PolarHBondContact O-N 3.05Å; I1110-S1113 CarbonylContact O-C 3.36Å; I1110-S1113 WeakPolarHBondContact O-CA 3.47Å; I1110-S1113 WeakPolarHBondContact O-CB 2.97Å; I1110-S1113 PolarHBondContact O-N 3.17Å; I1110-S1113 PolarHBondContact O-OG 3.4Å; I1110-E1114 HydrophobicContact CG2-CG 4.5Å; I1110-E1114 WeakPolarHBondContact O-CG 3.23Å; I1110-E1114 PolarHBondContact O-N 3.24Å
1111	L	49.5	Very low	45.8	Very low	95 Å²	95	90.2 Å²	90.2	50%	0.497	44%	0.443	S	S	.	.	H	α-helix	trans	-55.1	-43.1	174.8	-76.4	163.8	0	0	0	112.9	K1107 S1113 E1114 L1115	K1107-L1111 HydrophobicContact CG-CD1 4.19Å; K1107-L1111 WeakPolarHBondContact O-CB 3.47Å; K1107-L1111 WeakPolarHBondContact O-CG 3.32Å; K1107-L1111 PolarHBondContact O-N 3.1Å; L1111-S1113 VanDerWaalsContact C-N 3.32Å; L1111-S1113 PolarHBondContact O-N 3.34Å; L1111-E1114 WeakPolarHBondContact CA-OE2 3.43Å; L1111-E1114 PolarHBondContact O-N 3.23Å; L1111-L1115 WeakPolarHBondContact O-CB 3.1Å; L1111-L1115 PolarHBondContact O-N 3.4Å
1112	N	50.4	Low	46.3	Very low	76 Å²	76	92 Å²	92	41%	0.406	45%	0.45	S	S	.	.	H	α-helix	trans	-67.5	-31.4	174.1	-84.8	-51.9	0	0	0	112.1	E1108 I1110 T1116	E1108-N1112 WeakPolarHBondContact O-CB 3.28Å; E1108-N1112 VanDerWaalsContact O-CG 3.31Å; E1108-N1112 PolarHBondContact O-N 2.99Å; E1108-N1112 PolarHBondContact O-ND2 3.47Å; E1108-N1112 PolarHBondContact OE1-ND2 3.4Å; I1110-N1112 VanDerWaalsContact C-N 3.35Å; I1110-N1112 PolarHBondContact O-N 3.05Å; N1112-T1116 WeakPolarHBondContact O-CB 3.27Å; N1112-T1116 PolarHBondContact O-N 2.73Å; N1112-T1116 PolarHBondContact O-OG1 2.66Å
1113	S	47.5	Very low	46.6	Very low	33 Å²	33	93.4 Å²	93.4	23%	0.231	46%	0.456	C	S	.	.	H	α-helix	trans	-72.1	-36.7	173.8	78.2	0	0	0	0	112.2	K1109 I1110 L1111 T1116 A1117	K1109-S1113 WeakPolarHBondContact O-CB 3.37Å; K1109-S1113 PolarHBondContact O-N 2.69Å; K1109-S1113 PolarHBondContact O-OG 3.39Å; I1110-S1113 CarbonylContact O-C 3.36Å; I1110-S1113 WeakPolarHBondContact O-CA 3.47Å; I1110-S1113 WeakPolarHBondContact O-CB 2.97Å; I1110-S1113 PolarHBondContact O-N 3.17Å; I1110-S1113 PolarHBondContact O-OG 3.4Å; L1111-S1113 VanDerWaalsContact C-N 3.32Å; L1111-S1113 PolarHBondContact O-N 3.34Å; S1113-T1116 PolarHBondContact O-N 3.02Å; S1113-A1117 WeakPolarHBondContact O-CB 3.3Å; S1113-A1117 PolarHBondContact O-N 3.37Å
1114	E	46.9	Very low	46.4	Very low	86 Å²	86	91.8 Å²	91.8	40%	0.402	45%	0.448	S	S	.	.	H	α-helix	trans	-66.9	-46.9	172.8	-68.6	166	162.2	0	0	110.7	I1110 L1111 T1116 A1117 L1118	I1110-E1114 HydrophobicContact CG2-CG 4.5Å; I1110-E1114 WeakPolarHBondContact O-CG 3.23Å; I1110-E1114 PolarHBondContact O-N 3.24Å; L1111-E1114 WeakPolarHBondContact CA-OE2 3.43Å; L1111-E1114 PolarHBondContact O-N 3.23Å; E1114-T1116 VanDerWaalsContact C-N 3.29Å; E1114-T1116 PolarHBondContact O-N 2.92Å; E1114-A1117 WeakPolarHBondContact O-CB 3.47Å; E1114-A1117 PolarHBondContact O-N 2.53Å; E1114-A1117 VanDerWaalsContact O-N 3.17Å; E1114-L1118 WeakPolarHBondContact O-CB 3.24Å; E1114-L1118 WeakPolarHBondContact O-CG 3.36Å; E1114-L1118 PolarHBondContact O-N 3.38Å
1115	L	47.4	Very low	46.5	Very low	84 Å²	84	90.3 Å²	90.3	44%	0.44	45%	0.452	S	S	.	.	H	α-helix	trans	-69	-26.7	176.4	-168.8	135.5	0	0	0	112.5	L1111 K1119	L1111-L1115 WeakPolarHBondContact O-CB 3.1Å; L1111-L1115 PolarHBondContact O-N 3.4Å; L1115-K1119 HydrophobicContact CD2-CD 4.08Å; L1115-K1119 VanDerWaalsContact O-CB 3.29Å; L1115-K1119 WeakPolarHBondContact O-CB 3.19Å; L1115-K1119 VanDerWaalsContact O-CG 3.3Å; L1115-K1119 WeakPolarHBondContact O-CG 3.23Å; L1115-K1119 PolarHBondContact O-N 2.76Å
1116	T	58.5	Low	46.2	Very low	81 Å²	81	93.4 Å²	93.4	50%	0.497	47%	0.465	S	S	.	.	H	α-helix	trans	-74.8	-38.8	169.6	-60.1	0	0	0	0	111.2	N1112 S1113 E1114 K1119 Y1120	N1112-T1116 WeakPolarHBondContact O-CB 3.27Å; N1112-T1116 PolarHBondContact O-N 2.73Å; N1112-T1116 PolarHBondContact O-OG1 2.66Å; S1113-T1116 PolarHBondContact O-N 3.02Å; E1114-T1116 VanDerWaalsContact C-N 3.29Å; E1114-T1116 PolarHBondContact O-N 2.92Å; T1116-K1119 PolarHBondContact O-N 3.12Å; T1116-Y1120 WeakPolarHBondContact O-CB 3.14Å; T1116-Y1120 PolarHBondContact O-N 2.8Å
1117	A	47.1	Very low	45.9	Very low	47 Å²	47	92 Å²	92	39%	0.388	47%	0.466	S	S	.	.	H	α-helix	trans	-63.4	-49.9	172.8	0	0	0	0	0	110.8	S1113 E1114 K1119 Y1120 D1121	S1113-A1117 WeakPolarHBondContact O-CB 3.3Å; S1113-A1117 PolarHBondContact O-N 3.37Å; E1114-A1117 WeakPolarHBondContact O-CB 3.47Å; E1114-A1117 PolarHBondContact O-N 2.53Å; E1114-A1117 VanDerWaalsContact O-N 3.17Å; A1117-K1119 VanDerWaalsContact C-N 3.32Å; A1117-K1119 PolarHBondContact O-N 3Å; A1117-Y1120 CarbonylContact O-C 3.56Å; A1117-Y1120 WeakPolarHBondContact O-CA 3.28Å; A1117-Y1120 WeakPolarHBondContact O-CB 3.46Å; A1117-Y1120 PolarHBondContact O-N 3Å; A1117-D1121 PolarHBondContact O-N 3.47Å
1118	L	42.4	Very low	45.1	Very low	102 Å²	102	94 Å²	94	53%	0.534	47%	0.472	S	S	.	.	H	α-helix	trans	-57.1	-41.3	172.6	-72.9	168.5	0	0	0	112	E1114 D1121 M1122	E1114-L1118 WeakPolarHBondContact O-CB 3.24Å; E1114-L1118 WeakPolarHBondContact O-CG 3.36Å; E1114-L1118 PolarHBondContact O-N 3.38Å; L1118-D1121 PolarHBondContact O-N 3.17Å; L1118-M1122 WeakPolarHBondContact O-CB 3.26Å; L1118-M1122 VanDerWaalsContact O-CG 3.23Å; L1118-M1122 WeakPolarHBondContact O-CG 3.34Å; L1118-M1122 PolarHBondContact O-N 2.95Å
1119	K	49.2	Very low	44.1	Very low	124 Å²	124	96.1 Å²	96.1	54%	0.539	49%	0.486	S	S	.	.	H	α-helix	trans	-63.1	-40.6	171	-84.7	178	176.3	174.6	0	112.3	L1115 T1116 A1117 D1121 M1122 I1123	L1115-K1119 HydrophobicContact CD2-CD 4.08Å; L1115-K1119 VanDerWaalsContact O-CB 3.29Å; L1115-K1119 WeakPolarHBondContact O-CB 3.19Å; L1115-K1119 VanDerWaalsContact O-CG 3.3Å; L1115-K1119 WeakPolarHBondContact O-CG 3.23Å; L1115-K1119 PolarHBondContact O-N 2.76Å; T1116-K1119 PolarHBondContact O-N 3.12Å; A1117-K1119 VanDerWaalsContact C-N 3.32Å; A1117-K1119 PolarHBondContact O-N 3Å; K1119-D1121 VanDerWaalsContact C-N 3.33Å; K1119-M1122 PolarHBondContact O-N 3.22Å; K1119-I1123 VanDerWaalsContact O-CB 3.27Å; K1119-I1123 WeakPolarHBondContact O-CB 3.27Å; K1119-I1123 WeakPolarHBondContact O-CD1 3.3Å; K1119-I1123 WeakPolarHBondContact O-CG1 3.38Å; K1119-I1123 PolarHBondContact O-N 3.39Å
1120	Y	45.1	Very low	43.1	Very low	148 Å²	148	100.2 Å²	100.2	58%	0.58	50%	0.5	S	S	*	.	H	α-helix	trans	-66.6	-36.7	177.8	-141.4	-82.4	0	0	0	111.5	T1116 A1117 I1123 N1124	T1116-Y1120 WeakPolarHBondContact O-CB 3.14Å; T1116-Y1120 PolarHBondContact O-N 2.8Å; A1117-Y1120 CarbonylContact O-C 3.56Å; A1117-Y1120 WeakPolarHBondContact O-CA 3.28Å; A1117-Y1120 WeakPolarHBondContact O-CB 3.46Å; A1117-Y1120 PolarHBondContact O-N 3Å; Y1120-I1123 PolarHBondContact O-N 2.84Å; Y1120-N1124 WeakPolarHBondContact O-CB 3.49Å; Y1120-N1124 PolarHBondContact O-N 3.03Å; Y1120-N1124 PolarHBondContact O-ND2 2.94Å
1121	D	44	Very low	41.7	Very low	98 Å²	98	104.4 Å²	104.4	52%	0.524	53%	0.528	S	S	.	.	H	α-helix	trans	-77.1	-34.3	177	-69.2	-31.8	0	0	0	112.3	A1117 L1118 K1119 N1124 A1125	A1117-D1121 PolarHBondContact O-N 3.47Å; L1118-D1121 PolarHBondContact O-N 3.17Å; K1119-D1121 VanDerWaalsContact C-N 3.33Å; D1121-N1124 PolarHBondContact O-N 3.31Å; D1121-A1125 VanDerWaalsContact O-CB 3.24Å; D1121-A1125 WeakPolarHBondContact O-CB 3.43Å; D1121-A1125 PolarHBondContact O-N 3.36Å
1122	M	48.3	Very low	40.4	Very low	116 Å²	116	105.3 Å²	105.3	57%	0.571	54%	0.543	S	S	*	.	H	α-helix	trans	-64.8	-37.5	166.2	-74.1	-178.7	83.1	0	0	112	L1118 K1119 K1126	L1118-M1122 WeakPolarHBondContact O-CB 3.26Å; L1118-M1122 VanDerWaalsContact O-CG 3.23Å; L1118-M1122 WeakPolarHBondContact O-CG 3.34Å; L1118-M1122 PolarHBondContact O-N 2.95Å; K1119-M1122 PolarHBondContact O-N 3.22Å; M1122-K1126 WeakPolarHBondContact O-CB 3.41Å; M1122-K1126 VanDerWaalsContact O-CG 3.3Å; M1122-K1126 WeakPolarHBondContact O-CG 3.4Å; M1122-K1126 PolarHBondContact O-N 3.17Å
1123	I	45.5	Very low	39	Very low	90 Å²	90	111.5 Å²	111.5	46%	0.462	57%	0.566	S	S	.	*	H	α-helix	trans	-69.5	-42.8	175.1	-74.5	164.3	0	0	0	110	K1119 Y1120 K1126 L1127	K1119-I1123 VanDerWaalsContact O-CB 3.27Å; K1119-I1123 WeakPolarHBondContact O-CB 3.27Å; K1119-I1123 WeakPolarHBondContact O-CD1 3.3Å; K1119-I1123 WeakPolarHBondContact O-CG1 3.38Å; K1119-I1123 PolarHBondContact O-N 3.39Å; Y1120-I1123 PolarHBondContact O-N 2.84Å; I1123-K1126 PolarHBondContact O-N 2.71Å; I1123-L1127 HydrophobicContact CG2-CD1 3.7Å; I1123-L1127 HydrophobicContact CG2-CG 4.33Å; I1123-L1127 VanDerWaalsContact O-CB 3.3Å; I1123-L1127 WeakPolarHBondContact O-CB 3.25Å; I1123-L1127 VanDerWaalsContact O-CG 3.25Å; I1123-L1127 WeakPolarHBondContact O-CG 3.29Å; I1123-L1127 PolarHBondContact O-N 3.33Å
1124	N	35.7	Very low	37.7	Very low	49 Å²	49	118.6 Å²	118.6	26%	0.262	60%	0.595	S	S	.	*	H	α-helix	trans	-60.5	-46.6	172.3	-75.1	-32.8	0	0	0	111.2	Y1120 D1121 K1126 L1127 Y1128	Y1120-N1124 WeakPolarHBondContact O-CB 3.49Å; Y1120-N1124 PolarHBondContact O-N 3.03Å; Y1120-N1124 PolarHBondContact O-ND2 2.94Å; D1121-N1124 PolarHBondContact O-N 3.31Å; N1124-K1126 VanDerWaalsContact C-N 3.32Å; N1124-K1126 PolarHBondContact O-N 2.8Å; N1124-L1127 PolarHBondContact O-N 3.27Å; N1124-L1127 VanDerWaalsContact O-N 3.16Å; N1124-Y1128 WeakPolarHBondContact O-CB 3.2Å; N1124-Y1128 WeakPolarHBondContact O-CD2 3.42Å; N1124-Y1128 PolarHBondContact O-N 2.94Å
1125	A	38.5	Very low	36.5	Very low	67 Å²	67	122.7 Å²	122.7	55%	0.554	62%	0.618	S	S	*	*	H	α-helix	trans	-60.7	-39.8	177.2	0	0	0	0	0	112	D1121	D1121-A1125 VanDerWaalsContact O-CB 3.24Å; D1121-A1125 WeakPolarHBondContact O-CB 3.43Å; D1121-A1125 PolarHBondContact O-N 3.36Å
1126	K	36.9	Very low	35.2	Very low	155 Å²	155	123.3 Å²	123.3	67%	0.674	63%	0.629	S	S	*	*	H	α-helix	trans	-71.5	-31.5	174.1	-73.9	179.9	177.4	-171.6	0	113.5	M1122 I1123 N1124	M1122-K1126 WeakPolarHBondContact O-CB 3.41Å; M1122-K1126 VanDerWaalsContact O-CG 3.3Å; M1122-K1126 WeakPolarHBondContact O-CG 3.4Å; M1122-K1126 PolarHBondContact O-N 3.17Å; I1123-K1126 PolarHBondContact O-N 2.71Å; N1124-K1126 VanDerWaalsContact C-N 3.32Å; N1124-K1126 PolarHBondContact O-N 2.8Å
1127	L	35.8	Very low	33.4	Very low	97 Å²	97	124 Å²	124	51%	0.508	64%	0.637	S	S	.	*	H	α-helix	trans	-78	-31.3	177.1	-76.9	170	0	0	0	113	I1123 N1124 N1129	I1123-L1127 HydrophobicContact CG2-CD1 3.7Å; I1123-L1127 HydrophobicContact CG2-CG 4.33Å; I1123-L1127 VanDerWaalsContact O-CB 3.3Å; I1123-L1127 WeakPolarHBondContact O-CB 3.25Å; I1123-L1127 VanDerWaalsContact O-CG 3.25Å; I1123-L1127 WeakPolarHBondContact O-CG 3.29Å; I1123-L1127 PolarHBondContact O-N 3.33Å; N1124-L1127 PolarHBondContact O-N 3.27Å; N1124-L1127 VanDerWaalsContact O-N 3.16Å; L1127-N1129 VanDerWaalsContact C-N 3.32Å; L1127-N1129 PolarHBondContact O-N 3.43Å
1128	Y	28.2	Very low	32.1	Very low	169 Å²	169	129.1 Å²	129.1	66%	0.663	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.4	41.9	179	-72.5	-74.7	0	0	0	113	N1124 Y1130	N1124-Y1128 WeakPolarHBondContact O-CB 3.2Å; N1124-Y1128 WeakPolarHBondContact O-CD2 3.42Å; N1124-Y1128 PolarHBondContact O-N 2.94Å; Y1128-Y1130 VanDerWaalsContact C-N 3.27Å; Y1128-Y1130 PolarHBondContact O-N 3.11Å
1129	N	27.9	Very low	31	Very low	141 Å²	141	133.6 Å²	133.6	75%	0.754	68%	0.676	S	S	*	*			trans	-64.5	88	158.5	-92.8	-23.5	0	0	0	109.7	L1127	L1127-N1129 VanDerWaalsContact C-N 3.32Å; L1127-N1129 PolarHBondContact O-N 3.43Å
1130	Y	26.5	Very low	29.7	Very low	218 Å²	218	133.2 Å²	133.2	86%	0.855	69%	0.689	S	S	*	*			trans	-121.7	120.5	166.8	-130	-90.1	0	0	0	109.9	Y1128	Y1128-Y1130 VanDerWaalsContact C-N 3.27Å; Y1128-Y1130 PolarHBondContact O-N 3.11Å
1131	P	25.3	Very low	28.6	Very low	116 Å²	116	131.2 Å²	131.2	75%	0.753	70%	0.697	S	S	*	*			trans	-72.5	151.9	-171.2	29.1	-35.3	0	0	0	112.5
1132	S	21.3	Very low	27.6	Very low	114 Å²	114	133.6 Å²	133.6	80%	0.797	71%	0.705	S	S	*	*			trans	-54.1	132.9	-172.2	-47.3	0	0	0	0	114.5
1133	K	21.1	Very low	26.7	Very low	207 Å²	207	133.2 Å²	133.2	90%	0.9	71%	0.711	S	S	*	*			trans	-151.7	132.4	141.6	-116.2	158.7	-171.2	172.2	0	111.7
1134	H	21.3	Very low	25.6	Very low	182 Å²	182	136.7 Å²	136.7	84%	0.843	72%	0.723	S	S	*	*			trans	-62.2	146.5	-178.5	-59.8	-108.6	0	0	0	111.9
1135	I	20.8	Very low	25.1	Very low	172 Å²	172	140.4 Å²	140.4	88%	0.882	75%	0.747	S	S	*	*			trans	-149.3	154.5	132.2	-105.5	154.5	0	0	0	108.2
1136	S	19.6	Very low	24.3	Very low	97 Å²	97	146.5 Å²	146.5	68%	0.678	76%	0.761	S	S	*	*			trans	-90.2	174.7	-164.5	56.5	0	0	0	0	114.6
1137	S	20.6	Very low	23.5	Very low	95 Å²	95	144 Å²	144	66%	0.664	76%	0.762	S	S	*	*			trans	64	117	149	52	0	0	0	0	119
1138	N	19.7	Very low	22.8	Very low	155 Å²	155	146.6 Å²	146.6	83%	0.829	78%	0.777	S	S	*	*			trans	49	104.3	146.2	-56.7	-1.5	0	0	0	118.4
1139	E	20.2	Very low	22.4	Very low	195 Å²	195	146.6 Å²	146.6	91%	0.911	79%	0.787	S	S	*	*				-165.3	172.7	111	-109.8	172.4	-160.6	0	0	112.3
1140	S	22.1	Very low	22.1	Very low	116 Å²	116	148.9 Å²	148.9	81%	0.811	79%	0.793	S	S	*	*			trans	-72.5	121.6	-167.7	53.9	0	0	0	0	115
1141	S	22.4	Very low	21.8	Very low	107 Å²	107	145.5 Å²	145.5	75%	0.748	79%	0.787	S	S	*	*			trans	-156.4	123.3	155	62.3	0	0	0	0	114.8
1142	H	23.2	Very low	21.6	Very low	148 Å²	148	150.3 Å²	150.3	69%	0.685	80%	0.797	S	S	*	*			trans	55.3	119.6	159.1	-100	-84.3	0	0	0	121.5	F1144	H1142-F1144 PolarHBondContact O-N 3.16Å; H1142-F1144 VanDerWaalsContact O-N 3.16Å
1143	P	27.9	Very low	21.6	Very low	107 Å²	107	149.8 Å²	149.8	70%	0.695	79%	0.793	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.2	16.9	176.7	35.8	-37.8	0	0	0	114.9
1144	F	22.7	Very low	21.5	Very low	164 Å²	164	145.5 Å²	145.5	72%	0.719	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-17.6	-178.8	-101.1	-82.4	0	0	0	114.3	H1142	H1142-F1144 PolarHBondContact O-N 3.16Å; H1142-F1144 VanDerWaalsContact O-N 3.16Å
1145	T	25.8	Very low	21.6	Very low	126 Å²	126	142.9 Å²	142.9	77%	0.773	79%	0.788	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	16.1	177.7	41.4	0	0	0	0	113.6
1146	K	21.4	Very low	21.6	Very low	195 Å²	195	140.9 Å²	140.9	85%	0.848	79%	0.785	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.2	5	170.9	-144.8	-174.4	178	-174.3	0	114.4
1147	C	19.4	Very low	21.6	Very low	102 Å²	102	144 Å²	144	69%	0.689	79%	0.792	S	S	*	*			trans	-98.9	57.4	167.4	-65.8	0	0	0	0	110.2
1148	N	21.1	Very low	21.6	Very low	152 Å²	152	148.7 Å²	148.7	81%	0.813	80%	0.797	S	S	*	*			trans	-73.3	138.2	162	-99.7	14.2	0	0	0	108.7	E1150	N1148-E1150 PolarHBondContact O-N 3.48Å; N1148-E1150 VanDerWaalsContact O-N 3.08Å
1149	L	21	Very low	21.7	Very low	169 Å²	169	147.3 Å²	147.3	89%	0.885	79%	0.79	S	S	*	*			trans	-77	89.9	-178.6	-71.9	152.2	0	0	0	110.5
1150	E	20.8	Very low	21.6	Very low	189 Å²	189	143.1 Å²	143.1	88%	0.883	78%	0.782	S	S	*	*			trans	-121.3	150.5	153.6	-76.5	-162.4	148.4	0	0	111.1	N1148	N1148-E1150 PolarHBondContact O-N 3.48Å; N1148-E1150 VanDerWaalsContact O-N 3.08Å
1151	M	20.9	Very low	21.6	Very low	148 Å²	148	146.7 Å²	146.7	73%	0.729	78%	0.783	S	S	*	*			trans	-53.2	148.3	-167.3	-134.6	76.8	68.9	0	0	113.8	S1153	M1151-S1153 PolarHBondContact O-N 2.8Å
1152	F	20.8	Very low	21.6	Very low	216 Å²	216	147.7 Å²	147.7	95%	0.947	78%	0.779	S	S	*	*			trans	-58.8	103.1	148.7	-82.5	-89.2	0	0	0	108.6
1153	S	20.1	Very low	21.4	Very low	103 Å²	103	146.3 Å²	146.3	72%	0.72	79%	0.786	S	S	*	*			trans	-93.8	129.6	159.8	46.8	0	0	0	0	108.3	M1151 P1155	M1151-S1153 PolarHBondContact O-N 2.8Å; S1153-P1155 WeakPolarHBondContact O-CD 3.39Å
1154	S	19.7	Very low	21.1	Very low	117 Å²	117	151.1 Å²	151.1	82%	0.818	79%	0.79	S	S	*	*			trans	-69.3	126.8	-168.6	-38.2	0	0	0	0	112.4
1155	P	23.7	Very low	21	Very low	127 Å²	127	150.8 Å²	150.8	83%	0.825	80%	0.795	S	S	*	*			trans	-99.8	93.7	173.5	35.3	-28.7	0	0	0	111.7	S1153	S1153-P1155 WeakPolarHBondContact O-CD 3.39Å
1156	T	21.7	Very low	20.8	Very low	131 Å²	131	153 Å²	153	80%	0.804	80%	0.801	S	S	*	*			trans	-117.1	113.2	150.4	36.9	0	0	0	0	108.7
1157	L	19.4	Very low	21.3	Very low	161 Å²	161	147.7 Å²	147.7	84%	0.843	79%	0.787	S	S	*	*	S	Bend	trans	76.3	122.4	180	-63.6	164.9	0	0	0	118.9
1158	Y	20.1	Very low	21.3	Very low	195 Å²	195	152 Å²	152	77%	0.765	79%	0.79	S	S	*	*			trans	98.4	100.9	131.6	-106.3	-124.4	0	0	0	123.2
1159	N	20.7	Very low	21.2	Very low	125 Å²	125	152.9 Å²	152.9	67%	0.668	79%	0.787	S	S	*	*				71.2	134.2	125.4	-79.3	8.1	0	0	0	123.2
1160	S	19.7	Very low	21.1	Very low	107 Å²	107	152.9 Å²	152.9	75%	0.748	79%	0.787	S	S	*	*			trans	-74.9	131.4	168.1	45.4	0	0	0	0	113.2
1161	K	21.8	Very low	21	Very low	191 Å²	191	148.8 Å²	148.8	83%	0.83	78%	0.779	S	S	*	*			trans	-174.3	144.3	138.3	-105.3	159.1	-174	175.8	0	110.7
1162	L	22.4	Very low	20.9	Very low	128 Å²	128	148.3 Å²	148.3	67%	0.67	78%	0.779	S	S	*	*			trans	62.9	126.1	-173.6	-67.5	74.3	0	0	0	113.7	R1164	L1162-R1164 HydrophobicContact CB-CB 4.42Å; L1162-R1164 HydrophobicContact CD2-CB 3.95Å; L1162-R1164 HydrophobicContact CG-CB 4.02Å
1163	S	19	Very low	20.8	Very low	119 Å²	119	144.6 Å²	144.6	83%	0.832	77%	0.769	S	S	*	*			cis	60	42.5	-15.8	65.3	0	0	0	0	118.6
1164	R	20.4	Very low	20.7	Very low	209 Å²	209	145.4 Å²	145.4	79%	0.789	77%	0.766	S	S	*	*			trans	-155.6	145.5	155.9	-103.7	158	-152.7	-157.7	3.2	110.2	L1162	L1162-R1164 HydrophobicContact CB-CB 4.42Å; L1162-R1164 HydrophobicContact CD2-CB 3.95Å; L1162-R1164 HydrophobicContact CG-CB 4.02Å
1165	L	20.7	Very low	20.8	Very low	156 Å²	156	145.5 Å²	145.5	82%	0.817	76%	0.757	S	S	*	*			trans	66.5	89.1	168.6	-60.7	173.2	0	0	0	117.8
1166	L	22.4	Very low	20.7	Very low	172 Å²	172	146 Å²	146	90%	0.901	75%	0.753	S	S	*	*				-58.6	127.3	122.9	-165.8	100.9	0	0	0	106.7
1167	P	32.4	Very low	20.6	Very low	84 Å²	84	147 Å²	147	55%	0.545	75%	0.754	S	S	.	*				-158.9	177.2	96	43	-24	0	0	0	117.8
1168	Y	18.3	Very low	20.7	Very low	193 Å²	193	147.3 Å²	147.3	76%	0.757	76%	0.756	S	S	*	*			trans	78	128.4	152.2	-83.2	-66.1	0	0	0	122.4
1169	F	19.4	Very low	20.9	Very low	171 Å²	171	143.7 Å²	143.7	75%	0.75	76%	0.759	S	S	*	*			trans	64	137.2	167.4	-57	-64	0	0	0	117.1
1170	L	18.3	Very low	20.9	Very low	168 Å²	168	146.9 Å²	146.9	88%	0.88	77%	0.767	S	S	*	*			cis	61.8	68.2	11	-79.5	179.4	0	0	0	116.6
1171	S	19.4	Very low	21	Very low	103 Å²	103	152.6 Å²	152.6	72%	0.72	77%	0.772	S	S	*	*				-164.5	136.7	122.7	59.9	0	0	0	0	111.5
1172	D	19	Very low	21.1	Very low	138 Å²	138	153 Å²	153	74%	0.738	77%	0.774	S	S	*	*			trans	29.1	131.1	131.2	-58.8	1.9	0	0	0	120.9
1173	N	18.4	Very low	21.2	Very low	138 Å²	138	152 Å²	152	74%	0.738	77%	0.77	S	S	*	*			trans	86.3	135.7	133.4	-69.7	-6	0	0	0	121.9
1174	N	18.7	Very low	21.4	Very low	120 Å²	120	152 Å²	152	64%	0.642	76%	0.76	S	S	*	*			trans	71.1	101.8	141	-72.5	56.6	0	0	0	120.8
1175	D	20.7	Very low	21.6	Very low	120 Å²	120	150.1 Å²	150.1	64%	0.642	76%	0.758	S	S	*	*				88.8	149.5	119	-54	-19.5	0	0	0	120.7
1176	N	21.1	Very low	21.7	Very low	138 Å²	138	147 Å²	147	74%	0.738	76%	0.755	S	S	*	*			trans	80.8	105.5	159.2	-54.2	-50.7	0	0	0	118.8
1177	N	20.9	Very low	21.8	Very low	152 Å²	152	144.1 Å²	144.1	81%	0.813	74%	0.739	S	S	*	*			trans	91.9	141.8	148	-52.7	-31.2	0	0	0	119.8
1178	D	21.3	Very low	21.4	Very low	167 Å²	167	146.1 Å²	146.1	89%	0.893	75%	0.745	S	S	*	*			trans	55	79	165.1	-67.7	-14.5	0	0	0	120.3
1179	S	24.8	Very low	21.5	Very low	119 Å²	119	139.2 Å²	139.2	83%	0.832	73%	0.733	S	S	*	*			trans	-138.5	29.2	157.1	83	0	0	0	0	115.5
1180	F	20.8	Very low	21.7	Very low	192 Å²	192	137.5 Å²	137.5	84%	0.842	73%	0.731	S	S	*	*			trans	-118.6	46.9	-178.1	-113	-74.3	0	0	0	114.5
1181	R	20.4	Very low	22.1	Very low	226 Å²	226	136 Å²	136	85%	0.853	72%	0.722	S	S	*	*			trans	-155.9	84.4	170.4	-117.4	172.3	-171.1	-130.6	-4.4	114.2
1182	K	24.3	Very low	22.3	Very low	200 Å²	200	138.7 Å²	138.7	87%	0.87	73%	0.727	S	S	*	*			trans	-177.1	105.8	155.6	-102.8	151.5	-173.8	173.5	0	110.7
1183	N	25	Very low	22.6	Very low	107 Å²	107	135.9 Å²	135.9	57%	0.572	72%	0.718	S	S	*	*			trans	154.4	71.6	146.6	-79.7	-11.5	0	0	0	110.9	F1185	N1183-F1185 HydrophobicContact CB-CD2 4.12Å; N1183-F1185 HydrophobicContact CB-CE2 3.93Å; N1183-F1185 PolarHBondContact O-N 2.97Å; N1183-F1185 VanDerWaalsContact O-N 3.11Å
1184	N	22.1	Very low	23	Very low	119 Å²	119	137.1 Å²	137.1	64%	0.636	72%	0.719	S	S	*	*			trans	-66.7	104.5	160.7	-72.3	16.6	0	0	0	108	S1682	N1184-S1682 WeakPolarHBondContact ND2-CB 3.33Å; N1184-S1682 PolarHBondContact ND2-OG 3.32Å; N1184-S1682 VanDerWaalsContact ND2-OG 3.08Å; N1184-S1682 PolarHBondContact OD1-OG 3.09Å
1185	F	25.4	Very low	23.7	Very low	170 Å²	170	136.9 Å²	136.9	75%	0.746	72%	0.723	S	S	*	*			trans	-94	119.7	162.5	-79.8	-83.7	0	0	0	108.2	N1183 I1187	N1183-F1185 HydrophobicContact CB-CD2 4.12Å; N1183-F1185 HydrophobicContact CB-CE2 3.93Å; N1183-F1185 PolarHBondContact O-N 2.97Å; N1183-F1185 VanDerWaalsContact O-N 3.11Å; F1185-I1187 PolarHBondContact O-N 2.74Å
1186	A	23.1	Very low	24.3	Very low	90 Å²	90	135.3 Å²	135.3	74%	0.744	71%	0.714	S	S	*	*			trans	-63.8	117.8	179.7	0	0	0	0	0	110.5
1187	I	25	Very low	25.3	Very low	112 Å²	112	132 Å²	132	57%	0.574	70%	0.698	S	S	*	*	S	Bend	trans	-79.9	-25.2	-173.3	-70.3	176.4	0	0	0	111.9	F1185 G1189 L1190	F1185-I1187 PolarHBondContact O-N 2.74Å; I1187-G1189 PolarHBondContact O-N 3.46Å; I1187-L1190 WeakPolarHBondContact O-CB 3.4Å; I1187-L1190 PolarHBondContact O-N 2.9Å
1188	D	22.7	Very low	26	Very low	126 Å²	126	129.9 Å²	129.9	67%	0.674	70%	0.696	S	S	*	*	G	3₁₀ helix	trans	-61.6	-22.2	-172	-52	-48.2	0	0	0	114.4	L1190	D1188-L1190 VanDerWaalsContact C-N 3.29Å; D1188-L1190 PolarHBondContact O-N 2.96Å
1189	G	21.1	Very low	26.9	Very low	48 Å²	48	125.1 Å²	125.1	50%	0.495	68%	0.676	S	S	.	*	G	3₁₀ helix	trans	-65.4	-29	173.2	0	0	0	0	0	113.9	I1187 I1191 S1193	I1187-G1189 PolarHBondContact O-N 3.46Å; G1189-I1191 PolarHBondContact O-N 3.4Å; G1189-S1193 WeakPolarHBondContact O-CB 3.13Å; G1189-S1193 PolarHBondContact O-N 3.02Å; G1189-S1193 PolarHBondContact O-OG 2.89Å; G1189-S1193 VanDerWaalsContact O-OG 3.1Å
1190	L	23.7	Very low	27.6	Very low	134 Å²	134	122 Å²	122	70%	0.702	65%	0.65	S	S	*	*	G	3₁₀ helix	trans	-82.1	-10.4	-166.3	-90.9	165.1	0	0	0	115.7	I1187 D1188	I1187-L1190 WeakPolarHBondContact O-CB 3.4Å; I1187-L1190 PolarHBondContact O-N 2.9Å; D1188-L1190 VanDerWaalsContact C-N 3.29Å; D1188-L1190 PolarHBondContact O-N 2.96Å
1191	I	25.7	Very low	28.5	Very low	138 Å²	138	117.5 Å²	117.5	71%	0.708	63%	0.631	S	S	*	*	G	3₁₀ helix	trans	-91.1	-23.9	-174.2	-64.3	-179.3	0	0	0	112.5	G1189	G1189-I1191 PolarHBondContact O-N 3.4Å
1192	I	25.2	Very low	29.5	Very low	158 Å²	158	109.2 Å²	109.2	81%	0.81	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.3	-22.5	-173.9	-59.1	-177.9	0	0	0	113.7	E1194	I1192-E1194 PolarHBondContact O-N 3.07Å
1193	S	23.8	Very low	30.1	Very low	80 Å²	80	104.2 Å²	104.2	56%	0.559	59%	0.593	S	S	*	*			trans	-71.2	127.7	-176.8	70.1	0	0	0	0	113.4	G1189	G1189-S1193 WeakPolarHBondContact O-CB 3.13Å; G1189-S1193 PolarHBondContact O-N 3.02Å; G1189-S1193 PolarHBondContact O-OG 2.89Å; G1189-S1193 VanDerWaalsContact O-OG 3.1Å
1194	E	27.3	Very low	30.9	Very low	163 Å²	163	103.6 Å²	103.6	76%	0.762	58%	0.584	S	S	*	*			trans	-63.7	166.1	162.3	-62	-170.4	117.5	0	0	111.8	I1192	I1192-E1194 PolarHBondContact O-N 3.07Å
1195	T	33.4	Very low	31.7	Very low	116 Å²	116	101.5 Å²	101.5	71%	0.712	58%	0.575	S	S	*	*			trans	75.5	127.5	169.7	75.1	0	0	0	0	117.6
1196	L	33.5	Very low	32.3	Very low	87 Å²	87	96.2 Å²	96.2	46%	0.455	56%	0.555	S	S	.	*			trans	-58.7	143.5	143.1	-77.6	166.4	0	0	0	107.6	D1200	L1196-D1200 HydrophobicContact CB-CB 3.96Å; L1196-D1200 HydrophobicContact CD2-CB 4.02Å
1197	T	42.6	Very low	33	Very low	67 Å²	67	97.4 Å²	97.4	41%	0.411	54%	0.541	S	S	.	.			trans	-60.9	158.4	179.2	69.2	0	0	0	0	110.8	S1199 D1200 E1201	T1197-S1199 PolarHBondContact O-N 3.45Å; T1197-S1199 PolarHBondContact OG1-OG 3.47Å; T1197-D1200 VanDerWaalsContact CB-OD2 3.32Å; T1197-D1200 WeakPolarHBondContact CB-OD2 3.24Å; T1197-D1200 WeakPolarHBondContact CG2-OD2 3.48Å; T1197-D1200 PolarHBondContact N-OD2 3.1Å; T1197-D1200 WeakPolarHBondContact O-CB 3.47Å; T1197-D1200 PolarHBondContact O-N 2.89Å; T1197-D1200 PolarHBondContact OG1-N 3.18Å; T1197-D1200 PolarHBondContact OG1-OD2 3.23Å; T1197-E1201 PolarHBondContact O-N 3.08Å
1198	S	35.9	Very low	33.4	Very low	109 Å²	109	97 Å²	97	76%	0.762	54%	0.535	S	S	*	.	H	α-helix	trans	-57.1	-33	176.3	51.4	0	0	0	0	112.2	A1202	S1198-A1202 VanDerWaalsContact O-CB 3.25Å; S1198-A1202 WeakPolarHBondContact O-CB 3.1Å; S1198-A1202 PolarHBondContact O-N 3.12Å
1199	S	40.1	Very low	34	Very low	67 Å²	67	93.2 Å²	93.2	47%	0.469	52%	0.521	S	S	.	.	H	α-helix	trans	-61.8	-44.2	168.4	20.5	0	0	0	0	113.4	T1197 A1202 L1203	T1197-S1199 PolarHBondContact O-N 3.45Å; T1197-S1199 PolarHBondContact OG1-OG 3.47Å; S1199-A1202 PolarHBondContact O-N 3.29Å; S1199-L1203 WeakPolarHBondContact O-CB 3.48Å; S1199-L1203 WeakPolarHBondContact O-CG 3.48Å; S1199-L1203 PolarHBondContact O-N 3.29Å
1200	D	39	Very low	34.5	Very low	54 Å²	54	98.1 Å²	98.1	29%	0.289	53%	0.525	S	S	.	.	H	α-helix	trans	-69.5	-40	-179.8	-57.6	-44	0	0	0	112.2	L1196 T1197 A1202 L1203 Y1204	L1196-D1200 HydrophobicContact CB-CB 3.96Å; L1196-D1200 HydrophobicContact CD2-CB 4.02Å; T1197-D1200 VanDerWaalsContact CB-OD2 3.32Å; T1197-D1200 WeakPolarHBondContact CB-OD2 3.24Å; T1197-D1200 WeakPolarHBondContact CG2-OD2 3.48Å; T1197-D1200 PolarHBondContact N-OD2 3.1Å; T1197-D1200 WeakPolarHBondContact O-CB 3.47Å; T1197-D1200 PolarHBondContact O-N 2.89Å; T1197-D1200 PolarHBondContact OG1-N 3.18Å; T1197-D1200 PolarHBondContact OG1-OD2 3.23Å; D1200-A1202 VanDerWaalsContact C-N 3.33Å; D1200-L1203 PolarHBondContact O-N 2.93Å; D1200-Y1204 WeakPolarHBondContact O-CB 3.5Å; D1200-Y1204 PolarHBondContact O-N 2.61Å
1201	E	39.1	Very low	34.8	Very low	96 Å²	96	94.8 Å²	94.8	45%	0.449	52%	0.522	S	S	.	.	H	α-helix	trans	-70	-33.1	174.9	-158.5	-177.6	-157.9	0	0	111	T1197 T1205	T1197-E1201 PolarHBondContact O-N 3.08Å; E1201-T1205 WeakPolarHBondContact O-CB 3.38Å; E1201-T1205 WeakPolarHBondContact O-CG2 3.33Å; E1201-T1205 PolarHBondContact O-N 3.41Å; E1201-T1205 PolarHBondContact O-OG1 3.5Å
1202	A	41.6	Very low	35.1	Very low	53 Å²	53	96.3 Å²	96.3	44%	0.438	52%	0.524	S	S	.	.	H	α-helix	trans	-64.4	-47.7	170.1	0	0	0	0	0	111.9	S1198 S1199 D1200 Y1204 T1205 D1206	S1198-A1202 VanDerWaalsContact O-CB 3.25Å; S1198-A1202 WeakPolarHBondContact O-CB 3.1Å; S1198-A1202 PolarHBondContact O-N 3.12Å; S1199-A1202 PolarHBondContact O-N 3.29Å; D1200-A1202 VanDerWaalsContact C-N 3.33Å; A1202-Y1204 PolarHBondContact O-N 3.37Å; A1202-T1205 WeakPolarHBondContact CA-OG1 3.39Å; A1202-T1205 PolarHBondContact O-N 3.49Å; A1202-T1205 PolarHBondContact O-OG1 2.91Å; A1202-T1205 VanDerWaalsContact O-OG1 3.09Å; A1202-D1206 WeakPolarHBondContact O-CB 3.45Å; A1202-D1206 PolarHBondContact O-N 3.25Å
1203	L	38.1	Very low	35.1	Very low	94 Å²	94	96.1 Å²	96.1	49%	0.492	52%	0.522	S	S	.	.	H	α-helix	trans	-62.1	-42	176.3	-78.4	167	0	0	0	112	S1199 D1200 D1206 Y1207	S1199-L1203 WeakPolarHBondContact O-CB 3.48Å; S1199-L1203 WeakPolarHBondContact O-CG 3.48Å; S1199-L1203 PolarHBondContact O-N 3.29Å; D1200-L1203 PolarHBondContact O-N 2.93Å; L1203-D1206 PolarHBondContact O-N 2.77Å; L1203-Y1207 WeakPolarHBondContact O-CB 3.18Å; L1203-Y1207 PolarHBondContact O-N 3.01Å
1204	Y	40.1	Very low	35.2	Very low	94 Å²	94	98.6 Å²	98.6	37%	0.369	53%	0.529	S	S	.	.	H	α-helix	trans	-69.1	-35.1	176.3	177.3	-115.7	0	0	0	112.8	D1200 A1202 Y1207 K1208	D1200-Y1204 WeakPolarHBondContact O-CB 3.5Å; D1200-Y1204 PolarHBondContact O-N 2.61Å; A1202-Y1204 PolarHBondContact O-N 3.37Å; Y1204-Y1207 HydrophobicContact CD2-CD1 4.37Å; Y1204-K1208 VanDerWaalsContact O-CB 3.26Å; Y1204-K1208 WeakPolarHBondContact O-CB 3.18Å; Y1204-K1208 PolarHBondContact O-N 3.37Å
1205	T	39.3	Very low	35.2	Very low	75 Å²	75	97.8 Å²	97.8	46%	0.46	53%	0.53	S	S	.	.	H	α-helix	trans	-74.8	-33.3	175.5	50.8	0	0	0	0	112.8	E1201 A1202 K1208 A1209	E1201-T1205 WeakPolarHBondContact O-CB 3.38Å; E1201-T1205 WeakPolarHBondContact O-CG2 3.33Å; E1201-T1205 PolarHBondContact O-N 3.41Å; E1201-T1205 PolarHBondContact O-OG1 3.5Å; A1202-T1205 WeakPolarHBondContact CA-OG1 3.39Å; A1202-T1205 PolarHBondContact O-N 3.49Å; A1202-T1205 PolarHBondContact O-OG1 2.91Å; A1202-T1205 VanDerWaalsContact O-OG1 3.09Å; T1205-K1208 PolarHBondContact O-N 2.87Å; T1205-A1209 PolarHBondContact O-N 3.28Å
1206	D	37.5	Very low	34.7	Very low	60 Å²	60	99.1 Å²	99.1	32%	0.321	53%	0.533	S	S	.	.	H	α-helix	trans	-72.4	-45.1	171.1	-174.7	29.3	0	0	0	111.9	A1202 L1203 K1208 A1209 R1210	A1202-D1206 WeakPolarHBondContact O-CB 3.45Å; A1202-D1206 PolarHBondContact O-N 3.25Å; L1203-D1206 PolarHBondContact O-N 2.77Å; D1206-K1208 PolarHBondContact O-N 3.02Å; D1206-K1208 VanDerWaalsContact O-N 3.16Å; D1206-A1209 CarbonylContact O-C 3.4Å; D1206-A1209 WeakPolarHBondContact O-CA 3.31Å; D1206-A1209 WeakPolarHBondContact O-CB 3.35Å; D1206-A1209 PolarHBondContact O-N 3.26Å; D1206-R1210 VanDerWaalsContact CG-NE 3.34Å; D1206-R1210 WeakPolarHBondContact O-CB 3.11Å; D1206-R1210 WeakPolarHBondContact O-CG 3.47Å; D1206-R1210 PolarHBondContact O-N 3.05Å; D1206-R1210 IonicContact OD1-NE 2.68Å; D1206-R1210 PolarHBondContact OD1-NE 3.25Å; D1206-R1210 IonicContact OD2-CZ 3.65Å; D1206-R1210 IonicContact OD2-NE 2.7Å; D1206-R1210 PolarHBondContact OD2-NE 3.02Å; D1206-R1210 IonicContact OD2-NH2 3.55Å; D1206-R1210 PolarHBondContact OD2-NH2 2.76Å
1207	Y	38.7	Very low	34.2	Very low	115 Å²	115	100.3 Å²	100.3	45%	0.451	54%	0.54	S	S	.	.	H	α-helix	trans	-49.1	-44.5	168.8	166.7	-98.6	0	0	0	111.1	L1203 Y1204 R1210 G1211	L1203-Y1207 WeakPolarHBondContact O-CB 3.18Å; L1203-Y1207 PolarHBondContact O-N 3.01Å; Y1204-Y1207 HydrophobicContact CD2-CD1 4.37Å; Y1207-R1210 PolarHBondContact O-N 3.42Å; Y1207-G1211 PolarHBondContact O-N 3.14Å
1208	K	34.1	Very low	33.2	Very low	102 Å²	102	104 Å²	104	44%	0.443	55%	0.55	S	S	.	.	H	α-helix	trans	-69.6	-32.6	177.1	-170.6	175.9	179.2	-175.8	0	113.3	Y1204 T1205 D1206 F1212	Y1204-K1208 VanDerWaalsContact O-CB 3.26Å; Y1204-K1208 WeakPolarHBondContact O-CB 3.18Å; Y1204-K1208 PolarHBondContact O-N 3.37Å; T1205-K1208 PolarHBondContact O-N 2.87Å; D1206-K1208 PolarHBondContact O-N 3.02Å; D1206-K1208 VanDerWaalsContact O-N 3.16Å; K1208-F1212 WeakPolarHBondContact O-CD2 3.44Å; K1208-F1212 PolarHBondContact O-N 2.75Å
1209	A	35.1	Very low	32.6	Very low	47 Å²	47	108.4 Å²	108.4	39%	0.388	56%	0.558	S	S	.	*	H	α-helix	trans	-71.1	-42.6	172.2	0	0	0	0	0	111.8	T1205 D1206 G1211 F1212 M1213	T1205-A1209 PolarHBondContact O-N 3.28Å; D1206-A1209 CarbonylContact O-C 3.4Å; D1206-A1209 WeakPolarHBondContact O-CA 3.31Å; D1206-A1209 WeakPolarHBondContact O-CB 3.35Å; D1206-A1209 PolarHBondContact O-N 3.26Å; A1209-G1211 VanDerWaalsContact C-N 3.31Å; A1209-G1211 PolarHBondContact O-N 2.8Å; A1209-F1212 CarbonylContact O-C 3.59Å; A1209-F1212 WeakPolarHBondContact O-CA 3.15Å; A1209-F1212 WeakPolarHBondContact O-CB 3.13Å; A1209-F1212 PolarHBondContact O-N 2.88Å; A1209-M1213 WeakPolarHBondContact O-CG 3.44Å; A1209-M1213 PolarHBondContact O-N 3.48Å
1210	R	30.4	Very low	31.7	Very low	152 Å²	152	114.9 Å²	114.9	57%	0.574	57%	0.572	S	S	*	*	H	α-helix	trans	-61	-37.8	172.2	-66.6	179.1	-168.1	-155.4	8.6	111.5	D1206 Y1207 F1212 M1213 N1214	D1206-R1210 VanDerWaalsContact CG-NE 3.34Å; D1206-R1210 WeakPolarHBondContact O-CB 3.11Å; D1206-R1210 WeakPolarHBondContact O-CG 3.47Å; D1206-R1210 PolarHBondContact O-N 3.05Å; D1206-R1210 IonicContact OD1-NE 2.68Å; D1206-R1210 PolarHBondContact OD1-NE 3.25Å; D1206-R1210 IonicContact OD2-CZ 3.65Å; D1206-R1210 IonicContact OD2-NE 2.7Å; D1206-R1210 PolarHBondContact OD2-NE 3.02Å; D1206-R1210 IonicContact OD2-NH2 3.55Å; D1206-R1210 PolarHBondContact OD2-NH2 2.76Å; Y1207-R1210 PolarHBondContact O-N 3.42Å; R1210-F1212 PolarHBondContact O-N 2.87Å; R1210-M1213 PolarHBondContact O-N 3.32Å; R1210-N1214 WeakPolarHBondContact O-CB 3.14Å; R1210-N1214 PolarHBondContact O-N 3.43Å
1211	G	30.4	Very low	30.9	Very low	63 Å²	63	118 Å²	118	65%	0.649	59%	0.588	S	S	*	*	H	α-helix	trans	-62.4	-19	170.4	0	0	0	0	0	114.8	Y1207 A1209	Y1207-G1211 PolarHBondContact O-N 3.14Å; A1209-G1211 VanDerWaalsContact C-N 3.31Å; A1209-G1211 PolarHBondContact O-N 2.8Å
1212	F	31.3	Very low	30.1	Very low	170 Å²	170	120.7 Å²	120.7	75%	0.746	60%	0.604	S	S	*	*	H	α-helix	trans	-94.9	-22.7	168.3	-85.7	-75.4	0	0	0	113.7	K1208 A1209 R1210	K1208-F1212 WeakPolarHBondContact O-CD2 3.44Å; K1208-F1212 PolarHBondContact O-N 2.75Å; A1209-F1212 CarbonylContact O-C 3.59Å; A1209-F1212 WeakPolarHBondContact O-CA 3.15Å; A1209-F1212 WeakPolarHBondContact O-CB 3.13Å; A1209-F1212 PolarHBondContact O-N 2.88Å; R1210-F1212 PolarHBondContact O-N 2.87Å
1213	M	25.2	Very low	29.2	Very low	155 Å²	155	126.3 Å²	126.3	76%	0.764	62%	0.621	S	S	*	*	H	α-helix	trans	-92.1	-27.7	-178.3	-70.1	-64.8	-173.6	0	0	113.9	A1209 R1210 N1215	A1209-M1213 WeakPolarHBondContact O-CG 3.44Å; A1209-M1213 PolarHBondContact O-N 3.48Å; R1210-M1213 PolarHBondContact O-N 3.32Å; M1213-N1215 PolarHBondContact O-N 3.31Å
1214	N	25.9	Very low	28.5	Very low	131 Å²	131	127.1 Å²	127.1	70%	0.701	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	47.8	-178.9	-158.9	25.9	0	0	0	113.1	R1210	R1210-N1214 WeakPolarHBondContact O-CB 3.14Å; R1210-N1214 PolarHBondContact O-N 3.43Å
1215	N	27.1	Very low	27.5	Very low	147 Å²	147	134 Å²	134	79%	0.786	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.3	0.8	167.8	-121.5	-9.3	0	0	0	111.5	M1213	M1213-N1215 PolarHBondContact O-N 3.31Å
1216	N	24.3	Very low	26.6	Very low	144 Å²	144	142.7 Å²	142.7	77%	0.77	68%	0.684	S	S	*	*	S	Bend	trans	-138.1	57.9	-175.7	-82.8	-59	0	0	0	112.8
1217	N	21.6	Very low	25.9	Very low	112 Å²	112	144 Å²	144	60%	0.599	70%	0.698	S	S	*	*			trans	-143.7	106.7	153.3	-106.7	-64.8	0	0	0	112.3
1218	K	22	Very low	25	Very low	145 Å²	145	146.8 Å²	146.8	63%	0.63	71%	0.713	S	S	*	*			trans	72	98.1	143.7	-68.4	163.1	-173	140.9	0	118.4	R1220	K1218-R1220 HydrophobicContact CB-CB 3.99Å; K1218-R1220 HydrophobicContact CD-CB 4.42Å; K1218-R1220 HydrophobicContact CG-CB 4.17Å; K1218-R1220 PolarHBondContact O-N 2.88Å
1219	Q	23.2	Very low	24.4	Very low	201 Å²	201	145.3 Å²	145.3	94%	0.939	71%	0.714	S	S	*	*	S	Bend		-41.7	93	108.6	-66.1	168.7	-40.6	0	0	110.3
1220	R	22.8	Very low	23.7	Very low	202 Å²	202	150 Å²	150	76%	0.762	72%	0.722	S	S	*	*			trans	173.4	73.3	162.4	-96.2	-178.2	-146.5	-165.7	6.3	109	K1218	K1218-R1220 HydrophobicContact CB-CB 3.99Å; K1218-R1220 HydrophobicContact CD-CB 4.42Å; K1218-R1220 HydrophobicContact CG-CB 4.17Å; K1218-R1220 PolarHBondContact O-N 2.88Å
1221	I	21.1	Very low	23.9	Very low	121 Å²	121	148.9 Å²	148.9	62%	0.621	73%	0.726	S	S	*	*	S	Bend	trans	-159.9	61.6	138	-84	136.6	0	0	0	105
1222	I	22.5	Very low	23.3	Very low	151 Å²	151	157.4 Å²	157.4	77%	0.774	74%	0.739	S	S	*	*	S	Bend	trans	-132.8	107.6	148.6	-67.6	-173.1	0	0	0	104.5
1223	E	22	Very low	22.9	Very low	171 Å²	171	153.3 Å²	153.3	80%	0.799	74%	0.736	S	S	*	*			trans	39.2	133.9	136.7	-57.6	173.1	168.7	0	0	120.9	R1225	E1223-R1225 PolarHBondContact O-N 3.17Å; E1223-R1225 VanDerWaalsContact O-N 3.17Å
1224	S	23.7	Very low	22.9	Very low	112 Å²	112	149 Å²	149	78%	0.783	73%	0.732	S	S	*	*			trans	-23.6	105.1	151.7	47.6	0	0	0	0	117
1225	R	20.1	Very low	22.6	Very low	237 Å²	237	150 Å²	150	89%	0.894	73%	0.734	S	S	*	*			trans	-155.7	95.9	143.7	-104.5	159.5	-151.9	-99.5	4.1	110.7	E1223	E1223-R1225 PolarHBondContact O-N 3.17Å; E1223-R1225 VanDerWaalsContact O-N 3.17Å
1226	R	19.6	Very low	22.4	Very low	258 Å²	258	149.3 Å²	149.3	97%	0.974	73%	0.73	S	S	*	*			trans	-94.9	105.4	162.5	-79.3	-174.5	175.5	-172	-1.1	108.1
1227	S	22.2	Very low	22.3	Very low	87 Å²	87	146.5 Å²	146.5	61%	0.608	72%	0.722	S	S	*	*			trans	-135.6	70.1	175.1	57	0	0	0	0	111.3	P1229	S1227-P1229 CarbonylContact C-O 3.57Å; S1227-P1229 VanDerWaalsContact C-O 3.23Å; S1227-P1229 CarbonylContact O-C 3.59Å
1228	F	20	Very low	22.6	Very low	174 Å²	174	146.5 Å²	146.5	76%	0.763	72%	0.721	S	S	*	*				-72.2	142.5	124.9	-87.4	-153.3	0	0	0	106.7
1229	P	22.2	Very low	22.8	Very low	72 Å²	72	146.8 Å²	146.8	47%	0.468	73%	0.729	S	S	.	*			cis	-64.6	172.7	-30.8	-22.4	38.6	0	0	0	111.4	S1227 L1231	S1227-P1229 CarbonylContact C-O 3.57Å; S1227-P1229 VanDerWaalsContact C-O 3.23Å; S1227-P1229 CarbonylContact O-C 3.59Å; P1229-L1231 HydrophobicContact CB-CB 4.3Å; P1229-L1231 HydrophobicContact CB-CD2 3.77Å; P1229-L1231 HydrophobicContact CB-CG 3.72Å; P1229-L1231 HydrophobicContact CG-CD2 3.68Å; P1229-L1231 HydrophobicContact CG-CG 3.92Å
1230	R	19.6	Very low	23.1	Very low	146 Å²	146	142.3 Å²	142.3	55%	0.551	72%	0.72	S	S	*	*			cis	52.3	-137.9	27.2	41	90.7	177.2	-157.5	4.2	112	W1232 A1233	R1230-W1232 CarbonylContact O-C 3.58Å; R1230-A1233 WeakPolarHBondContact O-CB 3.49Å; R1230-A1233 PolarHBondContact O-N 3.01Å
1231	L	34.7	Very low	23.4	Very low	128 Å²	128	135.8 Å²	135.8	67%	0.67	72%	0.715	S	S	*	*	S	Bend	cis	-72.3	-19.9	-2.8	-67.7	168.1	0	0	0	116.5	P1229	P1229-L1231 HydrophobicContact CB-CB 4.3Å; P1229-L1231 HydrophobicContact CB-CD2 3.77Å; P1229-L1231 HydrophobicContact CB-CG 3.72Å; P1229-L1231 HydrophobicContact CG-CD2 3.68Å; P1229-L1231 HydrophobicContact CG-CG 3.92Å
1232	W	18.5	Very low	23.5	Very low	242 Å²	242	139 Å²	139	92%	0.917	73%	0.727	S	S	*	*			cis	-63.2	157.9	12.2	-11.3	-84.7	0	0	0	116	R1230	R1230-W1232 CarbonylContact O-C 3.58Å
1233	A	23.4	Very low	23.3	Very low	83 Å²	83	141.9 Å²	141.9	69%	0.686	73%	0.728	S	S	*	*			trans	-131.2	115.3	170.2	0	0	0	0	0	106.4	R1230	R1230-A1233 WeakPolarHBondContact O-CB 3.49Å; R1230-A1233 PolarHBondContact O-N 3.01Å
1234	G	23.9	Very low	23.2	Very low	66 Å²	66	142.1 Å²	142.1	68%	0.68	74%	0.735	S	S	*	*			trans	-73.2	141.5	-167.2	0	0	0	0	0	113
1235	M	20	Very low	23.1	Very low	151 Å²	151	140.7 Å²	140.7	74%	0.744	73%	0.725	S	S	*	*	S	Bend	trans	-118.1	20.3	140.8	-144.6	173.7	73	0	0	112	S1237 I1238	M1235-S1237 CarbonylContact C-O 3.54Å; M1235-S1237 VanDerWaalsContact CA-O 3.24Å; M1235-S1237 WeakPolarHBondContact CA-O 3.48Å; M1235-S1237 CarbonylContact O-C 3.57Å; M1235-I1238 WeakPolarHBondContact O-CB 3.38Å; M1235-I1238 WeakPolarHBondContact O-CG1 3.26Å; M1235-I1238 PolarHBondContact O-N 3.43Å
1236	N	22	Very low	22.9	Very low	132 Å²	132	134.9 Å²	134.9	71%	0.706	71%	0.711	S	S	*	*			trans	-118.7	100.2	148.3	-75.1	41	0	0	0	106.5	I1238	N1236-I1238 CarbonylContact C-O 3.56Å; N1236-I1238 WeakPolarHBondContact CA-O 3.39Å; N1236-I1238 HydrophobicContact CB-CB 4.44Å; N1236-I1238 VanDerWaalsContact CB-O 3.3Å; N1236-I1238 WeakPolarHBondContact CB-O 3.32Å
1237	S	22.9	Very low	22.9	Very low	85 Å²	85	131.2 Å²	131.2	59%	0.594	70%	0.703	S	S	*	*			cis	-27.3	106.9	-3.8	-72.3	0	0	0	0	117	M1235 L1239	M1235-S1237 CarbonylContact C-O 3.54Å; M1235-S1237 VanDerWaalsContact CA-O 3.24Å; M1235-S1237 WeakPolarHBondContact CA-O 3.48Å; M1235-S1237 CarbonylContact O-C 3.57Å; S1237-L1239 VanDerWaalsContact CA-O 3.27Å; S1237-L1239 WeakPolarHBondContact CA-O 3.33Å; S1237-L1239 WeakPolarHBondContact CB-O 3.41Å; S1237-L1239 PolarHBondContact OG-O 3.31Å
1238	I	29	Very low	22.9	Very low	113 Å²	113	133.3 Å²	133.3	58%	0.579	71%	0.707	S	S	*	*			cis	-5.9	100.1	-7.3	-56.7	171.1	0	0	0	115.2	M1235 N1236	M1235-I1238 WeakPolarHBondContact O-CB 3.38Å; M1235-I1238 WeakPolarHBondContact O-CG1 3.26Å; M1235-I1238 PolarHBondContact O-N 3.43Å; N1236-I1238 CarbonylContact C-O 3.56Å; N1236-I1238 WeakPolarHBondContact CA-O 3.39Å; N1236-I1238 HydrophobicContact CB-CB 4.44Å; N1236-I1238 VanDerWaalsContact CB-O 3.3Å; N1236-I1238 WeakPolarHBondContact CB-O 3.32Å
1239	L	25.3	Very low	23	Very low	151 Å²	151	129.8 Å²	129.8	79%	0.791	70%	0.7	S	S	*	*	S	Bend	cis	-56.9	118.8	6.8	-60.3	169	0	0	0	115.1	S1237	S1237-L1239 VanDerWaalsContact CA-O 3.27Å; S1237-L1239 WeakPolarHBondContact CA-O 3.33Å; S1237-L1239 WeakPolarHBondContact CB-O 3.41Å; S1237-L1239 PolarHBondContact OG-O 3.31Å
1240	S	29.2	Very low	22.9	Very low	107 Å²	107	136.8 Å²	136.8	75%	0.748	72%	0.717	S	S	*	*	S	Bend	trans	48.8	123.6	161	59.5	0	0	0	0	122.7
1241	G	30.1	Very low	23.1	Very low	64 Å²	64	137.4 Å²	137.4	66%	0.66	73%	0.726	S	S	*	*				128.4	85.5	120.2	0	0	0	0	0	122
1242	H	22.8	Very low	22.4	Very low	190 Å²	190	139.1 Å²	139.1	88%	0.88	74%	0.735	S	S	*	*			trans	66.5	178.8	153.4	-96	85.4	0	0	0	120.1
1243	W	18.5	Very low	22.4	Very low	210 Å²	210	138.3 Å²	138.3	80%	0.795	73%	0.731	S	S	*	*			trans	84.7	62.9	176.9	-64	97.2	0	0	0	119.8
1244	N	18.7	Very low	22.3	Very low	177 Å²	177	139 Å²	139	95%	0.947	73%	0.731	S	S	*	*			trans	-97.3	82.2	148.3	-119.7	-19.8	0	0	0	109.2
1245	S	21.8	Very low	22	Very low	82 Å²	82	144.4 Å²	144.4	57%	0.573	74%	0.736	S	S	*	*			trans	-165.2	157.8	166.7	-159.5	0	0	0	0	112.8
1246	L	17.5	Very low	21.9	Very low	115 Å²	115	146.2 Å²	146.2	60%	0.602	74%	0.74	S	S	*	*			trans	71.2	82.4	167.1	-50.1	-170.4	0	0	0	119.2
1247	F	19.8	Very low	21.8	Very low	181 Å²	181	145.7 Å²	145.7	79%	0.794	75%	0.746	S	S	*	*			trans	75.5	176.5	139.4	-49.2	-58.7	0	0	0	121.6
1248	N	22.1	Very low	22	Very low	131 Å²	131	145 Å²	145	70%	0.701	75%	0.752	S	S	*	*				-171.9	166.4	-68.1	-135.4	-33.9	0	0	0	111
1249	T	21.8	Very low	21.9	Very low	99 Å²	99	145.2 Å²	145.2	61%	0.607	76%	0.761	S	S	*	*			trans	59.6	116.4	152.3	49.4	0	0	0	0	123.4
1250	R	20	Very low	21.6	Very low	219 Å²	219	143.6 Å²	143.6	83%	0.826	76%	0.758	S	S	*	*				83.8	151.3	127.8	-66.3	174.8	-179.2	165.7	0.7	122.3
1251	H	22.6	Very low	21.2	Very low	160 Å²	160	144.5 Å²	144.5	74%	0.741	76%	0.759	S	S	*	*			trans	67.3	105.4	162.8	-67.8	-67.9	0	0	0	121.8
1252	L	20	Very low	20.7	Very low	163 Å²	163	147.2 Å²	147.2	85%	0.853	76%	0.763	S	S	*	*				163.8	109.1	121.9	-85.2	165.9	0	0	0	107.2
1253	R	18.9	Very low	20.4	Very low	225 Å²	225	143 Å²	143	85%	0.849	76%	0.755	S	S	*	*				64.3	127.6	69.5	-82.2	-164.8	175.2	-172.3	1.1	116.3
1254	S	20.7	Very low	20.5	Very low	97 Å²	97	138.8 Å²	138.8	68%	0.678	75%	0.753	S	S	*	*			trans	86.6	153.8	152.4	77.7	0	0	0	0	120.6
1255	F	18.5	Very low	20.5	Very low	181 Å²	181	136.1 Å²	136.1	79%	0.794	74%	0.743	S	S	*	*			trans	59.6	120.5	-178	-59.5	-84.2	0	0	0	116.9
1256	K	18.3	Very low	20.4	Very low	189 Å²	189	139.2 Å²	139.2	82%	0.822	76%	0.758	S	S	*	*			cis	76.5	141.5	38.2	-74.3	-165.4	171.1	-177.4	0	115
1257	S	20.5	Very low	20.5	Very low	120 Å²	120	140.5 Å²	140.5	84%	0.839	77%	0.772	S	S	*	*			trans	74.9	145.8	178.1	-39.5	0	0	0	0	115.4
1258	G	25.7	Very low	20.4	Very low	70 Å²	70	135 Å²	135	72%	0.722	77%	0.765	S	S	*	*			trans	-88.4	-154.1	164.8	0	0	0	0	0	111.3
1259	P	26.4	Very low	20.4	Very low	118 Å²	118	138.8 Å²	138.8	77%	0.766	78%	0.776	S	S	*	*			cis	-143.4	-173.9	29.6	42.5	-22.1	0	0	0	116.5
1260	T	19.4	Very low	20.3	Very low	118 Å²	118	140.2 Å²	140.2	72%	0.724	79%	0.785	S	S	*	*			trans	22.9	151.2	148.5	54.3	0	0	0	0	124.8
1261	T	21	Very low	20.4	Very low	126 Å²	126	136 Å²	136	77%	0.773	79%	0.785	S	S	*	*			trans	96.7	156.2	139	26	0	0	0	0	122.9
1262	T	18.8	Very low	20.4	Very low	120 Å²	120	134.2 Å²	134.2	74%	0.736	79%	0.786	S	S	*	*			trans	72.2	86.7	163.2	39.5	0	0	0	0	121.7
1263	S	18.4	Very low	20.5	Very low	102 Å²	102	131.5 Å²	131.5	71%	0.713	78%	0.781	S	S	*	*				61.3	161.6	108.2	66.8	0	0	0	0	124.3
1264	T	18.9	Very low	20.7	Very low	121 Å²	121	128 Å²	128	74%	0.742	78%	0.779	S	S	*	*			trans	99	150.3	155.2	-9.2	0	0	0	0	117.8
1265	T	19.4	Very low	20.8	Very low	121 Å²	121	131.3 Å²	131.3	74%	0.742	79%	0.786	S	S	*	*			trans	-121	150.9	-158.2	46.8	0	0	0	0	113.1
1266	T	19.7	Very low	21.1	Very low	147 Å²	147	131.4 Å²	131.4	90%	0.902	79%	0.789	S	S	*	*			trans	-155.2	161.5	148.5	-12.1	0	0	0	0	111
1267	T	18.9	Very low	21.4	Very low	143 Å²	143	128.8 Å²	128.8	88%	0.877	78%	0.783	S	S	*	*			trans	-108.8	141.9	-169.6	48.1	0	0	0	0	112.6
1268	G	19	Very low	21.5	Very low	64 Å²	64	130.7 Å²	130.7	66%	0.66	78%	0.782	S	S	*	*			trans	179.2	130.3	167.6	0	0	0	0	0	114.1
1269	F	21.5	Very low	21.4	Very low	212 Å²	212	131.2 Å²	131.2	93%	0.93	78%	0.775	S	S	*	*			trans	57.1	98.3	166.5	-61.5	-75.4	0	0	0	119.4
1270	T	19.4	Very low	21.4	Very low	128 Å²	128	131.7 Å²	131.7	79%	0.785	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-95.1	123.2	159.2	49.2	0	0	0	0	110.9
1271	P	23.3	Very low	21.7	Very low	130 Å²	130	132.2 Å²	132.2	84%	0.844	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-64.9	145	157.5	-17.6	32.2	0	0	0	110.2
1272	T	21.8	Very low	21.9	Very low	124 Å²	124	134.3 Å²	134.3	76%	0.761	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-91.9	152.9	-173.5	36.6	0	0	0	0	113.6
1273	S	22.1	Very low	22.4	Very low	105 Å²	105	132.9 Å²	132.9	73%	0.734	77%	0.766	S	S	*	*	S	Bend	trans	73.2	151.5	167.7	75.2	0	0	0	0	118.9
1274	N	23.9	Very low	22.9	Very low	153 Å²	153	132.5 Å²	132.5	82%	0.818	76%	0.759	S	S	*	*			trans	64.6	36	165.2	-61.4	-4.5	0	0	0	119.5
1275	M	22.9	Very low	23.5	Very low	165 Å²	165	134.6 Å²	134.6	81%	0.813	76%	0.758	S	S	*	*			trans	-131.3	75.2	156.7	-102	-67.4	117.9	0	0	111.8
1276	Q	24.4	Very low	24.1	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	75%	0.747	S	S	*	*			trans	-130.6	45.8	172.5	-160.4	169.3	0.4	0	0	112.1	I1278	Q1276-I1278 PolarHBondContact O-N 3.18Å
1277	L	24.4	Very low	24.7	Very low	134 Å²	134	133.5 Å²	133.5	70%	0.702	73%	0.731	S	S	*	*			trans	-90.5	44.8	179.8	-139.5	167.1	0	0	0	111.8
1278	I	21.7	Very low	25.7	Very low	159 Å²	159	135.3 Å²	135.3	82%	0.815	72%	0.722	S	S	*	*			trans	-140.4	79.4	179.5	-49.6	-179.8	0	0	0	110.3	Q1276	Q1276-I1278 PolarHBondContact O-N 3.18Å
1279	S	24.8	Very low	27.1	Very low	81 Å²	81	135.4 Å²	135.4	57%	0.566	70%	0.702	S	S	*	*			trans	-166.2	-19.4	163	58	0	0	0	0	114.8	T1281 E1282	S1279-T1281 PolarHBondContact O-N 3.33Å; S1279-E1282 PolarHBondContact O-N 2.84Å; S1279-E1282 VanDerWaalsContact O-N 3.16Å
1280	E	25.4	Very low	28.7	Very low	129 Å²	129	127.6 Å²	127.6	60%	0.603	67%	0.674	S	S	*	*	H	α-helix	trans	-58.6	-15.3	-176.7	-62.9	-167.9	131.3	0	0	115.2	E1282 S1283 V1284	E1280-E1282 PolarHBondContact O-N 3.19Å; E1280-S1283 PolarHBondContact O-OG 2.8Å; E1280-V1284 PolarHBondContact O-N 3.38Å
1281	T	26.5	Very low	30.7	Very low	129 Å²	129	124 Å²	124	79%	0.791	65%	0.649	S	S	*	*	H	α-helix	trans	-68.4	-13.8	176.5	48.6	0	0	0	0	114.9	S1279	S1279-T1281 PolarHBondContact O-N 3.33Å
1282	E	25.9	Very low	32.6	Very low	170 Å²	170	119.7 Å²	119.7	79%	0.794	62%	0.619	S	S	*	*	H	α-helix	trans	-103.6	-30.1	175.7	-63.7	-159.3	142.4	0	0	113.9	S1279 E1280	S1279-E1282 PolarHBondContact O-N 2.84Å; S1279-E1282 VanDerWaalsContact O-N 3.16Å; E1280-E1282 PolarHBondContact O-N 3.19Å
1283	S	28.4	Very low	34.9	Very low	90 Å²	90	115.5 Å²	115.5	63%	0.629	59%	0.592	S	S	*	*	H	α-helix	trans	-74.9	-37	179	54.5	0	0	0	0	112.5	E1280 K1285	E1280-S1283 PolarHBondContact O-OG 2.8Å; S1283-K1285 PolarHBondContact O-N 3.38Å
1284	V	28.6	Very low	37.5	Very low	94 Å²	94	110.6 Å²	110.6	57%	0.57	56%	0.557	S	S	*	*			trans	-77.3	71.6	172.2	-169.4	0	0	0	0	109.9	E1280 R1286	E1280-V1284 PolarHBondContact O-N 3.38Å; V1284-R1286 PolarHBondContact O-N 3.08Å
1285	K	32	Very low	40.2	Very low	165 Å²	165	106.1 Å²	106.1	72%	0.717	53%	0.529	S	S	*	.			trans	-55	113.5	154.7	-71.9	-178.5	-178.2	175.4	0	106.6	S1283	S1283-K1285 PolarHBondContact O-N 3.38Å
1286	R	31.7	Very low	42.4	Very low	137 Å²	137	98.8 Å²	98.8	52%	0.517	49%	0.494	S	S	.	.			trans	-52.8	145.3	-176.9	-67.9	168	171.1	76.1	6.9	110	V1284 R1288	V1284-R1286 PolarHBondContact O-N 3.08Å; R1286-R1288 HydrophobicContact CB-CB 3.91Å; R1286-R1288 HydrophobicContact CB-CG 4.09Å; R1286-R1288 VanDerWaalsContact O-CB 3.32Å; R1286-R1288 WeakPolarHBondContact O-CB 3.23Å; R1286-R1288 PolarHBondContact O-N 2.72Å
1287	L	31.8	Very low	45	Very low	107 Å²	107	90.3 Å²	90.3	56%	0.56	45%	0.454	S	S	*	.	S	Bend	trans	-53.3	88.1	148.4	-72.3	161.5	0	0	0	108.4	E2660	L1287-E2660 WeakPolarHBondContact CA-OE2 3.44Å; L1287-E2660 HydrophobicContact CD2-CB 4.26Å
1288	R	40.1	Very low	47.8	Very low	182 Å²	182	84.2 Å²	84.2	69%	0.687	42%	0.422	S	S	*	.			trans	-123	-12	-166	-140.8	179.2	-168.5	168.4	1	113.8	R1286	R1286-R1288 HydrophobicContact CB-CB 3.91Å; R1286-R1288 HydrophobicContact CB-CG 4.09Å; R1286-R1288 VanDerWaalsContact O-CB 3.32Å; R1286-R1288 WeakPolarHBondContact O-CB 3.23Å; R1286-R1288 PolarHBondContact O-N 2.72Å
1289	R	49.6	Very low	50.8	Low	66 Å²	66	77.4 Å²	77.4	25%	0.249	39%	0.388	C	S	.	.			trans	-109.8	102.7	179.8	-78.4	-176.9	173.1	145.9	14.8	107.9	S1296 S1299 E1327 D2656	R1289-S1296 VanDerWaalsContact CA-OG 3.3Å; R1289-S1296 WeakPolarHBondContact CA-OG 3.32Å; R1289-S1296 VanDerWaalsContact CB-OG 3.24Å; R1289-S1296 WeakPolarHBondContact CB-OG 3.36Å; R1289-S1299 PolarHBondContact NH1-OG 3.17Å; R1289-E1327 IonicContact CZ-OE1 2.75Å; R1289-E1327 IonicContact NH1-OE1 3.57Å; R1289-E1327 VanDerWaalsContact NH2-CD 3.34Å; R1289-E1327 IonicContact NH2-OE1 3.3Å; R1289-E1327 PolarHBondContact NH2-OE1 2.89Å; R1289-D2656 IonicContact NH1-OD2 3.07Å; R1289-D2656 PolarHBondContact NH1-OD2 3.18Å; R1289-D2656 VanDerWaalsContact NH1-OD2 3.17Å
1290	S	54.1	Low	53.9	Low	47 Å²	47	73.8 Å²	73.8	33%	0.329	36%	0.363	S	S	.	.			trans	-71.6	139.2	168.4	-178.4	0	0	0	0	108.3	L1292 D1293 S1296	S1290-L1292 PolarHBondContact O-N 3.22Å; S1290-L1292 PolarHBondContact OG-N 3.15Å; S1290-L1292 VanDerWaalsContact OG-N 3.12Å; S1290-D1293 PolarHBondContact O-N 3.24Å; S1290-S1296 PolarHBondContact N-OG 2.88Å; S1290-S1296 WeakPolarHBondContact O-CB 3.36Å; S1290-S1296 PolarHBondContact O-OG 3.01Å
1291	I	62	Low	56.9	Low	54 Å²	54	67.9 Å²	67.9	28%	0.277	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-16.6	166.4	-73.7	173.3	0	0	0	111.5	L1052 L1056 Y1297 W2654	L1052-I1291 HydrophobicContact CD1-CG2 3.95Å; L1056-I1291 HydrophobicContact CD2-CG2 4.34Å; I1291-Y1297 PolarHBondContact O-OH 3.03Å; I1291-W2654 HydrophobicContact CB-CZ3 4.38Å; I1291-W2654 HydrophobicContact CG1-CE3 4.36Å; I1291-W2654 HydrophobicContact CG1-CZ3 4.45Å; I1291-W2654 HydrophobicContact CG2-CE3 4.35Å; I1291-W2654 HydrophobicContact CG2-CH2 4.44Å; I1291-W2654 HydrophobicContact CG2-CZ3 3.73Å
1292	L	62.8	Low	60	Low	39 Å²	39	62.3 Å²	62.3	20%	0.204	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-4	177.5	-52.6	177.6	0	0	0	114.7	L1052 L1056 S1290	L1052-L1292 HydrophobicContact CD1-CD2 4.49Å; L1056-L1292 HydrophobicContact CD2-CD2 3.77Å; L1056-L1292 HydrophobicContact CG-CD2 4.19Å; S1290-L1292 PolarHBondContact O-N 3.22Å; S1290-L1292 PolarHBondContact OG-N 3.15Å; S1290-L1292 VanDerWaalsContact OG-N 3.12Å
1293	D	69.1	Low	63.1	Low	36 Å²	36	54.4 Å²	54.4	19%	0.193	26%	0.263	C	S	.	.			trans	-95.6	119.5	-178.5	178.8	2.9	0	0	0	110.8	S1290 R1295 S1296 Y1297	S1290-D1293 PolarHBondContact O-N 3.24Å; D1293-R1295 PolarHBondContact O-N 3.19Å; D1293-R1295 VanDerWaalsContact OD1-CB 3.32Å; D1293-R1295 WeakPolarHBondContact OD1-CB 3.31Å; D1293-R1295 WeakPolarHBondContact OD1-CD 3.19Å; D1293-R1295 VanDerWaalsContact OD1-CG 3.24Å; D1293-R1295 WeakPolarHBondContact OD1-CG 3.49Å; D1293-R1295 IonicContact OD1-CZ 2.81Å; D1293-R1295 PolarHBondContact OD1-N 3.32Å; D1293-R1295 IonicContact OD1-NH1 2.63Å; D1293-R1295 PolarHBondContact OD1-NH1 3.12Å; D1293-R1295 WeakPolarHBondContact OD2-CD 3.49Å; D1293-S1296 VanDerWaalsContact O-CB 3.22Å; D1293-S1296 WeakPolarHBondContact O-CB 3.3Å; D1293-S1296 PolarHBondContact O-N 2.94Å; D1293-S1296 PolarHBondContact O-OG 2.99Å; D1293-Y1297 WeakPolarHBondContact O-CE2 3.16Å
1294	P	78	Confident	66.1	Low	1 Å²	1	51 Å²	51	1%	0.006	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-54.4	-20.1	175.9	-30	38.6	0	0	0	115	F955 L1060 S1296 Y1297	F955-P1294 HydrophobicContact CE1-CB 4.46Å; F955-P1294 HydrophobicContact CE2-CB 4.09Å; F955-P1294 HydrophobicContact CZ-CB 3.57Å; F955-P1294 HydrophobicContact CZ-CG 4.49Å; L1060-P1294 WeakPolarHBondContact O-CG 3.39Å; P1294-S1296 VanDerWaalsContact C-N 3.25Å; P1294-S1296 PolarHBondContact O-N 2.84Å; P1294-Y1297 PolarHBondContact O-N 3.03Å
1295	R	79.3	Confident	68.9	Low	59 Å²	59	47.6 Å²	47.6	22%	0.223	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-70.2	-19.7	174.5	-61.3	165.1	-177.4	78.6	1	113.5	D652 F955 D1293 Y1297 Q1298	D652-R1295 IonicContact OD1-CZ 3.12Å; D652-R1295 IonicContact OD1-NH1 2.7Å; D652-R1295 PolarHBondContact OD1-NH1 3.21Å; D652-R1295 IonicContact OD1-NH2 2.74Å; D652-R1295 PolarHBondContact OD1-NH2 3.23Å; D652-R1295 IonicContact OD2-CZ 2.67Å; D652-R1295 IonicContact OD2-NH2 3.07Å; D652-R1295 PolarHBondContact OD2-NH2 2.99Å; F955-R1295 HydrophobicContact CD2-CG 3.72Å; F955-R1295 HydrophobicContact CE2-CG 3.97Å; D1293-R1295 PolarHBondContact O-N 3.19Å; D1293-R1295 VanDerWaalsContact OD1-CB 3.32Å; D1293-R1295 WeakPolarHBondContact OD1-CB 3.31Å; D1293-R1295 WeakPolarHBondContact OD1-CD 3.19Å; D1293-R1295 VanDerWaalsContact OD1-CG 3.24Å; D1293-R1295 WeakPolarHBondContact OD1-CG 3.49Å; D1293-R1295 IonicContact OD1-CZ 2.81Å; D1293-R1295 PolarHBondContact OD1-N 3.32Å; D1293-R1295 IonicContact OD1-NH1 2.63Å; D1293-R1295 PolarHBondContact OD1-NH1 3.12Å; D1293-R1295 WeakPolarHBondContact OD2-CD 3.49Å; R1295-Y1297 VanDerWaalsContact C-N 3.29Å; R1295-Q1298 PolarHBondContact O-N 3.04Å
1296	S	70.8	Confident	71.5	Confident	11 Å²	11	40.2 Å²	40.2	8%	0.077	19%	0.188	C	C	.	.	G	3₁₀ helix	trans	-67.5	-32	177.5	-58.5	0	0	0	0	111.9	R1289 S1290 D1293 P1294 Q1298	R1289-S1296 VanDerWaalsContact CA-OG 3.3Å; R1289-S1296 WeakPolarHBondContact CA-OG 3.32Å; R1289-S1296 VanDerWaalsContact CB-OG 3.24Å; R1289-S1296 WeakPolarHBondContact CB-OG 3.36Å; S1290-S1296 PolarHBondContact N-OG 2.88Å; S1290-S1296 WeakPolarHBondContact O-CB 3.36Å; S1290-S1296 PolarHBondContact O-OG 3.01Å; D1293-S1296 VanDerWaalsContact O-CB 3.22Å; D1293-S1296 WeakPolarHBondContact O-CB 3.3Å; D1293-S1296 PolarHBondContact O-N 2.94Å; D1293-S1296 PolarHBondContact O-OG 2.99Å; P1294-S1296 VanDerWaalsContact C-N 3.25Å; P1294-S1296 PolarHBondContact O-N 2.84Å; S1296-Q1298 PolarHBondContact O-N 3.26Å
1297	Y	78.9	Confident	74.1	Confident	7 Å²	7	35 Å²	35	3%	0.027	17%	0.169	C	C	.	.	G	3₁₀ helix	trans	-90.2	24.3	-179.3	-46.3	-88.8	0	0	0	113.1	L1061 F1069 I1291 D1293 P1294 R1295 F1328 W2654	L1061-Y1297 HydrophobicContact CB-CD2 4.08Å; L1061-Y1297 HydrophobicContact CB-CE1 4.43Å; L1061-Y1297 HydrophobicContact CB-CE2 3.75Å; L1061-Y1297 HydrophobicContact CD2-CE2 3.77Å; L1061-Y1297 HydrophobicContact CG-CE2 4.21Å; F1069-Y1297 AromaticContact CD1-CD1 3.46Å; F1069-Y1297 HydrophobicContact CD1-CD1 3.46Å; F1069-Y1297 VanDerWaalsContact CD1-CD1 3.46Å; F1069-Y1297 AromaticContact CD1-CE1 3.84Å; F1069-Y1297 HydrophobicContact CD1-CE1 3.84Å; F1069-Y1297 HydrophobicContact CD1-CG 4.3Å; F1069-Y1297 AromaticContact CE1-CD1 3.37Å; F1069-Y1297 HydrophobicContact CE1-CD1 3.37Å; F1069-Y1297 HydrophobicContact CE1-CE1 4.22Å; F1069-Y1297 AromaticContact CE1-CG 3.99Å; F1069-Y1297 HydrophobicContact CE1-CG 3.99Å; F1069-Y1297 HydrophobicContact CG-CD1 4.39Å; F1069-Y1297 HydrophobicContact CZ-CD1 4.22Å; F1069-Y1297 HydrophobicContact CZ-CG 4.42Å; I1291-Y1297 PolarHBondContact O-OH 3.03Å; D1293-Y1297 WeakPolarHBondContact O-CE2 3.16Å; P1294-Y1297 PolarHBondContact O-N 3.03Å; R1295-Y1297 VanDerWaalsContact C-N 3.29Å; Y1297-F1328 WeakPolarHBondContact O-CE2 3.44Å; Y1297-W2654 HydrophobicContact CE1-CE3 4.14Å; Y1297-W2654 AromaticContact CE1-CH2 3.69Å; Y1297-W2654 HydrophobicContact CE1-CH2 3.69Å; Y1297-W2654 HydrophobicContact CE1-CZ2 4.36Å; Y1297-W2654 AromaticContact CE1-CZ3 3.54Å; Y1297-W2654 HydrophobicContact CE1-CZ3 3.54Å; Y1297-W2654 AromaticContact CZ-CH2 3.83Å; Y1297-W2654 AromaticContact CZ-CZ3 3.63Å; Y1297-W2654 WeakPolarHBondContact OH-CH2 2.94Å; Y1297-W2654 WeakPolarHBondContact OH-CZ3 3.4Å
1298	Q	81.9	Confident	76.5	Confident	6 Å²	6	30.3 Å²	30.3	3%	0.028	15%	0.145	C	C	.	.	S	Bend	trans	-102.1	20.3	177.1	-55.5	-166.3	-38.7	0	0	112.6	F955 R958 V1063 R1295 S1296 E1327 F1328	F955-Q1298 VanDerWaalsContact CE2-NE2 3.28Å; R958-Q1298 VanDerWaalsContact NH1-CB 3.29Å; R958-Q1298 PolarHBondContact NH2-O 2.74Å; V1063-Q1298 HydrophobicContact CG2-CG 3.92Å; R1295-Q1298 PolarHBondContact O-N 3.04Å; S1296-Q1298 PolarHBondContact O-N 3.26Å; Q1298-E1327 VanDerWaalsContact O-CA 3.31Å; Q1298-E1327 WeakPolarHBondContact O-CA 3.21Å; Q1298-F1328 PolarHBondContact O-N 2.77Å
1299	S	85.5	Confident	78.3	Confident	15 Å²	15	26.6 Å²	26.6	11%	0.105	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	150.9	164.5	32.5	0	0	0	0	110.3	R1289 V1326 D2656	R1289-S1299 PolarHBondContact NH1-OG 3.17Å; S1299-V1326 CarbonylContact C-O 3.59Å; S1299-V1326 WeakPolarHBondContact CA-O 3.44Å; S1299-V1326 WeakPolarHBondContact CB-O 3.47Å; S1299-D2656 PolarHBondContact OG-OD2 2.87Å
1300	L	89.1	Confident	79.8	Confident	6 Å²	6	29.4 Å²	29.4	3%	0.031	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	136.8	163.8	-166.9	68.7	0	0	0	108.6	F1302 T1325 V1326 F1328 V1437 L1440 D1441	L1300-F1302 HydrophobicContact CB-CD1 4.36Å; L1300-F1302 HydrophobicContact CD2-CD1 3.93Å; L1300-F1302 HydrophobicContact CG-CD1 4.11Å; L1300-T1325 WeakPolarHBondContact O-CA 3.33Å; L1300-V1326 PolarHBondContact N-O 2.9Å; L1300-V1326 PolarHBondContact O-N 3.31Å; L1300-F1328 HydrophobicContact CB-CE1 3.99Å; L1300-F1328 HydrophobicContact CB-CZ 4.25Å; L1300-V1437 HydrophobicContact CB-CG1 3.45Å; L1300-V1437 VanDerWaalsContact CB-CG1 3.45Å; L1300-V1437 HydrophobicContact CD2-CG1 3.97Å; L1300-V1437 HydrophobicContact CG-CG1 4.34Å; L1300-L1440 HydrophobicContact CD2-CB 4.11Å; L1300-D1441 HydrophobicContact CD1-CB 4.15Å; L1300-D1441 HydrophobicContact CD2-CB 4.16Å
1301	S	88.9	Confident	80.9	Confident	4 Å²	4	27.6 Å²	27.6	3%	0.028	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	120	168.6	-64.7	0	0	0	0	108.7	T1325 D2656	S1301-T1325 PolarHBondContact OG-OG1 3.33Å; S1301-D2656 PolarHBondContact OG-OD1 2.91Å
1302	F	91.5	Very high	81.3	Confident	12 Å²	12	32.3 Å²	32.3	5%	0.053	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	149.5	-179.3	57.9	-92	0	0	0	111.5	L1300 A1304 I1323 A1324 V1326 F1366 I1367 V1437	L1300-F1302 HydrophobicContact CB-CD1 4.36Å; L1300-F1302 HydrophobicContact CD2-CD1 3.93Å; L1300-F1302 HydrophobicContact CG-CD1 4.11Å; F1302-A1304 HydrophobicContact CD2-CB 4.34Å; F1302-A1304 HydrophobicContact CE2-CB 4.23Å; F1302-I1323 WeakPolarHBondContact O-CA 3.41Å; F1302-A1324 HydrophobicContact CD2-CB 4.47Å; F1302-A1324 HydrophobicContact CE2-CB 3.91Å; F1302-A1324 HydrophobicContact CZ-CB 3.95Å; F1302-A1324 PolarHBondContact N-O 3.32Å; F1302-A1324 VanDerWaalsContact N-O 3.11Å; F1302-A1324 PolarHBondContact O-N 2.97Å; F1302-V1326 HydrophobicContact CE1-CB 4.49Å; F1302-V1326 HydrophobicContact CE1-CG2 4.22Å; F1302-V1326 HydrophobicContact CZ-CG2 4.27Å; F1302-F1366 HydrophobicContact CD2-CB 4.39Å; F1302-F1366 AromaticContact CD2-CD1 3.88Å; F1302-F1366 HydrophobicContact CD2-CD1 3.88Å; F1302-F1366 AromaticContact CE2-CD1 3.66Å; F1302-F1366 HydrophobicContact CE2-CD1 3.66Å; F1302-F1366 HydrophobicContact CE2-CE1 4.22Å; F1302-F1366 HydrophobicContact CZ-CD1 4.44Å; F1302-I1367 WeakPolarHBondContact CA-O 3.46Å; F1302-V1437 HydrophobicContact CE1-CG1 4Å; F1302-V1437 HydrophobicContact CE1-CG2 4.1Å; F1302-V1437 HydrophobicContact CZ-CG2 4.44Å
1303	L	91.9	Very high	81.4	Confident	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	123	169.7	-176	71.4	0	0	0	109	I1305 P1321 I1323 F1366 I1367 Y2553 P2648 L2650	L1303-I1305 HydrophobicContact CD2-CD1 4.07Å; L1303-I1305 HydrophobicContact CD2-CG1 4.4Å; L1303-I1305 HydrophobicContact CG-CD1 4.47Å; L1303-I1305 HydrophobicContact CG-CG1 4.26Å; L1303-P1321 HydrophobicContact CD1-CB 3.81Å; L1303-P1321 HydrophobicContact CD2-CB 4.5Å; L1303-P1321 HydrophobicContact CG-CB 4.35Å; L1303-I1323 HydrophobicContact CD1-CG1 3.59Å; L1303-F1366 WeakPolarHBondContact O-CA 3.45Å; L1303-I1367 HydrophobicContact CB-CB 4.31Å; L1303-I1367 HydrophobicContact CB-CD1 4.41Å; L1303-I1367 HydrophobicContact CD2-CD1 4.09Å; L1303-I1367 HydrophobicContact CG-CD1 4.3Å; L1303-I1367 PolarHBondContact N-O 3.5Å; L1303-I1367 PolarHBondContact O-N 2.53Å; L1303-Y2553 HydrophobicContact CD2-CD1 4.32Å; L1303-Y2553 HydrophobicContact CD2-CE1 3.82Å; L1303-P2648 HydrophobicContact CD2-CB 4.19Å; L1303-L2650 HydrophobicContact CB-CD1 4.39Å
1304	A	90.1	Very high	81.2	Confident	20 Å²	20	38.5 Å²	38.5	17%	0.165	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103	125.5	176	0	0	0	0	0	110.6	F1302 L1322 R1365	F1302-A1304 HydrophobicContact CD2-CB 4.34Å; F1302-A1304 HydrophobicContact CE2-CB 4.23Å; A1304-L1322 PolarHBondContact N-O 3.38Å; A1304-L1322 PolarHBondContact O-N 2.94Å; A1304-R1365 WeakPolarHBondContact CA-O 3.37Å
1305	I	87.7	Confident	80.6	Confident	22 Å²	22	40 Å²	40	11%	0.113	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	139.2	176	-55.2	-177.7	0	0	0	109	L1303 F1307 P1317 P1321 Q1364 R1365 I1367	L1303-I1305 HydrophobicContact CD2-CD1 4.07Å; L1303-I1305 HydrophobicContact CD2-CG1 4.4Å; L1303-I1305 HydrophobicContact CG-CD1 4.47Å; L1303-I1305 HydrophobicContact CG-CG1 4.26Å; I1305-F1307 HydrophobicContact CG2-CD1 4.4Å; I1305-P1317 HydrophobicContact CG2-CB 3.79Å; I1305-P1317 HydrophobicContact CG2-CG 4.5Å; I1305-P1321 HydrophobicContact CD1-CB 4.2Å; I1305-P1321 HydrophobicContact CD1-CG 4.16Å; I1305-P1321 HydrophobicContact CG1-CB 3.93Å; I1305-P1321 HydrophobicContact CG1-CG 4.17Å; I1305-Q1364 CarbonylContact O-C 3.46Å; I1305-Q1364 WeakPolarHBondContact O-CA 3.31Å; I1305-R1365 PolarHBondContact N-O 3.34Å; I1305-R1365 PolarHBondContact O-N 3.48Å; I1305-I1367 HydrophobicContact CB-CD1 4.41Å; I1305-I1367 HydrophobicContact CD1-CD1 3.55Å; I1305-I1367 HydrophobicContact CG1-CD1 3.77Å
1306	L	87.5	Confident	80.3	Confident	10 Å²	10	42.5 Å²	42.5	5%	0.052	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129	117.3	178	-175.7	65.7	0	0	0	109.6	C1318 V1319 R1351 M1359 H1362 Q1364	L1306-C1318 WeakPolarHBondContact O-CB 3.09Å; L1306-C1318 PolarHBondContact O-N 3.48Å; L1306-V1319 HydrophobicContact CB-CB 4.15Å; L1306-V1319 HydrophobicContact CB-CG2 4.26Å; L1306-V1319 HydrophobicContact CD2-CG2 3.8Å; L1306-V1319 PolarHBondContact O-N 3.32Å; L1306-V1319 VanDerWaalsContact O-N 3.15Å; L1306-R1351 HydrophobicContact CD2-CG 4.34Å; L1306-M1359 HydrophobicContact CD1-CE 4.1Å; L1306-M1359 HydrophobicContact CD2-CE 3.78Å; L1306-M1359 HydrophobicContact CD2-SD 4.06Å; L1306-M1359 HydrophobicContact CG-CE 4.2Å; L1306-H1362 HydrophobicContact CD1-CB 3.95Å; L1306-Q1364 HydrophobicContact CD1-CB 3.79Å; L1306-Q1364 HydrophobicContact CD1-CG 4.12Å
1307	F	84.6	Confident	80.7	Confident	27 Å²	27	44.1 Å²	44.1	12%	0.118	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	165.8	-176	71.5	-77.9	0	0	0	111.8	I1305 P1317 H1362 I1363 R1365	I1305-F1307 HydrophobicContact CG2-CD1 4.4Å; F1307-P1317 HydrophobicContact CB-CB 4.33Å; F1307-H1362 WeakPolarHBondContact O-CA 2.91Å; F1307-I1363 HydrophobicContact CD1-CB 4.19Å; F1307-I1363 HydrophobicContact CD1-CG2 4.42Å; F1307-I1363 WeakPolarHBondContact CD1-O 3.41Å; F1307-I1363 HydrophobicContact CE1-CB 3.67Å; F1307-I1363 HydrophobicContact CE1-CG2 3.52Å; F1307-I1363 HydrophobicContact CE2-CB 4.21Å; F1307-I1363 HydrophobicContact CE2-CD1 4.02Å; F1307-I1363 HydrophobicContact CZ-CB 3.69Å; F1307-I1363 HydrophobicContact CZ-CD1 3.89Å; F1307-I1363 HydrophobicContact CZ-CG1 4.35Å; F1307-I1363 HydrophobicContact CZ-CG2 3.63Å; F1307-I1363 PolarHBondContact N-O 2.84Å; F1307-I1363 PolarHBondContact O-N 3.23Å; F1307-R1365 HydrophobicContact CE1-CG 4.07Å
1308	T	83.6	Confident	80.8	Confident	9 Å²	9	43.9 Å²	43.9	6%	0.055	22%	0.223	C	C	.	.			trans	-149.7	146.7	167.5	177.3	0	0	0	0	109.7	K1310 C1311 V1357 D1361	T1308-K1310 HydrophobicContact CG2-CB 4.48Å; T1308-K1310 PolarHBondContact O-N 2.99Å; T1308-K1310 PolarHBondContact OG1-N 3.41Å; T1308-C1311 HydrophobicContact CG2-CB 3.65Å; T1308-C1311 PolarHBondContact O-N 3.42Å; T1308-V1357 HydrophobicContact CG2-CB 4.23Å; T1308-V1357 HydrophobicContact CG2-CG1 4.04Å; T1308-V1357 HydrophobicContact CG2-CG2 4.45Å; T1308-D1361 WeakPolarHBondContact CB-O 3.45Å; T1308-D1361 PolarHBondContact OG1-O 2.99Å
1309	T	77.6	Confident	80.8	Confident	104 Å²	104	45.5 Å²	45.5	64%	0.638	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-16.7	173.7	50	0	0	0	0	113
1310	K	80.5	Confident	80.1	Confident	124 Å²	124	49.4 Å²	49.4	54%	0.539	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	1.6	-178.5	-68.1	171.1	168.7	176.1	0	114.7	T1308 V1357 D1361	T1308-K1310 HydrophobicContact CG2-CB 4.48Å; T1308-K1310 PolarHBondContact O-N 2.99Å; T1308-K1310 PolarHBondContact OG1-N 3.41Å; K1310-V1357 HydrophobicContact CB-CG1 4.22Å; K1310-V1357 HydrophobicContact CB-CG2 3.95Å; K1310-V1357 HydrophobicContact CD-CG1 4.49Å; K1310-D1361 HydrophobicContact CD-CB 4.09Å; K1310-D1361 WeakPolarHBondContact CD-OD2 3.11Å; K1310-D1361 IonicContact NZ-OD1 3.45Å; K1310-D1361 PolarHBondContact NZ-OD1 3.09Å; K1310-D1361 IonicContact NZ-OD2 3.94Å; K1310-D1361 PolarHBondContact NZ-OD2 3.04Å
1311	C	76.7	Confident	79.8	Confident	10 Å²	10	52.2 Å²	52.2	7%	0.068	28%	0.277	C	S	.	.			trans	-88.4	134.9	-175.5	-168.5	0	0	0	0	112.1	T1308 M1313 R1314 C1318	T1308-C1311 HydrophobicContact CG2-CB 3.65Å; T1308-C1311 PolarHBondContact O-N 3.42Å; C1311-M1313 PolarHBondContact O-N 2.78Å; C1311-M1313 VanDerWaalsContact O-N 3.1Å; C1311-R1314 PolarHBondContact O-N 2.81Å; C1311-C1318 VanDerWaalsContact CB-SG 3.51Å; C1311-C1318 VanDerWaalsContact SG-SG 3.64Å
1312	I	71.4	Confident	79.5	Confident	152 Å²	152	57.2 Å²	57.2	78%	0.779	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-6.4	175.2	-157.3	169	0	0	0	113.9
1313	M	65.7	Low	79.3	Confident	66 Å²	66	58.9 Å²	58.9	33%	0.325	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.5	-5.1	174.5	-53.6	-81.2	78.5	0	0	113.6	C1311 E1316 L1354	C1311-M1313 PolarHBondContact O-N 2.78Å; C1311-M1313 VanDerWaalsContact O-N 3.1Å; M1313-E1316 WeakPolarHBondContact O-CB 3.48Å; M1313-E1316 PolarHBondContact O-N 2.93Å; M1313-L1354 HydrophobicContact SD-CB 4.48Å; M1313-L1354 HydrophobicContact SD-CD1 4.17Å
1314	R	64.4	Low	78.9	Confident	139 Å²	139	59.9 Å²	59.9	53%	0.525	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	131.6	177.9	-177.2	-176.6	172.5	95.8	1.5	110	C1311 I2548	C1311-R1314 PolarHBondContact O-N 2.81Å; R1314-I2548 HydrophobicContact CG-CD1 4.13Å; R1314-I2548 VanDerWaalsContact CZ-CD1 3.47Å
1315	P	65.2	Low	78.8	Confident	34 Å²	34	61.5 Å²	61.5	22%	0.221	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	cis	-81.6	-9.4	13.8	34.4	-39.5	0	0	0	116.3	L2544 I2548	P1315-L2544 HydrophobicContact CB-CB 4.33Å; P1315-L2544 HydrophobicContact CG-CB 3.98Å; P1315-L2544 HydrophobicContact CG-CD1 3.96Å; P1315-I2548 HydrophobicContact CB-CD1 3.86Å; P1315-I2548 HydrophobicContact CB-CG1 4.24Å
1316	E	72.4	Confident	78.8	Confident	111 Å²	111	61.1 Å²	61.1	52%	0.519	33%	0.327	S	S	.	.	S	Bend	trans	-69.5	143.7	-174	-59.9	-167.2	159.5	0	0	112.8	M1313	M1313-E1316 WeakPolarHBondContact O-CB 3.48Å; M1313-E1316 PolarHBondContact O-N 2.93Å
1317	P	79.2	Confident	78.7	Confident	44 Å²	44	64.3 Å²	64.3	29%	0.286	34%	0.342	S	S	.	.			trans	-68.4	142.1	175.2	29.9	-34.9	0	0	0	110.5	I1305 F1307 V1319 P1321	I1305-P1317 HydrophobicContact CG2-CB 3.79Å; I1305-P1317 HydrophobicContact CG2-CG 4.5Å; F1307-P1317 HydrophobicContact CB-CB 4.33Å; P1317-V1319 PolarHBondContact O-N 3Å; P1317-V1319 VanDerWaalsContact O-N 3.12Å; P1317-P1321 HydrophobicContact CG-CG 4.35Å
1318	C	81.9	Confident	79	Confident	2 Å²	2	63.5 Å²	63.5	1%	0.014	34%	0.338	C	S	.	.	S	Bend	trans	-58.3	-31.4	-176.2	-54.7	0	0	0	0	112.9	L1306 C1311 N1352	L1306-C1318 WeakPolarHBondContact O-CB 3.09Å; L1306-C1318 PolarHBondContact O-N 3.48Å; C1311-C1318 VanDerWaalsContact CB-SG 3.51Å; C1311-C1318 VanDerWaalsContact SG-SG 3.64Å; C1318-N1352 WeakPolarHBondContact O-CB 3.46Å; C1318-N1352 PolarHBondContact O-ND2 3.05Å
1319	V	81	Confident	79.2	Confident	41 Å²	41	63.3 Å²	63.3	25%	0.248	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	131.8	165.4	-179.8	0	0	0	0	108	L1306 P1317 R1351 N1352	L1306-V1319 HydrophobicContact CB-CB 4.15Å; L1306-V1319 HydrophobicContact CB-CG2 4.26Å; L1306-V1319 HydrophobicContact CD2-CG2 3.8Å; L1306-V1319 PolarHBondContact O-N 3.32Å; L1306-V1319 VanDerWaalsContact O-N 3.15Å; P1317-V1319 PolarHBondContact O-N 3Å; P1317-V1319 VanDerWaalsContact O-N 3.12Å; V1319-R1351 HydrophobicContact CG2-CB 4Å; V1319-N1352 HydrophobicContact CG2-CB 4.43Å
1320	P	72.4	Confident	79.4	Confident	97 Å²	97	59.2 Å²	59.2	63%	0.63	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-52.6	145.3	176.6	-28.9	35.8	0	0	0	112.7	L1322	P1320-L1322 PolarHBondContact O-N 3.14Å
1321	P	82.1	Confident	79.3	Confident	64 Å²	64	59.1 Å²	59.1	42%	0.416	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.6	122.4	-179.4	-25.1	35.2	0	0	0	112	L1303 I1305 P1317	L1303-P1321 HydrophobicContact CD1-CB 3.81Å; L1303-P1321 HydrophobicContact CD2-CB 4.5Å; L1303-P1321 HydrophobicContact CG-CB 4.35Å; I1305-P1321 HydrophobicContact CD1-CB 4.2Å; I1305-P1321 HydrophobicContact CD1-CG 4.16Å; I1305-P1321 HydrophobicContact CG1-CB 3.93Å; I1305-P1321 HydrophobicContact CG1-CG 4.17Å; P1317-P1321 HydrophobicContact CG-CG 4.35Å
1322	L	81.8	Confident	79.5	Confident	109 Å²	109	63 Å²	63	57%	0.571	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-118.1	118.6	-176	176.6	63.2	0	0	0	110.4	A1304 P1320	A1304-L1322 PolarHBondContact N-O 3.38Å; A1304-L1322 PolarHBondContact O-N 2.94Å; P1320-L1322 PolarHBondContact O-N 3.14Å
1323	I	86.9	Confident	80.5	Confident	47 Å²	47	56.3 Å²	56.3	24%	0.241	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	127	167.7	-62.6	176.8	0	0	0	108.5	F1302 L1303 L2649 P2651 Y2655	F1302-I1323 WeakPolarHBondContact O-CA 3.41Å; L1303-I1323 HydrophobicContact CD1-CG1 3.59Å; I1323-L2649 HydrophobicContact CD1-CB 4.2Å; I1323-L2649 HydrophobicContact CD1-CD2 3.73Å; I1323-L2649 HydrophobicContact CD1-CG 4.43Å; I1323-P2651 HydrophobicContact CG2-CB 4.35Å; I1323-P2651 HydrophobicContact CG2-CG 4.17Å; I1323-Y2655 HydrophobicContact CD1-CE2 4.37Å; I1323-Y2655 HydrophobicContact CG2-CD1 4.33Å; I1323-Y2655 HydrophobicContact CG2-CE1 3.9Å
1324	A	85.2	Confident	81.6	Confident	25 Å²	25	55 Å²	55	21%	0.207	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	115.1	176.6	0	0	0	0	0	110.2	F1302 V1326	F1302-A1324 HydrophobicContact CD2-CB 4.47Å; F1302-A1324 HydrophobicContact CE2-CB 3.91Å; F1302-A1324 HydrophobicContact CZ-CB 3.95Å; F1302-A1324 PolarHBondContact N-O 3.32Å; F1302-A1324 VanDerWaalsContact N-O 3.11Å; F1302-A1324 PolarHBondContact O-N 2.97Å; A1324-V1326 HydrophobicContact CB-CG2 4.45Å
1325	T	86.5	Confident	82.9	Confident	55 Å²	55	48.7 Å²	48.7	34%	0.337	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	123.5	160.6	-56.7	0	0	0	0	108.5	L1300 S1301 D2656	L1300-T1325 WeakPolarHBondContact O-CA 3.33Å; S1301-T1325 PolarHBondContact OG-OG1 3.33Å; T1325-D2656 WeakPolarHBondContact CB-OD1 3.47Å; T1325-D2656 VanDerWaalsContact CG2-CG 3.48Å; T1325-D2656 WeakPolarHBondContact CG2-OD1 3.46Å; T1325-D2656 WeakPolarHBondContact CG2-OD2 3.39Å; T1325-D2656 PolarHBondContact OG1-OD1 3.1Å
1326	V	88.2	Confident	84.2	Confident	14 Å²	14	47.1 Å²	47.1	9%	0.085	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	124.6	174.9	-178.4	0	0	0	0	110.4	S1299 L1300 F1302 A1324 D1333 V1437	S1299-V1326 CarbonylContact C-O 3.59Å; S1299-V1326 WeakPolarHBondContact CA-O 3.44Å; S1299-V1326 WeakPolarHBondContact CB-O 3.47Å; L1300-V1326 PolarHBondContact N-O 2.9Å; L1300-V1326 PolarHBondContact O-N 3.31Å; F1302-V1326 HydrophobicContact CE1-CB 4.49Å; F1302-V1326 HydrophobicContact CE1-CG2 4.22Å; F1302-V1326 HydrophobicContact CZ-CG2 4.27Å; A1324-V1326 HydrophobicContact CB-CG2 4.45Å; V1326-D1333 HydrophobicContact CG1-CB 3.65Å; V1326-V1437 HydrophobicContact CB-CB 4.48Å; V1326-V1437 HydrophobicContact CB-CG1 4.18Å; V1326-V1437 HydrophobicContact CB-CG2 3.93Å; V1326-V1437 HydrophobicContact CG1-CB 4.34Å; V1326-V1437 HydrophobicContact CG1-CG2 3.78Å; V1326-V1437 HydrophobicContact CG2-CG2 4.41Å
1327	E	86.6	Confident	85.1	Confident	76 Å²	76	41.8 Å²	41.8	36%	0.355	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.1	130.5	172.1	-68.1	-171.9	-163.4	0	0	111.3	R1289 Q1298 Y1329 G1330	R1289-E1327 IonicContact CZ-OE1 2.75Å; R1289-E1327 IonicContact NH1-OE1 3.57Å; R1289-E1327 VanDerWaalsContact NH2-CD 3.34Å; R1289-E1327 IonicContact NH2-OE1 3.3Å; R1289-E1327 PolarHBondContact NH2-OE1 2.89Å; Q1298-E1327 VanDerWaalsContact O-CA 3.31Å; Q1298-E1327 WeakPolarHBondContact O-CA 3.21Å; E1327-Y1329 PolarHBondContact O-N 2.81Å; E1327-G1330 WeakPolarHBondContact O-CA 3.02Å; E1327-G1330 PolarHBondContact O-N 3.11Å
1328	F	89.5	Confident	85.5	Confident	10 Å²	10	40.3 Å²	40.3	4%	0.044	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	125.9	177.6	-51.1	-57.1	0	0	0	110.5	R958 Y1297 Q1298 L1300 G1330 V1437 K1438 D1441	R958-F1328 PolarHBondContact NH2-O 3.14Å; Y1297-F1328 WeakPolarHBondContact O-CE2 3.44Å; Q1298-F1328 PolarHBondContact O-N 2.77Å; L1300-F1328 HydrophobicContact CB-CE1 3.99Å; L1300-F1328 HydrophobicContact CB-CZ 4.25Å; F1328-G1330 PolarHBondContact O-N 3.16Å; F1328-V1437 HydrophobicContact CD1-CB 4.34Å; F1328-V1437 HydrophobicContact CD1-CG1 4.07Å; F1328-V1437 HydrophobicContact CE1-CG1 3.95Å; F1328-K1438 HydrophobicContact CD1-CB 3.79Å; F1328-K1438 HydrophobicContact CD1-CD 4.43Å; F1328-K1438 HydrophobicContact CE1-CB 4.15Å; F1328-K1438 HydrophobicContact CE1-CD 4.24Å; F1328-K1438 HydrophobicContact CG-CB 4.34Å; F1328-K1438 HydrophobicContact CZ-CD 4.29Å; F1328-D1441 HydrophobicContact CE1-CB 3.91Å; F1328-D1441 HydrophobicContact CZ-CB 3.94Å
1329	Y	87.8	Confident	86	Confident	6 Å²	6	40.7 Å²	40.7	2%	0.024	25%	0.25	C	C	.	.	T	Hydrogen-bonded Turn	trans	66	7.4	-175	-38.1	-79.8	0	0	0	115.2	M730 D731 N962 L965 E1327 D1333 S1435	M730-Y1329 HydrophobicContact CE-CD1 3.83Å; M730-Y1329 HydrophobicContact CE-CG 4.44Å; M730-Y1329 HydrophobicContact CG-CD1 3.87Å; M730-Y1329 HydrophobicContact SD-CD1 4.07Å; D731-Y1329 VanDerWaalsContact CB-O 3.3Å; D731-Y1329 WeakPolarHBondContact CB-O 3.36Å; D731-Y1329 PolarHBondContact N-O 2.8Å; N962-Y1329 HydrophobicContact CB-CE2 4.11Å; N962-Y1329 WeakPolarHBondContact OD1-CE2 3.27Å; N962-Y1329 PolarHBondContact OD1-OH 3.31Å; L965-Y1329 HydrophobicContact CD1-CD1 4.32Å; L965-Y1329 HydrophobicContact CD1-CE1 3.49Å; L965-Y1329 VanDerWaalsContact CD1-CE1 3.49Å; E1327-Y1329 PolarHBondContact O-N 2.81Å; Y1329-D1333 PolarHBondContact N-OD2 3.09Å; Y1329-S1435 VanDerWaalsContact CE1-CB 3.44Å
1330	G	83.2	Confident	86.4	Confident	18 Å²	18	38.7 Å²	38.7	19%	0.186	24%	0.238	C	C	.	.	S	Bend	trans	-73.9	177.4	176.6	0	0	0	0	0	114.1	E1327 F1328 S1332 D1333	E1327-G1330 WeakPolarHBondContact O-CA 3.02Å; E1327-G1330 PolarHBondContact O-N 3.11Å; F1328-G1330 PolarHBondContact O-N 3.16Å; G1330-S1332 PolarHBondContact O-N 3.47Å; G1330-D1333 WeakPolarHBondContact O-CB 3.33Å; G1330-D1333 PolarHBondContact O-N 3Å; G1330-D1333 VanDerWaalsContact O-N 3.15Å
1331	S	77.3	Confident	87.1	Confident	121 Å²	121	36.3 Å²	36.3	85%	0.846	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-68.1	-17.8	-176	55.2	0	0	0	0	115.2
1332	S	81.7	Confident	87.1	Confident	92 Å²	92	35.1 Å²	35.1	64%	0.643	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-96.2	-6	176.9	-51.8	0	0	0	0	113	G1330	G1330-S1332 PolarHBondContact O-N 3.47Å
1333	D	90.8	Very high	87.3	Confident	11 Å²	11	32.9 Å²	32.9	6%	0.059	19%	0.192	C	C	.	.			trans	-92.9	164.9	-178.8	-168.4	18.2	0	0	0	111.1	M730 V1326 Y1329 G1330 S1435 V1437	M730-D1333 HydrophobicContact CE-CB 4.1Å; M730-D1333 WeakPolarHBondContact CE-OD2 3.37Å; V1326-D1333 HydrophobicContact CG1-CB 3.65Å; Y1329-D1333 PolarHBondContact N-OD2 3.09Å; G1330-D1333 WeakPolarHBondContact O-CB 3.33Å; G1330-D1333 PolarHBondContact O-N 3Å; G1330-D1333 VanDerWaalsContact O-N 3.15Å; D1333-S1435 PolarHBondContact OD1-OG 2.98Å; D1333-S1435 WeakPolarHBondContact OD2-CB 3.44Å; D1333-S1435 PolarHBondContact OD2-OG 3.09Å; D1333-V1437 WeakPolarHBondContact OD1-CG2 3.48Å; D1333-V1437 PolarHBondContact OD1-N 3.3Å
1334	L	89.5	Confident	87.2	Confident	40 Å²	40	30.8 Å²	30.8	21%	0.209	18%	0.182	C	C	.	.			trans	-135.3	146.6	178.8	-65.9	173.6	0	0	0	110.8	L1336 L1338 F1343 F1436	L1334-L1336 PolarHBondContact O-N 2.74Å; L1334-L1338 HydrophobicContact CD2-CD2 4.12Å; L1334-F1343 HydrophobicContact CD1-CD2 4.45Å; L1334-F1343 HydrophobicContact CD1-CE2 3.62Å; L1334-F1343 HydrophobicContact CD1-CZ 4.48Å; L1334-F1436 WeakPolarHBondContact O-CB 3.26Å; L1334-F1436 PolarHBondContact O-N 3.47Å
1335	P	91.5	Very high	87.3	Confident	6 Å²	6	30.4 Å²	30.4	4%	0.039	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-55.9	138.4	164.8	-19.2	28.2	0	0	0	110.5	L681 M730 G1337 L1338 F1339 W1432 L1434	L681-P1335 HydrophobicContact CD1-CB 4.41Å; L681-P1335 HydrophobicContact CD1-CG 3.37Å; M730-P1335 HydrophobicContact SD-CB 4Å; M730-P1335 HydrophobicContact SD-CG 3.57Å; M730-P1335 VanDerWaalsContact SD-CG 3.57Å; P1335-G1337 PolarHBondContact O-N 2.84Å; P1335-L1338 HydrophobicContact CB-CB 3.98Å; P1335-L1338 HydrophobicContact CG-CB 4Å; P1335-L1338 HydrophobicContact CG-CD2 4.4Å; P1335-L1338 PolarHBondContact O-N 2.95Å; P1335-F1339 PolarHBondContact O-N 3.39Å; P1335-W1432 HydrophobicContact CB-CE3 3.94Å; P1335-W1432 HydrophobicContact CB-CH2 4.38Å; P1335-W1432 HydrophobicContact CB-CZ3 3.69Å; P1335-W1432 WeakPolarHBondContact CB-O 3.1Å; P1335-W1432 HydrophobicContact CG-CH2 4.47Å; P1335-W1432 HydrophobicContact CG-CZ3 3.87Å; P1335-L1434 CarbonylContact C-O 3.6Å; P1335-L1434 WeakPolarHBondContact CA-O 3.41Å
1336	L	92.9	Very high	87	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-51.6	-43.4	176.4	175.7	59.6	0	0	0	111.3	L1334 F1339 L1340 L1434 F1436 F1439 F1510	L1334-L1336 PolarHBondContact O-N 2.74Å; L1336-F1339 PolarHBondContact O-N 2.88Å; L1336-L1340 HydrophobicContact CD1-CD1 4.13Å; L1336-L1340 HydrophobicContact CD1-CG 4.33Å; L1336-L1340 HydrophobicContact CG-CD1 4.11Å; L1336-L1340 WeakPolarHBondContact O-CB 3.48Å; L1336-L1340 VanDerWaalsContact O-CG 3.25Å; L1336-L1340 WeakPolarHBondContact O-CG 3.43Å; L1336-L1340 PolarHBondContact O-N 3.5Å; L1336-L1434 HydrophobicContact CD2-CD2 4.43Å; L1336-L1434 PolarHBondContact N-O 2.82Å; L1336-F1436 HydrophobicContact CD1-CD2 3.95Å; L1336-F1439 HydrophobicContact CD1-CD1 3.78Å; L1336-F1439 HydrophobicContact CD1-CE1 4.08Å; L1336-F1439 HydrophobicContact CD1-CG 4.07Å; L1336-F1439 HydrophobicContact CD2-CB 4.38Å; L1336-F1439 HydrophobicContact CD2-CD2 4.06Å; L1336-F1439 HydrophobicContact CD2-CG 4.1Å; L1336-F1510 HydrophobicContact CD2-CE1 4.1Å; L1336-F1510 HydrophobicContact CD2-CZ 4.09Å
1337	G	90.4	Very high	86.1	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-41	176.1	0	0	0	0	0	113.9	P1335 L1340 E1341 W1432	P1335-G1337 PolarHBondContact O-N 2.84Å; G1337-L1340 PolarHBondContact O-N 3.35Å; G1337-E1341 WeakPolarHBondContact O-CB 3.42Å; G1337-E1341 VanDerWaalsContact O-CG 3.3Å; G1337-E1341 WeakPolarHBondContact O-CG 3.4Å; G1337-E1341 PolarHBondContact O-N 3.24Å; G1337-W1432 PolarHBondContact N-O 2.93Å; G1337-W1432 VanDerWaalsContact N-O 3.09Å
1338	L	88	Confident	85.4	Confident	12 Å²	12	37.9 Å²	37.9	6%	0.063	21%	0.207	C	C	.	.	H	α-helix	trans	-69.8	-35.3	176.6	-175.8	60	0	0	0	112.1	Y727 L1334 P1335 K1342 W1432	Y727-L1338 HydrophobicContact CD1-CD2 3.79Å; Y727-L1338 HydrophobicContact CE1-CD1 4.17Å; Y727-L1338 HydrophobicContact CE1-CD2 3.65Å; Y727-L1338 HydrophobicContact CG-CD2 4.49Å; L1334-L1338 HydrophobicContact CD2-CD2 4.12Å; P1335-L1338 HydrophobicContact CB-CB 3.98Å; P1335-L1338 HydrophobicContact CG-CB 4Å; P1335-L1338 HydrophobicContact CG-CD2 4.4Å; P1335-L1338 PolarHBondContact O-N 2.95Å; L1338-K1342 WeakPolarHBondContact O-CB 3.39Å; L1338-K1342 PolarHBondContact O-N 3.44Å; L1338-W1432 HydrophobicContact CB-CH2 3.78Å; L1338-W1432 HydrophobicContact CB-CZ2 4.04Å; L1338-W1432 HydrophobicContact CB-CZ3 4.45Å
1339	F	91.7	Very high	84.9	Confident	10 Å²	10	44.4 Å²	44.4	4%	0.044	24%	0.237	C	C	.	.	H	α-helix	trans	-61.7	-51.9	173.5	177.1	-87.6	0	0	0	110.5	P1335 L1336 E1341 K1342 F1343 F1366 L1375 F1436 F1519	P1335-F1339 PolarHBondContact O-N 3.39Å; L1336-F1339 PolarHBondContact O-N 2.88Å; F1339-E1341 PolarHBondContact O-N 2.9Å; F1339-K1342 PolarHBondContact O-N 3.49Å; F1339-F1343 AromaticContact CD2-CD2 3.73Å; F1339-F1343 HydrophobicContact CD2-CD2 3.73Å; F1339-F1343 HydrophobicContact CD2-CE2 4.32Å; F1339-F1343 HydrophobicContact CD2-CG 4.48Å; F1339-F1343 HydrophobicContact CE2-CB 4.39Å; F1339-F1343 AromaticContact CE2-CD2 3.99Å; F1339-F1343 HydrophobicContact CE2-CD2 3.99Å; F1339-F1343 HydrophobicContact CE2-CG 4.34Å; F1339-F1343 HydrophobicContact CG-CD2 4.31Å; F1339-F1343 HydrophobicContact CZ-CB 4.39Å; F1339-F1343 WeakPolarHBondContact O-CB 2.92Å; F1339-F1343 PolarHBondContact O-N 2.94Å; F1339-F1366 HydrophobicContact CZ-CZ 4.25Å; F1339-L1375 HydrophobicContact CE1-CD2 3.84Å; F1339-L1375 HydrophobicContact CZ-CD2 3.89Å; F1339-F1436 HydrophobicContact CB-CB 4.27Å; F1339-F1436 HydrophobicContact CB-CD2 4.1Å; F1339-F1436 HydrophobicContact CB-CG 4.12Å; F1339-F1436 AromaticContact CD1-CD2 3.68Å; F1339-F1436 HydrophobicContact CD1-CD2 3.68Å; F1339-F1436 AromaticContact CD1-CE2 3.59Å; F1339-F1436 HydrophobicContact CD1-CE2 3.59Å; F1339-F1436 HydrophobicContact CD1-CG 4.32Å; F1339-F1436 HydrophobicContact CD1-CZ 4.15Å; F1339-F1436 AromaticContact CD2-CD1 3.88Å; F1339-F1436 HydrophobicContact CD2-CD1 3.88Å; F1339-F1436 HydrophobicContact CD2-CD2 4.13Å; F1339-F1436 AromaticContact CD2-CE1 3.98Å; F1339-F1436 HydrophobicContact CD2-CE1 3.98Å; F1339-F1436 HydrophobicContact CD2-CE2 4.24Å; F1339-F1436 AromaticContact CD2-CG 3.97Å; F1339-F1436 HydrophobicContact CD2-CG 3.97Å; F1339-F1436 HydrophobicContact CD2-CZ 4.17Å; F1339-F1436 HydrophobicContact CE1-CD2 4.15Å; F1339-F1436 AromaticContact CE1-CE2 3.57Å; F1339-F1436 HydrophobicContact CE1-CE2 3.57Å; F1339-F1436 AromaticContact CE1-CZ 3.8Å; F1339-F1436 HydrophobicContact CE1-CZ 3.8Å; F1339-F1436 HydrophobicContact CE2-CD1 4.14Å; F1339-F1436 AromaticContact CE2-CE1 3.75Å; F1339-F1436 HydrophobicContact CE2-CE1 3.75Å; F1339-F1436 HydrophobicContact CE2-CE2 4.22Å; F1339-F1436 AromaticContact CE2-CZ 3.8Å; F1339-F1436 HydrophobicContact CE2-CZ 3.8Å; F1339-F1436 HydrophobicContact CG-CD1 4.25Å; F1339-F1436 AromaticContact CG-CD2 3.68Å; F1339-F1436 HydrophobicContact CG-CD2 3.68Å; F1339-F1436 HydrophobicContact CG-CE1 4.48Å; F1339-F1436 AromaticContact CG-CE2 3.95Å; F1339-F1436 HydrophobicContact CG-CE2 3.95Å; F1339-F1436 AromaticContact CG-CG 3.86Å; F1339-F1436 HydrophobicContact CG-CG 3.86Å; F1339-F1436 HydrophobicContact CG-CZ 4.34Å; F1339-F1436 HydrophobicContact CZ-CE1 4.06Å; F1339-F1436 AromaticContact CZ-CE2 3.9Å; F1339-F1436 HydrophobicContact CZ-CE2 3.9Å; F1339-F1436 AromaticContact CZ-CZ 3.61Å; F1339-F1436 HydrophobicContact CZ-CZ 3.61Å; F1339-F1519 HydrophobicContact CD1-CZ 4.42Å; F1339-F1519 HydrophobicContact CE1-CE1 4.42Å; F1339-F1519 AromaticContact CE1-CZ 3.99Å; F1339-F1519 HydrophobicContact CE1-CZ 3.99Å
1340	L	91.1	Very high	84.6	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	24%	0.24	C	C	.	.	I	π-helix	trans	-56.8	-49.3	177.3	-73.8	168.1	0	0	0	111.8	L1336 G1337 C1344 F1345 I1409 M1427 F1510 A1517 F1519	L1336-L1340 HydrophobicContact CD1-CD1 4.13Å; L1336-L1340 HydrophobicContact CD1-CG 4.33Å; L1336-L1340 HydrophobicContact CG-CD1 4.11Å; L1336-L1340 WeakPolarHBondContact O-CB 3.48Å; L1336-L1340 VanDerWaalsContact O-CG 3.25Å; L1336-L1340 WeakPolarHBondContact O-CG 3.43Å; L1336-L1340 PolarHBondContact O-N 3.5Å; G1337-L1340 PolarHBondContact O-N 3.35Å; L1340-C1344 HydrophobicContact CD2-CB 4.38Å; L1340-C1344 WeakPolarHBondContact O-CA 3.15Å; L1340-C1344 WeakPolarHBondContact O-CB 3.13Å; L1340-C1344 PolarHBondContact O-N 3.45Å; L1340-C1344 VanDerWaalsContact O-N 3.09Å; L1340-F1345 HydrophobicContact CB-CD2 4.16Å; L1340-F1345 HydrophobicContact CB-CE2 3.7Å; L1340-F1345 HydrophobicContact CB-CZ 4.37Å; L1340-F1345 HydrophobicContact CD2-CE2 4.42Å; L1340-F1345 HydrophobicContact CD2-CZ 4.26Å; L1340-F1345 VanDerWaalsContact O-CD2 3.29Å; L1340-F1345 WeakPolarHBondContact O-CD2 3.04Å; L1340-F1345 WeakPolarHBondContact O-CG 3.34Å; L1340-F1345 PolarHBondContact O-N 3.44Å; L1340-I1409 HydrophobicContact CB-CD1 4.2Å; L1340-I1409 HydrophobicContact CD1-CD1 4.46Å; L1340-I1409 HydrophobicContact CD1-CG2 4.39Å; L1340-M1427 HydrophobicContact CD1-CE 4.22Å; L1340-M1427 HydrophobicContact CD1-SD 4.44Å; L1340-F1510 HydrophobicContact CD1-CB 4.03Å; L1340-F1510 HydrophobicContact CD1-CD1 3.5Å; L1340-F1510 HydrophobicContact CD1-CD2 4.49Å; L1340-F1510 HydrophobicContact CD1-CE1 4Å; L1340-F1510 HydrophobicContact CD1-CG 3.78Å; L1340-F1510 HydrophobicContact CD2-CB 3.86Å; L1340-F1510 HydrophobicContact CD2-CD2 4.26Å; L1340-F1510 HydrophobicContact CD2-CG 4.02Å; L1340-A1517 HydrophobicContact CD2-CB 3.93Å; L1340-F1519 HydrophobicContact CD2-CE2 4.06Å; L1340-F1519 HydrophobicContact CD2-CZ 4.49Å
1341	E	86.6	Confident	84.4	Confident	46 Å²	46	50.5 Å²	50.5	22%	0.215	26%	0.256	C	S	.	.	I	π-helix	trans	-59.1	-50.9	176.6	-73.8	173.8	-152.8	0	0	112.1	G1337 F1339 M1346 I1409 W1432	G1337-E1341 WeakPolarHBondContact O-CB 3.42Å; G1337-E1341 VanDerWaalsContact O-CG 3.3Å; G1337-E1341 WeakPolarHBondContact O-CG 3.4Å; G1337-E1341 PolarHBondContact O-N 3.24Å; F1339-E1341 PolarHBondContact O-N 2.9Å; E1341-M1346 WeakPolarHBondContact O-CG 3.13Å; E1341-M1346 PolarHBondContact O-N 2.92Å; E1341-I1409 HydrophobicContact CG-CD1 4.08Å; E1341-W1432 PolarHBondContact OE1-NE1 3.17Å
1342	K	82.8	Confident	84.6	Confident	40 Å²	40	46.2 Å²	46.2	17%	0.174	22%	0.224	C	C	.	.	I	π-helix	trans	-78.4	-33.8	-169.5	-171.9	172.4	-178.5	172.1	0	114.2	Y727 L1338 F1339 Q1348	Y727-K1342 PolarHBondContact OH-NZ 3.48Å; L1338-K1342 WeakPolarHBondContact O-CB 3.39Å; L1338-K1342 PolarHBondContact O-N 3.44Å; F1339-K1342 PolarHBondContact O-N 3.49Å; K1342-Q1348 PolarHBondContact O-NE2 2.97Å
1343	F	84.7	Confident	84.3	Confident	61 Å²	61	47.3 Å²	47.3	27%	0.268	23%	0.229	S	C	.	.	I	π-helix	trans	-113.5	-33.7	-172.7	-64.2	-76.9	0	0	0	114.4	L1334 F1339	L1334-F1343 HydrophobicContact CD1-CD2 4.45Å; L1334-F1343 HydrophobicContact CD1-CE2 3.62Å; L1334-F1343 HydrophobicContact CD1-CZ 4.48Å; F1339-F1343 AromaticContact CD2-CD2 3.73Å; F1339-F1343 HydrophobicContact CD2-CD2 3.73Å; F1339-F1343 HydrophobicContact CD2-CE2 4.32Å; F1339-F1343 HydrophobicContact CD2-CG 4.48Å; F1339-F1343 HydrophobicContact CE2-CB 4.39Å; F1339-F1343 AromaticContact CE2-CD2 3.99Å; F1339-F1343 HydrophobicContact CE2-CD2 3.99Å; F1339-F1343 HydrophobicContact CE2-CG 4.34Å; F1339-F1343 HydrophobicContact CG-CD2 4.31Å; F1339-F1343 HydrophobicContact CZ-CB 4.39Å; F1339-F1343 WeakPolarHBondContact O-CB 2.92Å; F1339-F1343 PolarHBondContact O-N 2.94Å
1344	C	85.9	Confident	83.6	Confident	3 Å²	3	52 Å²	52	2%	0.02	25%	0.253	C	S	.	.	I	π-helix	trans	-92.1	-43.7	-178.9	-55.8	0	0	0	0	112.6	L1340 I1377 A1517	L1340-C1344 HydrophobicContact CD2-CB 4.38Å; L1340-C1344 WeakPolarHBondContact O-CA 3.15Å; L1340-C1344 WeakPolarHBondContact O-CB 3.13Å; L1340-C1344 PolarHBondContact O-N 3.45Å; L1340-C1344 VanDerWaalsContact O-N 3.09Å; C1344-I1377 HydrophobicContact CB-CD1 4.29Å; C1344-I1377 HydrophobicContact CB-CG1 4.34Å; C1344-A1517 HydrophobicContact CB-CB 3.88Å
1345	F	86	Confident	83.1	Confident	18 Å²	18	50.3 Å²	50.3	8%	0.079	25%	0.245	C	C	.	.	I	π-helix	trans	-96.8	-33.7	-170.6	-55.3	-39.8	0	0	0	114	L1340 I1409 F1510 F1512 K1515 A1517	L1340-F1345 HydrophobicContact CB-CD2 4.16Å; L1340-F1345 HydrophobicContact CB-CE2 3.7Å; L1340-F1345 HydrophobicContact CB-CZ 4.37Å; L1340-F1345 HydrophobicContact CD2-CE2 4.42Å; L1340-F1345 HydrophobicContact CD2-CZ 4.26Å; L1340-F1345 VanDerWaalsContact O-CD2 3.29Å; L1340-F1345 WeakPolarHBondContact O-CD2 3.04Å; L1340-F1345 WeakPolarHBondContact O-CG 3.34Å; L1340-F1345 PolarHBondContact O-N 3.44Å; F1345-I1409 HydrophobicContact CD2-CD1 4.38Å; F1345-I1409 HydrophobicContact CD2-CG1 4.44Å; F1345-I1409 HydrophobicContact CE2-CD1 3.87Å; F1345-I1409 HydrophobicContact CE2-CG1 3.84Å; F1345-I1409 HydrophobicContact CE2-CG2 4.2Å; F1345-I1409 HydrophobicContact CZ-CG2 4.48Å; F1345-F1510 HydrophobicContact CZ-CB 4.23Å; F1345-F1510 WeakPolarHBondContact CZ-O 3.45Å; F1345-F1512 HydrophobicContact CB-CD1 3.9Å; F1345-F1512 HydrophobicContact CD1-CB 4.17Å; F1345-F1512 HydrophobicContact CD2-CB 3.61Å; F1345-F1512 AromaticContact CD2-CD1 3.85Å; F1345-F1512 HydrophobicContact CD2-CD1 3.85Å; F1345-F1512 HydrophobicContact CD2-CG 4.17Å; F1345-F1512 HydrophobicContact CE1-CB 4.18Å; F1345-F1512 HydrophobicContact CE2-CB 3.61Å; F1345-F1512 HydrophobicContact CG-CB 3.91Å; F1345-F1512 AromaticContact CG-CD1 4Å; F1345-F1512 HydrophobicContact CG-CD1 4Å; F1345-F1512 HydrophobicContact CG-CG 4.47Å; F1345-F1512 HydrophobicContact CZ-CB 3.91Å; F1345-K1515 HydrophobicContact CD1-CB 3.77Å; F1345-K1515 HydrophobicContact CE1-CB 4.32Å; F1345-K1515 WeakPolarHBondContact CE1-O 3.43Å; F1345-K1515 VanDerWaalsContact O-CD 3.31Å; F1345-K1515 WeakPolarHBondContact O-CD 3.16Å; F1345-K1515 PolarHBondContact O-NZ 3.17Å; F1345-A1517 HydrophobicContact CE1-CB 4.32Å
1346	M	80.2	Confident	82.6	Confident	82 Å²	82	57.2 Å²	57.2	40%	0.404	28%	0.282	S	S	.	.	S	Bend	trans	-65.8	143.4	165.6	-75.8	-168.4	73.6	0	0	111.3	F689 E1341 Q1348	F689-M1346 HydrophobicContact CD1-CE 4.3Å; F689-M1346 HydrophobicContact CD1-SD 4.27Å; F689-M1346 HydrophobicContact CE1-CE 3.84Å; F689-M1346 HydrophobicContact CE1-SD 3.65Å; F689-M1346 HydrophobicContact CZ-SD 4.06Å; E1341-M1346 WeakPolarHBondContact O-CG 3.13Å; E1341-M1346 PolarHBondContact O-N 2.92Å; M1346-Q1348 PolarHBondContact O-N 3.45Å
1347	Q	70.3	Confident	82.1	Confident	148 Å²	148	58.5 Å²	58.5	69%	0.692	29%	0.289	S	S	*	.			trans	-80.2	110.5	175.5	-173.8	169.9	-2.9	0	0	109.2
1348	Q	71.2	Confident	81.8	Confident	71 Å²	71	61 Å²	61	33%	0.332	31%	0.305	S	S	.	.			trans	-115.7	142.7	179.9	-55.1	-66.4	0.3	0	0	109.7	K1342 M1346 M1359	K1342-Q1348 PolarHBondContact O-NE2 2.97Å; M1346-Q1348 PolarHBondContact O-N 3.45Å; Q1348-M1359 HydrophobicContact CB-CB 4.43Å; Q1348-M1359 HydrophobicContact CB-CG 3.91Å; Q1348-M1359 WeakPolarHBondContact O-CB 3.44Å; Q1348-M1359 VanDerWaalsContact O-CG 3.27Å; Q1348-M1359 WeakPolarHBondContact O-CG 3.11Å; Q1348-M1359 PolarHBondContact O-N 2.92Å
1349	H	78.3	Confident	81.5	Confident	148 Å²	148	61.5 Å²	61.5	69%	0.685	31%	0.307	S	S	*	.	B	Isolated β-bridge	trans	-76.1	166.2	166	-60	95.4	0	0	0	110	M1359	H1349-M1359 WeakPolarHBondContact O-CG 3.46Å
1350	C	82	Confident	81.1	Confident	13 Å²	13	63.2 Å²	63.2	9%	0.088	32%	0.323	C	S	.	.			trans	-58.9	147.3	175.1	-166.7	0	0	0	0	111.8	N1352 C1355 M1359 H1362	C1350-N1352 PolarHBondContact O-N 3.41Å; C1350-C1355 HydrophobicContact CB-CB 3.72Å; C1350-C1355 VanDerWaalsContact CB-O 3.23Å; C1350-C1355 WeakPolarHBondContact CB-O 3.34Å; C1350-M1359 HydrophobicContact CB-CE 3.91Å; C1350-H1362 PolarHBondContact SG-NE2 3.32Å
1351	R	80.2	Confident	80.8	Confident	138 Å²	138	66.4 Å²	66.4	52%	0.521	34%	0.34	S	S	.	.	S	Bend	trans	-67.9	-20.7	175	-56.4	-176.7	-166.3	171.3	8.8	112.2	L1306 V1319 M1359	L1306-R1351 HydrophobicContact CD2-CG 4.34Å; V1319-R1351 HydrophobicContact CG2-CB 4Å; R1351-M1359 HydrophobicContact CG-SD 4.49Å
1352	N	80.2	Confident	80.9	Confident	31 Å²	31	64.5 Å²	64.5	17%	0.166	33%	0.331	C	S	.	.	S	Bend	trans	-91.7	119.4	168.3	176.8	-4.9	0	0	0	109.6	C1318 V1319 C1350 L1354 C1355	C1318-N1352 WeakPolarHBondContact O-CB 3.46Å; C1318-N1352 PolarHBondContact O-ND2 3.05Å; V1319-N1352 HydrophobicContact CG2-CB 4.43Å; C1350-N1352 PolarHBondContact O-N 3.41Å; N1352-L1354 PolarHBondContact O-N 2.99Å; N1352-L1354 VanDerWaalsContact OD1-CB 3.31Å; N1352-L1354 WeakPolarHBondContact OD1-CB 3.29Å; N1352-L1354 WeakPolarHBondContact OD1-CG 3.24Å; N1352-L1354 PolarHBondContact OD1-N 2.8Å; N1352-C1355 PolarHBondContact O-N 2.87Å
1353	P	75.4	Confident	81.1	Confident	116 Å²	116	64.5 Å²	64.5	75%	0.753	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-10	-179	30.3	-37	0	0	0	114.3	C1355	P1353-C1355 VanDerWaalsContact C-N 3.35Å
1354	L	75.9	Confident	81.4	Confident	108 Å²	108	62.7 Å²	62.7	57%	0.565	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-13.6	171.7	-55.6	177.7	0	0	0	112.6	M1313 N1352	M1313-L1354 HydrophobicContact SD-CB 4.48Å; M1313-L1354 HydrophobicContact SD-CD1 4.17Å; N1352-L1354 PolarHBondContact O-N 2.99Å; N1352-L1354 VanDerWaalsContact OD1-CB 3.31Å; N1352-L1354 WeakPolarHBondContact OD1-CB 3.29Å; N1352-L1354 WeakPolarHBondContact OD1-CG 3.24Å; N1352-L1354 PolarHBondContact OD1-N 2.8Å
1355	C	80.5	Confident	81.6	Confident	6 Å²	6	64 Å²	64	4%	0.041	33%	0.329	C	S	.	.			trans	-102.1	95	-179.9	-171.6	0	0	0	0	110.9	C1350 N1352 P1353 V1357 H1362	C1350-C1355 HydrophobicContact CB-CB 3.72Å; C1350-C1355 VanDerWaalsContact CB-O 3.23Å; C1350-C1355 WeakPolarHBondContact CB-O 3.34Å; N1352-C1355 PolarHBondContact O-N 2.87Å; P1353-C1355 VanDerWaalsContact C-N 3.35Å; C1355-V1357 PolarHBondContact O-N 2.84Å; C1355-V1357 VanDerWaalsContact O-N 3.14Å; C1355-H1362 VanDerWaalsContact SG-CE1 3.55Å; C1355-H1362 PolarHBondContact SG-NE2 3.05Å; C1355-H1362 VanDerWaalsContact SG-NE2 3.37Å
1356	N	79.9	Confident	82	Confident	151 Å²	151	63.4 Å²	63.4	81%	0.807	33%	0.327	S	S	*	.			trans	-69.7	-1.7	176.2	-73.4	-13.9	0	0	0	114.2
1357	V	83.7	Confident	82.5	Confident	26 Å²	26	59.5 Å²	59.5	16%	0.158	31%	0.308	C	S	.	.	S	Bend	trans	-75.2	139.6	178.1	-180	0	0	0	0	110.1	T1308 K1310 C1355 D1361 H1362	T1308-V1357 HydrophobicContact CG2-CB 4.23Å; T1308-V1357 HydrophobicContact CG2-CG1 4.04Å; T1308-V1357 HydrophobicContact CG2-CG2 4.45Å; K1310-V1357 HydrophobicContact CB-CG1 4.22Å; K1310-V1357 HydrophobicContact CB-CG2 3.95Å; K1310-V1357 HydrophobicContact CD-CG1 4.49Å; C1355-V1357 PolarHBondContact O-N 2.84Å; C1355-V1357 VanDerWaalsContact O-N 3.14Å; V1357-D1361 HydrophobicContact CG1-CB 3.35Å; V1357-H1362 PolarHBondContact O-CE1 3.42Å; V1357-H1362 VanDerWaalsContact O-CE1 3.31Å
1358	V	83.5	Confident	83.5	Confident	53 Å²	53	52.5 Å²	52.5	32%	0.321	28%	0.275	S	S	.	.	B	Isolated β-bridge	trans	-68.1	151.9	179.4	-66.6	0	0	0	0	112.1	A1360 D1361 H1362	V1358-A1360 HydrophobicContact CG2-CB 4.17Å; V1358-A1360 PolarHBondContact O-N 3.41Å; V1358-A1360 VanDerWaalsContact O-N 3.11Å; V1358-D1361 HydrophobicContact CG2-CB 4.22Å; V1358-D1361 PolarHBondContact O-N 3.08Å; V1358-H1362 PolarHBondContact O-ND1 2.76Å
1359	M	82.4	Confident	84	Confident	22 Å²	22	50.2 Å²	50.2	11%	0.108	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-63.7	-17.6	178.4	-66.1	-87.8	70.3	0	0	113.9	L1306 Q1348 H1349 C1350 R1351 D1361 H1362	L1306-M1359 HydrophobicContact CD1-CE 4.1Å; L1306-M1359 HydrophobicContact CD2-CE 3.78Å; L1306-M1359 HydrophobicContact CD2-SD 4.06Å; L1306-M1359 HydrophobicContact CG-CE 4.2Å; Q1348-M1359 HydrophobicContact CB-CB 4.43Å; Q1348-M1359 HydrophobicContact CB-CG 3.91Å; Q1348-M1359 WeakPolarHBondContact O-CB 3.44Å; Q1348-M1359 VanDerWaalsContact O-CG 3.27Å; Q1348-M1359 WeakPolarHBondContact O-CG 3.11Å; Q1348-M1359 PolarHBondContact O-N 2.92Å; H1349-M1359 WeakPolarHBondContact O-CG 3.46Å; C1350-M1359 HydrophobicContact CB-CE 3.91Å; R1351-M1359 HydrophobicContact CG-SD 4.49Å; M1359-D1361 VanDerWaalsContact C-N 3.29Å; M1359-D1361 PolarHBondContact O-N 2.92Å; M1359-H1362 HydrophobicContact CE-CB 3.68Å; M1359-H1362 VanDerWaalsContact CE-CD2 3.46Å; M1359-H1362 WeakPolarHBondContact CE-CD2 3.14Å; M1359-H1362 WeakPolarHBondContact CE-ND1 3.42Å; M1359-H1362 PolarHBondContact O-N 3.44Å
1360	A	81.4	Confident	84.2	Confident	47 Å²	47	44.5 Å²	44.5	39%	0.388	24%	0.243	S	C	.	.	G	3₁₀ helix	trans	-68.1	-26.9	172.6	0	0	0	0	0	113.5	V1358 H1362 I1377	V1358-A1360 HydrophobicContact CG2-CB 4.17Å; V1358-A1360 PolarHBondContact O-N 3.41Å; V1358-A1360 VanDerWaalsContact O-N 3.11Å; A1360-H1362 VanDerWaalsContact C-N 3.31Å; A1360-I1377 HydrophobicContact CB-CG2 4.09Å
1361	D	85	Confident	84.5	Confident	67 Å²	67	43.9 Å²	43.9	36%	0.358	24%	0.239	S	C	.	.	G	3₁₀ helix	trans	-88.3	0.9	176.7	-92.9	-32.5	0	0	0	112.7	T1308 K1310 V1357 V1358 M1359	T1308-D1361 WeakPolarHBondContact CB-O 3.45Å; T1308-D1361 PolarHBondContact OG1-O 2.99Å; K1310-D1361 HydrophobicContact CD-CB 4.09Å; K1310-D1361 WeakPolarHBondContact CD-OD2 3.11Å; K1310-D1361 IonicContact NZ-OD1 3.45Å; K1310-D1361 PolarHBondContact NZ-OD1 3.09Å; K1310-D1361 IonicContact NZ-OD2 3.94Å; K1310-D1361 PolarHBondContact NZ-OD2 3.04Å; V1357-D1361 HydrophobicContact CG1-CB 3.35Å; V1358-D1361 HydrophobicContact CG2-CB 4.22Å; V1358-D1361 PolarHBondContact O-N 3.08Å; M1359-D1361 VanDerWaalsContact C-N 3.29Å; M1359-D1361 PolarHBondContact O-N 2.92Å
1362	H	88.7	Confident	85.1	Confident	6 Å²	6	37.6 Å²	37.6	3%	0.028	22%	0.216	C	C	.	.			trans	-100.7	151.5	-179.7	-72.4	73.4	0	0	0	112.6	L1306 F1307 C1350 C1355 V1357 V1358 M1359 A1360	L1306-H1362 HydrophobicContact CD1-CB 3.95Å; F1307-H1362 WeakPolarHBondContact O-CA 2.91Å; C1350-H1362 PolarHBondContact SG-NE2 3.32Å; C1355-H1362 VanDerWaalsContact SG-CE1 3.55Å; C1355-H1362 PolarHBondContact SG-NE2 3.05Å; C1355-H1362 VanDerWaalsContact SG-NE2 3.37Å; V1357-H1362 PolarHBondContact O-CE1 3.42Å; V1357-H1362 VanDerWaalsContact O-CE1 3.31Å; V1358-H1362 PolarHBondContact O-ND1 2.76Å; M1359-H1362 HydrophobicContact CE-CB 3.68Å; M1359-H1362 VanDerWaalsContact CE-CD2 3.46Å; M1359-H1362 WeakPolarHBondContact CE-CD2 3.14Å; M1359-H1362 WeakPolarHBondContact CE-ND1 3.42Å; M1359-H1362 PolarHBondContact O-N 3.44Å; A1360-H1362 VanDerWaalsContact C-N 3.31Å
1363	I	88.2	Confident	85.7	Confident	40 Å²	40	36.1 Å²	36.1	21%	0.205	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108	125.9	172.2	-59.7	178.5	0	0	0	107.2	F1307 R1365 Q1374 M1376	F1307-I1363 HydrophobicContact CD1-CB 4.19Å; F1307-I1363 HydrophobicContact CD1-CG2 4.42Å; F1307-I1363 WeakPolarHBondContact CD1-O 3.41Å; F1307-I1363 HydrophobicContact CE1-CB 3.67Å; F1307-I1363 HydrophobicContact CE1-CG2 3.52Å; F1307-I1363 HydrophobicContact CE2-CB 4.21Å; F1307-I1363 HydrophobicContact CE2-CD1 4.02Å; F1307-I1363 HydrophobicContact CZ-CB 3.69Å; F1307-I1363 HydrophobicContact CZ-CD1 3.89Å; F1307-I1363 HydrophobicContact CZ-CG1 4.35Å; F1307-I1363 HydrophobicContact CZ-CG2 3.63Å; F1307-I1363 PolarHBondContact N-O 2.84Å; F1307-I1363 PolarHBondContact O-N 3.23Å; I1363-R1365 HydrophobicContact CG2-CG 4.37Å; I1363-Q1374 HydrophobicContact CG2-CG 3.3Å; I1363-M1376 HydrophobicContact CG1-CG 4.5Å
1364	Q	91	Very high	86.5	Confident	22 Å²	22	31.5 Å²	31.5	10%	0.103	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	115.4	173.4	-168.7	178	-27.8	0	0	109	I1305 L1306 F1366 L1375	I1305-Q1364 CarbonylContact O-C 3.46Å; I1305-Q1364 WeakPolarHBondContact O-CA 3.31Å; L1306-Q1364 HydrophobicContact CD1-CB 3.79Å; L1306-Q1364 HydrophobicContact CD1-CG 4.12Å; Q1364-F1366 HydrophobicContact CG-CE2 4.19Å; Q1364-F1366 HydrophobicContact CG-CZ 4.08Å; Q1364-L1375 HydrophobicContact CB-CB 4.34Å; Q1364-L1375 PolarHBondContact N-O 3.33Å; Q1364-L1375 PolarHBondContact O-N 2.94Å
1365	R	90.4	Very high	87.4	Confident	31 Å²	31	26.7 Å²	26.7	12%	0.117	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	136.8	175.4	-73.4	175.4	177.4	161.2	-6.2	110	A1304 I1305 F1307 I1363 I1367 V1373 Q1374 I2548	A1304-R1365 WeakPolarHBondContact CA-O 3.37Å; I1305-R1365 PolarHBondContact N-O 3.34Å; I1305-R1365 PolarHBondContact O-N 3.48Å; F1307-R1365 HydrophobicContact CE1-CG 4.07Å; I1363-R1365 HydrophobicContact CG2-CG 4.37Å; R1365-I1367 HydrophobicContact CB-CD1 4.04Å; R1365-I1367 HydrophobicContact CB-CG1 3.9Å; R1365-V1373 WeakPolarHBondContact CA-O 3.29Å; R1365-Q1374 HydrophobicContact CG-CB 4.35Å; R1365-Q1374 HydrophobicContact CG-CG 4.12Å; R1365-I2548 PolarHBondContact NH1-O 3.47Å
1366	F	93.5	Very high	87.8	Confident	6 Å²	6	27.6 Å²	27.6	3%	0.026	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.3	120.3	169.4	-53.8	-91.8	0	0	0	107.4	F1302 L1303 F1339 Q1364 S1372 V1373 L1375 F1436 L1440	F1302-F1366 HydrophobicContact CD2-CB 4.39Å; F1302-F1366 AromaticContact CD2-CD1 3.88Å; F1302-F1366 HydrophobicContact CD2-CD1 3.88Å; F1302-F1366 AromaticContact CE2-CD1 3.66Å; F1302-F1366 HydrophobicContact CE2-CD1 3.66Å; F1302-F1366 HydrophobicContact CE2-CE1 4.22Å; F1302-F1366 HydrophobicContact CZ-CD1 4.44Å; L1303-F1366 WeakPolarHBondContact O-CA 3.45Å; F1339-F1366 HydrophobicContact CZ-CZ 4.25Å; Q1364-F1366 HydrophobicContact CG-CE2 4.19Å; Q1364-F1366 HydrophobicContact CG-CZ 4.08Å; F1366-S1372 CarbonylContact O-C 3.39Å; F1366-S1372 VanDerWaalsContact O-CA 3.23Å; F1366-S1372 WeakPolarHBondContact O-CA 3.42Å; F1366-S1372 WeakPolarHBondContact O-CB 3.41Å; F1366-V1373 PolarHBondContact N-O 2.82Å; F1366-V1373 PolarHBondContact O-N 2.92Å; F1366-L1375 HydrophobicContact CE2-CB 4.02Å; F1366-L1375 HydrophobicContact CE2-CD2 4.32Å; F1366-F1436 AromaticContact CE1-CE1 3.89Å; F1366-F1436 HydrophobicContact CE1-CE1 3.89Å; F1366-F1436 AromaticContact CE1-CZ 4Å; F1366-F1436 HydrophobicContact CE1-CZ 4Å; F1366-F1436 HydrophobicContact CE2-CZ 4Å; F1366-F1436 AromaticContact CZ-CE1 3.89Å; F1366-F1436 HydrophobicContact CZ-CE1 3.89Å; F1366-F1436 AromaticContact CZ-CZ 3.54Å; F1366-F1436 HydrophobicContact CZ-CZ 3.54Å; F1366-L1440 HydrophobicContact CB-CD1 4.02Å; F1366-L1440 HydrophobicContact CB-CD2 4.41Å; F1366-L1440 HydrophobicContact CD1-CD1 3.64Å; F1366-L1440 HydrophobicContact CD2-CD1 4.25Å; F1366-L1440 HydrophobicContact CD2-CD2 4.04Å; F1366-L1440 HydrophobicContact CE1-CD1 4.06Å; F1366-L1440 HydrophobicContact CG-CD1 3.73Å; F1366-L1440 HydrophobicContact CG-CD2 4.22Å
1367	I	91.4	Very high	88.4	Confident	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133	133	-160.1	-42.1	144.3	0	0	0	109.4	F1302 L1303 I1305 R1365 V1524 Y2553 L2650	F1302-I1367 WeakPolarHBondContact CA-O 3.46Å; L1303-I1367 HydrophobicContact CB-CB 4.31Å; L1303-I1367 HydrophobicContact CB-CD1 4.41Å; L1303-I1367 HydrophobicContact CD2-CD1 4.09Å; L1303-I1367 HydrophobicContact CG-CD1 4.3Å; L1303-I1367 PolarHBondContact N-O 3.5Å; L1303-I1367 PolarHBondContact O-N 2.53Å; I1305-I1367 HydrophobicContact CB-CD1 4.41Å; I1305-I1367 HydrophobicContact CD1-CD1 3.55Å; I1305-I1367 HydrophobicContact CG1-CD1 3.77Å; R1365-I1367 HydrophobicContact CB-CD1 4.04Å; R1365-I1367 HydrophobicContact CB-CG1 3.9Å; I1367-V1524 HydrophobicContact CG2-CG1 4.19Å; I1367-V1524 HydrophobicContact CG2-CG2 3.81Å; I1367-Y2553 HydrophobicContact CD1-CE1 4.25Å; I1367-Y2553 WeakPolarHBondContact CD1-OH 3.25Å; I1367-Y2553 HydrophobicContact CG2-CE1 4.18Å; I1367-Y2553 HydrophobicContact CG2-CE2 4.43Å; I1367-L2650 HydrophobicContact CB-CD1 3.93Å; I1367-L2650 HydrophobicContact CG2-CD1 3.43Å; I1367-L2650 VanDerWaalsContact CG2-CD1 3.43Å
1368	Q	90.1	Very high	88.5	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.139	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	165.8	176.5	-164	-175.5	-3.4	0	0	109	S1370 G1371 I1444 N1445 P2651	Q1368-S1370 PolarHBondContact O-N 3.4Å; Q1368-S1370 PolarHBondContact OE1-OG 3.26Å; Q1368-G1371 PolarHBondContact N-O 3.21Å; Q1368-G1371 PolarHBondContact O-N 3.33Å; Q1368-G1371 VanDerWaalsContact O-N 3.09Å; Q1368-I1444 HydrophobicContact CB-CG2 4.13Å; Q1368-N1445 PolarHBondContact OE1-ND2 3.38Å; Q1368-N1445 PolarHBondContact OE1-OD1 3Å; Q1368-P2651 WeakPolarHBondContact CG-O 3.14Å
1369	T	82.1	Confident	88.4	Confident	24 Å²	24	29.8 Å²	29.8	15%	0.147	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.2	177.7	52.6	0	0	0	0	115.8	V1526 R2555 L2650 P2651 D2652	T1369-V1526 HydrophobicContact CG2-CG1 4.3Å; T1369-R2555 HydrophobicContact CG2-CG 4.31Å; T1369-L2650 HydrophobicContact CG2-CB 4.49Å; T1369-L2650 HydrophobicContact CG2-CD2 4.02Å; T1369-L2650 HydrophobicContact CG2-CG 4.02Å; T1369-P2651 PolarHBondContact N-O 2.98Å; T1369-D2652 HydrophobicContact CG2-CB 3.81Å; T1369-D2652 WeakPolarHBondContact OG1-CA 3.4Å; T1369-D2652 WeakPolarHBondContact OG1-CB 3.11Å
1370	S	82.7	Confident	88.2	Confident	28 Å²	28	30.8 Å²	30.8	20%	0.196	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	-89.5	-22.4	178.4	18.4	0	0	0	0	113.1	Q1368 I1444 N1445 Y1521	Q1368-S1370 PolarHBondContact O-N 3.4Å; Q1368-S1370 PolarHBondContact OE1-OG 3.26Å; S1370-I1444 WeakPolarHBondContact OG-CG2 3.43Å; S1370-N1445 VanDerWaalsContact CB-OD1 3.26Å; S1370-N1445 WeakPolarHBondContact CB-OD1 3.46Å; S1370-N1445 PolarHBondContact OG-OD1 2.87Å; S1370-Y1521 PolarHBondContact O-OH 3.24Å; S1370-Y1521 VanDerWaalsContact O-OH 3.1Å
1371	G	89.3	Confident	87.8	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	156.9	-175.1	-175.8	0	0	0	0	0	112.4	Q1368	Q1368-G1371 PolarHBondContact N-O 3.21Å; Q1368-G1371 PolarHBondContact O-N 3.33Å; Q1368-G1371 VanDerWaalsContact O-N 3.09Å
1372	S	91.3	Very high	87	Confident	6 Å²	6	40.5 Å²	40.5	4%	0.042	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	152.7	179.5	68.2	0	0	0	0	112.9	F1366 Y1521 Q1522	F1366-S1372 CarbonylContact O-C 3.39Å; F1366-S1372 VanDerWaalsContact O-CA 3.23Å; F1366-S1372 WeakPolarHBondContact O-CA 3.42Å; F1366-S1372 WeakPolarHBondContact O-CB 3.41Å; S1372-Y1521 CarbonylContact O-C 3.59Å; S1372-Y1521 VanDerWaalsContact O-CA 3.32Å; S1372-Y1521 WeakPolarHBondContact O-CA 3.46Å; S1372-Q1522 PolarHBondContact N-O 2.86Å; S1372-Q1522 PolarHBondContact O-N 3.2Å; S1372-Q1522 PolarHBondContact OG-O 2.84Å
1373	V	94	Very high	85.7	Confident	0 Å²	0	44 Å²	44	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	118.9	171.3	-172.2	0	0	0	0	108.9	R1365 F1366 L1440 I1443 I1444 F1519 K1520	R1365-V1373 WeakPolarHBondContact CA-O 3.29Å; F1366-V1373 PolarHBondContact N-O 2.82Å; F1366-V1373 PolarHBondContact O-N 2.92Å; V1373-L1440 HydrophobicContact CB-CD2 3.99Å; V1373-L1440 HydrophobicContact CG1-CD2 4.03Å; V1373-L1440 HydrophobicContact CG2-CD2 4.13Å; V1373-I1443 HydrophobicContact CG1-CG2 4.43Å; V1373-I1443 HydrophobicContact CG2-CB 4.04Å; V1373-I1443 HydrophobicContact CG2-CG2 3.48Å; V1373-I1443 VanDerWaalsContact CG2-CG2 3.48Å; V1373-I1444 HydrophobicContact CG2-CD1 3.92Å; V1373-I1444 HydrophobicContact CG2-CG1 3.51Å; V1373-F1519 HydrophobicContact CG1-CB 3.82Å; V1373-F1519 HydrophobicContact CG1-CD1 3.88Å; V1373-F1519 HydrophobicContact CG1-CG 4.35Å; V1373-K1520 CarbonylContact C-O 3.59Å; V1373-K1520 WeakPolarHBondContact CA-O 3.3Å
1374	Q	92	Very high	84.4	Confident	19 Å²	19	42.9 Å²	42.9	9%	0.089	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	112.6	173.8	-170.4	167.6	-76	0	0	109.8	I1363 R1365 M1376 K1520	I1363-Q1374 HydrophobicContact CG2-CG 3.3Å; R1365-Q1374 HydrophobicContact CG-CB 4.35Å; R1365-Q1374 HydrophobicContact CG-CG 4.12Å; Q1374-M1376 HydrophobicContact CG-CG 4.18Å; Q1374-K1520 PolarHBondContact N-O 2.83Å; Q1374-K1520 PolarHBondContact O-N 2.84Å
1375	L	94.2	Very high	82.7	Confident	6 Å²	6	46.3 Å²	46.3	3%	0.031	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.8	123.2	168	169.9	59.8	0	0	0	109.6	F1339 Q1364 F1366 A1517 I1518 F1519	F1339-L1375 HydrophobicContact CE1-CD2 3.84Å; F1339-L1375 HydrophobicContact CZ-CD2 3.89Å; Q1364-L1375 HydrophobicContact CB-CB 4.34Å; Q1364-L1375 PolarHBondContact N-O 3.33Å; Q1364-L1375 PolarHBondContact O-N 2.94Å; F1366-L1375 HydrophobicContact CE2-CB 4.02Å; F1366-L1375 HydrophobicContact CE2-CD2 4.32Å; L1375-A1517 HydrophobicContact CD1-CB 4.13Å; L1375-I1518 WeakPolarHBondContact CA-O 3.43Å; L1375-F1519 HydrophobicContact CB-CD1 4.04Å; L1375-F1519 HydrophobicContact CB-CE1 3.99Å; L1375-F1519 HydrophobicContact CD1-CD1 4.17Å; L1375-F1519 HydrophobicContact CD1-CD2 4.34Å; L1375-F1519 HydrophobicContact CD1-CE1 3.84Å; L1375-F1519 HydrophobicContact CD1-CE2 4.04Å; L1375-F1519 HydrophobicContact CD1-CG 4.42Å; L1375-F1519 HydrophobicContact CD1-CZ 3.78Å; L1375-F1519 HydrophobicContact CD2-CE1 4.03Å; L1375-F1519 HydrophobicContact CD2-CZ 4.25Å; L1375-F1519 HydrophobicContact CG-CE1 4.17Å; L1375-F1519 HydrophobicContact CG-CZ 4.48Å
1376	M	90.2	Very high	80.6	Confident	25 Å²	25	54.6 Å²	54.6	12%	0.123	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	143	170.9	-60.7	177.9	-71.6	0	0	109.4	I1363 Q1374 A1517 I1518 K1520	I1363-M1376 HydrophobicContact CG1-CG 4.5Å; Q1374-M1376 HydrophobicContact CG-CG 4.18Å; M1376-A1517 WeakPolarHBondContact O-CA 3.34Å; M1376-I1518 HydrophobicContact CE-CB 4.47Å; M1376-I1518 HydrophobicContact CE-CG2 4.36Å; M1376-I1518 PolarHBondContact N-O 3.14Å; M1376-I1518 PolarHBondContact O-N 3.02Å; M1376-K1520 HydrophobicContact CE-CB 4.49Å
1377	I	90.9	Very high	78.4	Confident	23 Å²	23	57.5 Å²	57.5	12%	0.118	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	135.3	172.8	-62.9	161.9	0	0	0	107.6	C1344 A1360 L1516	C1344-I1377 HydrophobicContact CB-CD1 4.29Å; C1344-I1377 HydrophobicContact CB-CG1 4.34Å; A1360-I1377 HydrophobicContact CB-CG2 4.09Å; I1377-L1516 CarbonylContact C-O 3.6Å; I1377-L1516 WeakPolarHBondContact CA-O 3.43Å
1378	R	85.9	Confident	75.8	Confident	136 Å²	136	65.3 Å²	65.3	51%	0.513	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	143.8	176	-66.3	-175	179.2	172.1	1.2	110.3	L1516	R1378-L1516 PolarHBondContact N-O 2.88Å; R1378-L1516 PolarHBondContact O-N 3.37Å
1379	Q	82.5	Confident	73.3	Confident	118 Å²	118	71.4 Å²	71.4	55%	0.551	36%	0.358	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.4	120.6	167.4	-173	63.4	46.4	0	0	107.9	R1514	Q1379-R1514 VanDerWaalsContact NE2-CB 3.27Å; Q1379-R1514 PolarHBondContact NE2-O 3.33Å; Q1379-R1514 VanDerWaalsContact NE2-O 3.07Å
1380	L	76.9	Confident	70.8	Confident	42 Å²	42	78.2 Å²	78.2	22%	0.22	39%	0.393	C	S	.	.			trans	-77	138.7	172.1	-61.1	173.8	0	0	0	109.5	Q1382 P1384 R1514 L1516	L1380-Q1382 VanDerWaalsContact CB-O 3.23Å; L1380-Q1382 WeakPolarHBondContact CB-O 3.14Å; L1380-P1384 HydrophobicContact CD1-CB 4.29Å; L1380-P1384 HydrophobicContact CD1-CG 4.33Å; L1380-R1514 HydrophobicContact CB-CB 4.47Å; L1380-R1514 WeakPolarHBondContact CB-O 3.48Å; L1380-R1514 PolarHBondContact N-O 3.39Å; L1380-L1516 HydrophobicContact CD1-CB 4.12Å; L1380-L1516 HydrophobicContact CD2-CB 4.09Å; L1380-L1516 HydrophobicContact CD2-CD2 3.93Å; L1380-L1516 HydrophobicContact CG-CB 3.95Å
1381	I	74.1	Confident	68.3	Low	163 Å²	163	80.7 Å²	80.7	84%	0.836	41%	0.41	S	S	*	.	S	Bend	trans	-72.9	-43.4	177.9	-59	172.7	0	0	0	109.9
1382	Q	66.7	Low	65.3	Low	155 Å²	155	87.7 Å²	87.7	72%	0.724	45%	0.447	S	S	*	.	S	Bend	trans	-104.2	162.3	175.4	-64	174.7	-7.2	0	0	110.1	L1380	L1380-Q1382 VanDerWaalsContact CB-O 3.23Å; L1380-Q1382 WeakPolarHBondContact CB-O 3.14Å
1383	D	61.6	Low	62.3	Low	79 Å²	79	94.7 Å²	94.7	42%	0.422	48%	0.483	S	S	.	.	P	Polyproline II helix	trans	-67.3	140.9	163.5	-70.2	-65.2	0	0	0	109.1	R1514	D1383-R1514 WeakPolarHBondContact OD1-CG 3.47Å; D1383-R1514 IonicContact OD1-NE 2.7Å; D1383-R1514 PolarHBondContact OD1-NE 2.93Å; D1383-R1514 IonicContact OD2-CZ 3.16Å; D1383-R1514 VanDerWaalsContact OD2-CZ 3.25Å; D1383-R1514 IonicContact OD2-NE 3.77Å; D1383-R1514 PolarHBondContact OD2-NE 3.24Å; D1383-R1514 IonicContact OD2-NH2 3.88Å; D1383-R1514 PolarHBondContact OD2-NH2 3.13Å
1384	P	62.2	Low	59.2	Low	17 Å²	17	100.2 Å²	100.2	11%	0.11	52%	0.519	C	S	.	.	P	Polyproline II helix	trans	-59.5	146.4	174.8	27.8	-35.8	0	0	0	110.1	L1380 R1386 Q1410 A1511	L1380-P1384 HydrophobicContact CD1-CB 4.29Å; L1380-P1384 HydrophobicContact CD1-CG 4.33Å; P1384-R1386 PolarHBondContact O-N 3.22Å; P1384-Q1410 VanDerWaalsContact CG-OE1 3.26Å; P1384-A1511 HydrophobicContact CG-CB 4.19Å
1385	P	54.7	Low	56.1	Low	94 Å²	94	107 Å²	107	61%	0.61	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-57.3	132.1	-176	21	-30.4	0	0	0	110.3	I1424	P1385-I1424 HydrophobicContact CG-CD1 3.87Å
1386	R	46.4	Very low	52.9	Low	206 Å²	206	113.5 Å²	113.5	78%	0.777	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-72.2	140.6	175	-67	-179.9	-179.2	158.1	3.9	108	P1384 E1388	P1384-R1386 PolarHBondContact O-N 3.22Å; R1386-E1388 PolarHBondContact O-N 3.32Å
1387	S	46.4	Very low	49.9	Very low	67 Å²	67	116.7 Å²	116.7	47%	0.469	63%	0.625	S	S	.	*			trans	-68.6	114.8	166.7	-178.2	0	0	0	0	107.8	V1389	S1387-V1389 PolarHBondContact O-N 2.93Å
1388	E	37.1	Very low	47	Very low	163 Å²	163	119.7 Å²	119.7	76%	0.762	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-74.9	-13.3	-171.9	-62.5	178.4	142.1	0	0	112.6	R1386 L1390 S1391	R1386-E1388 PolarHBondContact O-N 3.32Å; E1388-L1390 PolarHBondContact O-N 3.33Å; E1388-L1390 VanDerWaalsContact O-N 3.11Å; E1388-S1391 PolarHBondContact O-N 3.28Å; E1388-S1391 PolarHBondContact O-OG 3.16Å
1389	V	37.8	Very low	44.5	Very low	128 Å²	128	118.8 Å²	118.8	78%	0.776	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-72	-1.6	-172.5	-170.1	0	0	0	0	114.2	S1387	S1387-V1389 PolarHBondContact O-N 2.93Å
1390	L	30.9	Very low	42.1	Very low	167 Å²	167	117.7 Å²	117.7	87%	0.874	65%	0.651	S	S	*	*	G	3₁₀ helix	trans	-132.7	36.2	176.5	-75.4	176.3	0	0	0	113.6	E1388	E1388-L1390 PolarHBondContact O-N 3.33Å; E1388-L1390 VanDerWaalsContact O-N 3.11Å
1391	S	29.4	Very low	40	Very low	80 Å²	80	119.3 Å²	119.3	56%	0.559	67%	0.671	S	S	*	*	S	Bend	trans	-86.7	-36.2	174.4	-46.4	0	0	0	0	113.2	E1388	E1388-S1391 PolarHBondContact O-N 3.28Å; E1388-S1391 PolarHBondContact O-OG 3.16Å
1392	D	26.1	Very low	37.8	Very low	147 Å²	147	119.4 Å²	119.4	79%	0.786	67%	0.665	S	S	*	*			trans	-111.2	60.9	-157.4	-64.6	-42	0	0	0	115
1393	I	27.9	Very low	36.1	Very low	154 Å²	154	120.6 Å²	120.6	79%	0.79	66%	0.664	S	S	*	*			trans	-132.4	91.2	155.6	-53.7	-179.3	0	0	0	109.7
1394	P	29.4	Very low	34.8	Very low	115 Å²	115	126.4 Å²	126.4	75%	0.747	68%	0.681	S	S	*	*			trans	-80.4	119.1	175.9	30.6	-32.4	0	0	0	112
1395	N	27.1	Very low	33.8	Very low	162 Å²	162	132.9 Å²	132.9	87%	0.866	70%	0.703	S	S	*	*			trans	49.1	93.9	160.3	-64.1	-35.6	0	0	0	118.4
1396	Q	27.6	Very low	33.6	Very low	142 Å²	142	133 Å²	133	66%	0.664	70%	0.704	S	S	*	*			trans	-115	141	138	-82.3	-168.9	-19.3	0	0	110.2	S1398	Q1396-S1398 PolarHBondContact O-N 3.09Å
1397	G	26.2	Very low	34.1	Very low	92 Å²	92	124.1 Å²	124.1	95%	0.948	67%	0.672	S	S	*	*			trans	-85.9	99.3	-158.6	0	0	0	0	0	115.4
1398	S	29.8	Very low	35.5	Very low	86 Å²	86	128.4 Å²	128.4	60%	0.601	68%	0.678	S	S	*	*			trans	-126.3	131.3	155	63.1	0	0	0	0	110.3	Q1396 D1400	Q1396-S1398 PolarHBondContact O-N 3.09Å; S1398-D1400 VanDerWaalsContact C-N 3.31Å; S1398-D1400 PolarHBondContact O-N 3.15Å
1399	N	34.5	Very low	37.9	Very low	118 Å²	118	120.8 Å²	120.8	63%	0.631	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-77.3	-12.3	-170.8	-90.6	-52	0	0	0	114.3	A1401 K1402	N1399-A1401 VanDerWaalsContact C-N 3.29Å; N1399-A1401 PolarHBondContact O-N 3.37Å; N1399-K1402 PolarHBondContact O-N 3.48Å
1400	D	32	Very low	40.2	Very low	94 Å²	94	115.8 Å²	115.8	50%	0.503	61%	0.611	S	S	.	*	G	3₁₀ helix	trans	-69.4	-21.7	-177.9	-75.2	-50.5	0	0	0	114.3	S1398 K1402 Y1403	S1398-D1400 VanDerWaalsContact C-N 3.31Å; S1398-D1400 PolarHBondContact O-N 3.15Å; D1400-K1402 PolarHBondContact O-N 3.12Å; D1400-K1402 VanDerWaalsContact O-N 3.15Å; D1400-Y1403 PolarHBondContact O-N 3.27Å
1401	A	31.4	Very low	43	Very low	77 Å²	77	108 Å²	108	64%	0.636	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-60.9	-23.6	178.7	0	0	0	0	0	113.6	N1399 Y1403	N1399-A1401 VanDerWaalsContact C-N 3.29Å; N1399-A1401 PolarHBondContact O-N 3.37Å; A1401-Y1403 PolarHBondContact O-N 3.26Å
1402	K	28.1	Very low	45.8	Very low	164 Å²	164	105.4 Å²	105.4	71%	0.713	55%	0.548	S	S	*	.	G	3₁₀ helix	trans	-74.4	-16.7	-176.3	-78.2	175.9	178.2	164.4	0	115.1	N1399 D1400	N1399-K1402 PolarHBondContact O-N 3.48Å; D1400-K1402 PolarHBondContact O-N 3.12Å; D1400-K1402 VanDerWaalsContact O-N 3.15Å
1403	Y	32.1	Very low	48.7	Very low	180 Å²	180	98.5 Å²	98.5	71%	0.706	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.2	-18.7	-171.2	-69.4	-74.1	0	0	0	115.8	Y929 D1400 A1401 R1405	Y929-Y1403 PolarHBondContact OH-O 3.4Å; D1400-Y1403 PolarHBondContact O-N 3.27Å; A1401-Y1403 PolarHBondContact O-N 3.26Å; Y1403-R1405 PolarHBondContact O-N 2.72Å
1404	R	34.1	Very low	51.5	Low	202 Å²	202	93.1 Å²	93.1	76%	0.762	48%	0.482	S	S	*	.			trans	-72.1	110.6	162.6	-69.4	-174.5	-178.4	-175.1	2.3	108.5	P1406	R1404-P1406 WeakPolarHBondContact O-CD 3.49Å
1405	R	41	Very low	54.1	Low	153 Å²	153	87.7 Å²	87.7	58%	0.577	45%	0.447	S	S	*	.			trans	-72.6	113.7	163.4	-73.5	-177	179.3	149.5	3.3	107.5	Q690 Y1403	Q690-R1405 VanDerWaalsContact OE1-NH1 3.09Å; Y1403-R1405 PolarHBondContact O-N 2.72Å
1406	P	50.4	Low	56.7	Low	97 Å²	97	81.3 Å²	81.3	63%	0.63	41%	0.414	S	S	*	.			trans	-63.1	157	173.7	27.8	-35	0	0	0	110.1	R1404 R1408	R1404-P1406 WeakPolarHBondContact O-CD 3.49Å; P1406-R1408 PolarHBondContact O-N 3.39Å; P1406-R1408 VanDerWaalsContact O-N 3.11Å
1407	C	57.5	Low	59.2	Low	18 Å²	18	79.3 Å²	79.3	12%	0.122	41%	0.407	C	S	.	.			trans	-66.4	112.1	177.5	-166.8	0	0	0	0	109.8	R682 I1409 H1426 M1427	R682-C1407 PolarHBondContact NH2-SG 3.24Å; C1407-I1409 VanDerWaalsContact C-N 3.3Å; C1407-I1409 PolarHBondContact O-N 3.31Å; C1407-H1426 PolarHBondContact O-ND1 2.84Å; C1407-M1427 WeakPolarHBondContact CB-O 3.33Å; C1407-M1427 PolarHBondContact SG-O 2.81Å
1408	R	74.9	Confident	61.7	Low	157 Å²	157	77.1 Å²	77.1	59%	0.592	38%	0.377	S	S	*	.			trans	-85.1	-2.9	-174.7	-63.7	-171.8	176.2	-166.2	-4.5	114.1	P1406 F1512	P1406-R1408 PolarHBondContact O-N 3.39Å; P1406-R1408 VanDerWaalsContact O-N 3.11Å; R1408-F1512 HydrophobicContact CB-CD2 3.77Å; R1408-F1512 HydrophobicContact CB-CE2 3.48Å; R1408-F1512 VanDerWaalsContact CB-CE2 3.48Å; R1408-F1512 HydrophobicContact CG-CE2 4.39Å
1409	I	87.2	Confident	64.1	Low	3 Å²	3	81.8 Å²	81.8	2%	0.015	38%	0.381	C	S	.	.			trans	-79.7	122.6	175.4	-61.3	171.6	0	0	0	107.7	L1340 E1341 F1345 C1407 M1427 F1510 A1511 F1512	L1340-I1409 HydrophobicContact CB-CD1 4.2Å; L1340-I1409 HydrophobicContact CD1-CD1 4.46Å; L1340-I1409 HydrophobicContact CD1-CG2 4.39Å; E1341-I1409 HydrophobicContact CG-CD1 4.08Å; F1345-I1409 HydrophobicContact CD2-CD1 4.38Å; F1345-I1409 HydrophobicContact CD2-CG1 4.44Å; F1345-I1409 HydrophobicContact CE2-CD1 3.87Å; F1345-I1409 HydrophobicContact CE2-CG1 3.84Å; F1345-I1409 HydrophobicContact CE2-CG2 4.2Å; F1345-I1409 HydrophobicContact CZ-CG2 4.48Å; C1407-I1409 VanDerWaalsContact C-N 3.3Å; C1407-I1409 PolarHBondContact O-N 3.31Å; I1409-M1427 HydrophobicContact CB-CB 4.36Å; I1409-M1427 HydrophobicContact CB-CE 3.95Å; I1409-M1427 HydrophobicContact CD1-CE 3.5Å; I1409-M1427 HydrophobicContact CG1-CE 4.28Å; I1409-M1427 HydrophobicContact CG2-CB 4.42Å; I1409-M1427 HydrophobicContact CG2-CE 4Å; I1409-M1427 PolarHBondContact O-N 3.45Å; I1409-F1510 HydrophobicContact CG2-CB 4.3Å; I1409-F1510 HydrophobicContact CG2-CD1 4.37Å; I1409-A1511 WeakPolarHBondContact CA-O 3.33Å; I1409-F1512 HydrophobicContact CG1-CB 4.26Å
1410	Q	86.7	Confident	66.1	Low	23 Å²	23	78.7 Å²	78.7	11%	0.107	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	151.3	169.9	-70.5	169.8	-51.2	0	0	109.3	P1384 I1424 K1425 F1510 A1511	P1384-Q1410 VanDerWaalsContact CG-OE1 3.26Å; Q1410-I1424 HydrophobicContact CB-CG2 3.76Å; Q1410-I1424 HydrophobicContact CG-CG2 4.16Å; Q1410-K1425 CarbonylContact C-O 3.57Å; Q1410-K1425 WeakPolarHBondContact CA-O 3.25Å; Q1410-F1510 CarbonylContact O-C 3.55Å; Q1410-F1510 WeakPolarHBondContact O-CA 3.34Å; Q1410-A1511 PolarHBondContact N-O 3.01Å; Q1410-A1511 PolarHBondContact O-N 2.83Å
1411	M	89.2	Confident	68.3	Low	4 Å²	4	77.4 Å²	77.4	2%	0.02	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.6	153.3	176	64.8	160	72.3	0	0	112.8	Y969 N972 I975 I1424 K1425 M1427 T1431 C1509 F1510	Y969-M1411 HydrophobicContact CE2-CE 4.24Å; Y969-M1411 HydrophobicContact CE2-SD 4.2Å; N972-M1411 HydrophobicContact CB-SD 4.47Å; I975-M1411 HydrophobicContact CD1-CG 3.77Å; I975-M1411 HydrophobicContact CD1-SD 3.64Å; M1411-I1424 WeakPolarHBondContact O-CA 3.29Å; M1411-K1425 PolarHBondContact N-O 3.34Å; M1411-K1425 PolarHBondContact O-N 2.95Å; M1411-M1427 HydrophobicContact CE-CB 3.61Å; M1411-M1427 HydrophobicContact CE-CG 3.52Å; M1411-M1427 HydrophobicContact CE-SD 3.67Å; M1411-T1431 HydrophobicContact CE-CG2 3.6Å; M1411-C1509 WeakPolarHBondContact CA-O 3.33Å; M1411-C1509 WeakPolarHBondContact CB-O 3.26Å; M1411-F1510 HydrophobicContact CB-CD1 3.91Å; M1411-F1510 HydrophobicContact CB-CE1 4.23Å; M1411-F1510 HydrophobicContact CE-CD1 4.15Å; M1411-F1510 HydrophobicContact CE-CE1 3.62Å
1412	W	87.8	Confident	70.5	Confident	26 Å²	26	74 Å²	74	10%	0.098	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.1	174	171	67.8	103.1	0	0	0	110.1	N1421 S1422 I1424 C1509 A1511 L1516	W1412-N1421 PolarHBondContact NE1-OD1 2.95Å; W1412-S1422 WeakPolarHBondContact CA-OG 3.41Å; W1412-S1422 WeakPolarHBondContact CB-O 3.46Å; W1412-I1424 HydrophobicContact CB-CG1 4.16Å; W1412-I1424 HydrophobicContact CD2-CD1 4.45Å; W1412-I1424 HydrophobicContact CD2-CG1 4.11Å; W1412-I1424 HydrophobicContact CE3-CD1 4.21Å; W1412-I1424 HydrophobicContact CE3-CG1 4.01Å; W1412-I1424 HydrophobicContact CE3-CG2 4.16Å; W1412-I1424 HydrophobicContact CG-CG1 4.2Å; W1412-I1424 HydrophobicContact CZ3-CD1 4.47Å; W1412-C1509 HydrophobicContact CD2-CB 3.58Å; W1412-C1509 HydrophobicContact CE3-CB 4.07Å; W1412-C1509 HydrophobicContact CG-CB 4.01Å; W1412-C1509 HydrophobicContact CH2-CB 4.21Å; W1412-C1509 HydrophobicContact CZ2-CB 3.72Å; W1412-C1509 HydrophobicContact CZ3-CB 4.36Å; W1412-C1509 PolarHBondContact N-O 3.08Å; W1412-C1509 WeakPolarHBondContact O-CB 3.47Å; W1412-C1509 PolarHBondContact O-N 3.47Å; W1412-A1511 HydrophobicContact CH2-CB 3.97Å; W1412-A1511 HydrophobicContact CZ3-CB 3.69Å; W1412-L1516 HydrophobicContact CH2-CD1 3.73Å; W1412-L1516 HydrophobicContact CH2-CD2 4.42Å; W1412-L1516 HydrophobicContact CZ2-CD1 4.03Å; W1412-L1516 HydrophobicContact CZ2-CD2 4.27Å; W1412-L1516 HydrophobicContact CZ3-CD1 4.44Å
1413	L	87.5	Confident	72.6	Confident	2 Å²	2	68 Å²	68	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.7	168.9	-68.2	164.8	0	0	0	110.5	I975 N1421 S1422 V1502 L1506 E1507 H1508	I975-L1413 HydrophobicContact CG2-CD1 3.37Å; I975-L1413 HydrophobicContact CG2-CG 3.64Å; I975-L1413 VanDerWaalsContact O-CD1 3.3Å; I975-L1413 WeakPolarHBondContact O-CD1 3.47Å; L1413-N1421 CarbonylContact O-C 3.39Å; L1413-N1421 VanDerWaalsContact O-CA 3.3Å; L1413-N1421 WeakPolarHBondContact O-CA 3.27Å; L1413-S1422 PolarHBondContact N-OG 2.75Å; L1413-S1422 PolarHBondContact O-N 2.88Å; L1413-V1502 HydrophobicContact CD1-CG1 3.5Å; L1413-V1502 VanDerWaalsContact CD1-CG1 3.5Å; L1413-V1502 HydrophobicContact CD2-CG1 4.31Å; L1413-L1506 HydrophobicContact CB-CB 4.23Å; L1413-L1506 HydrophobicContact CB-CD2 3.94Å; L1413-L1506 HydrophobicContact CD1-CD2 3.93Å; L1413-L1506 HydrophobicContact CD2-CB 4.12Å; L1413-L1506 HydrophobicContact CG-CD2 4.45Å; L1413-E1507 WeakPolarHBondContact CA-O 3.32Å; L1413-H1508 HydrophobicContact CD2-CB 4.22Å
1414	F	86.3	Confident	74.9	Confident	41 Å²	41	61.1 Å²	61.1	18%	0.18	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	122.6	170.3	169.8	-115.6	0	0	0	110.6	P1416 N1421 L1506 E1507	F1414-P1416 HydrophobicContact CE1-CB 4.05Å; F1414-P1416 WeakPolarHBondContact O-CD 3.45Å; F1414-N1421 WeakPolarHBondContact CB-OD1 3.31Å; F1414-N1421 WeakPolarHBondContact CD2-OD1 3.43Å; F1414-L1506 CarbonylContact O-C 3.56Å; F1414-L1506 WeakPolarHBondContact O-CA 3.36Å; F1414-E1507 HydrophobicContact CB-CB 4.41Å; F1414-E1507 HydrophobicContact CD1-CB 4.39Å; F1414-E1507 HydrophobicContact CD1-CG 4.45Å; F1414-E1507 PolarHBondContact N-O 3Å; F1414-E1507 PolarHBondContact O-N 2.94Å
1415	C	85.8	Confident	77.2	Confident	0 Å²	0	53.6 Å²	53.6	0%	0	26%	0.255	C	S	.	.			trans	-84.6	114.1	170.3	-173.6	0	0	0	0	110.3	I1417 C1418 R1419 I1420 C1498 L1506	C1415-I1417 PolarHBondContact O-N 3.28Å; C1415-C1418 HydrophobicContact CB-CB 4.21Å; C1415-C1418 PolarHBondContact SG-N 3.41Å; C1415-C1418 VanDerWaalsContact SG-N 3.35Å; C1415-R1419 WeakPolarHBondContact O-CA 3.18Å; C1415-R1419 PolarHBondContact O-N 3.45Å; C1415-I1420 PolarHBondContact N-O 3.37Å; C1415-I1420 PolarHBondContact O-N 3.25Å; C1415-C1498 VanDerWaalsContact CB-SG 3.56Å; C1415-C1498 PolarHBondContact SG-SG 3.2Å; C1415-L1506 HydrophobicContact CB-CD1 3.97Å; C1415-L1506 HydrophobicContact CB-CG 3.88Å
1416	P	81.6	Confident	79.2	Confident	28 Å²	28	51.4 Å²	51.4	18%	0.182	25%	0.251	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-16	176.7	31.4	-34.6	0	0	0	112.9	F1414 R1419 C1505 E1507	F1414-P1416 HydrophobicContact CE1-CB 4.05Å; F1414-P1416 WeakPolarHBondContact O-CD 3.45Å; P1416-R1419 WeakPolarHBondContact O-CD 3.42Å; P1416-R1419 PolarHBondContact O-NE 3.23Å; P1416-C1505 WeakPolarHBondContact CD-O 3.01Å; P1416-C1505 WeakPolarHBondContact CG-O 3.48Å; P1416-E1507 HydrophobicContact CG-CG 4.49Å
1417	I	79.3	Confident	80.9	Confident	100 Å²	100	46.9 Å²	46.9	51%	0.513	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-63.3	178.8	-50.6	169	0	0	0	109.4	C1415 R1419 H1500 C1505	C1415-I1417 PolarHBondContact O-N 3.28Å; I1417-R1419 VanDerWaalsContact C-N 3.27Å; I1417-R1419 PolarHBondContact O-N 3.47Å; I1417-H1500 VanDerWaalsContact CD1-CD2 3.48Å; I1417-H1500 WeakPolarHBondContact CD1-CD2 3.42Å; I1417-H1500 WeakPolarHBondContact CG2-NE2 3.48Å; I1417-C1505 HydrophobicContact CD1-CB 4.17Å
1418	C	79.1	Confident	82.1	Confident	47 Å²	47	47.9 Å²	47.9	32%	0.318	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-15.2	176.6	-69.2	0	0	0	0	114.8	C1415 I1420 H1500	C1415-C1418 HydrophobicContact CB-CB 4.21Å; C1415-C1418 PolarHBondContact SG-N 3.41Å; C1415-C1418 VanDerWaalsContact SG-N 3.35Å; C1418-I1420 HydrophobicContact CB-CB 3.89Å; C1418-I1420 HydrophobicContact CB-CD1 3.85Å; C1418-I1420 HydrophobicContact CB-CG1 3.91Å; C1418-I1420 PolarHBondContact O-N 2.95Å; C1418-H1500 PolarHBondContact SG-CE1 3.14Å; C1418-H1500 PolarHBondContact SG-ND1 2.83Å
1419	R	80.5	Confident	82.3	Confident	184 Å²	184	42.8 Å²	42.8	69%	0.694	22%	0.22	S	C	*	.			trans	60.2	21.8	-168.6	-53.4	-60.6	175.8	139.7	-1.5	114.8	C1415 P1416 I1417	C1415-R1419 WeakPolarHBondContact O-CA 3.18Å; C1415-R1419 PolarHBondContact O-N 3.45Å; P1416-R1419 WeakPolarHBondContact O-CD 3.42Å; P1416-R1419 PolarHBondContact O-NE 3.23Å; I1417-R1419 VanDerWaalsContact C-N 3.27Å; I1417-R1419 PolarHBondContact O-N 3.47Å
1420	I	75.7	Confident	82.2	Confident	52 Å²	52	45.2 Å²	45.2	27%	0.267	23%	0.233	S	C	.	.			trans	-94.5	133.8	-175.9	-80.8	177.6	0	0	0	110.8	C1415 C1418 F1496 Q1497 C1498	C1415-I1420 PolarHBondContact N-O 3.37Å; C1415-I1420 PolarHBondContact O-N 3.25Å; C1418-I1420 HydrophobicContact CB-CB 3.89Å; C1418-I1420 HydrophobicContact CB-CD1 3.85Å; C1418-I1420 HydrophobicContact CB-CG1 3.91Å; C1418-I1420 PolarHBondContact O-N 2.95Å; I1420-F1496 HydrophobicContact CG2-CD1 3.53Å; I1420-F1496 HydrophobicContact CG2-CE1 3.76Å; I1420-Q1497 WeakPolarHBondContact CD1-O 3.38Å; I1420-C1498 HydrophobicContact CG2-CB 4.28Å
1421	N	79.3	Confident	82.3	Confident	68 Å²	68	44.1 Å²	44.1	36%	0.364	23%	0.228	S	C	.	.	B	Isolated β-bridge	trans	-107.5	131.5	175.6	-73.4	-80.6	0	0	0	110.7	W1412 L1413 F1414 F1496	W1412-N1421 PolarHBondContact NE1-OD1 2.95Å; L1413-N1421 CarbonylContact O-C 3.39Å; L1413-N1421 VanDerWaalsContact O-CA 3.3Å; L1413-N1421 WeakPolarHBondContact O-CA 3.27Å; F1414-N1421 WeakPolarHBondContact CB-OD1 3.31Å; F1414-N1421 WeakPolarHBondContact CD2-OD1 3.43Å; N1421-F1496 WeakPolarHBondContact O-CE1 3.39Å; N1421-F1496 WeakPolarHBondContact O-CZ 3.34Å
1422	S	76.8	Confident	82.2	Confident	6 Å²	6	44.2 Å²	44.2	4%	0.042	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-62.3	152.9	167.2	82.6	0	0	0	0	110.4	W1412 L1413	W1412-S1422 WeakPolarHBondContact CA-OG 3.41Å; W1412-S1422 WeakPolarHBondContact CB-O 3.46Å; L1413-S1422 PolarHBondContact N-OG 2.75Å; L1413-S1422 PolarHBondContact O-N 2.88Å
1423	P	72.7	Confident	82.2	Confident	36 Å²	36	43.3 Å²	43.3	23%	0.234	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-58.5	146.2	172.3	25.2	-36.2	0	0	0	112	H974	H974-P1423 HydrophobicContact CB-CG 3.41Å; H974-P1423 VanDerWaalsContact CB-CG 3.41Å; H974-P1423 WeakPolarHBondContact O-CD 3.48Å
1424	I	80.2	Confident	82.4	Confident	36 Å²	36	43.2 Å²	43.2	19%	0.185	22%	0.224	C	C	.	.	P	Polyproline II helix	trans	-81.5	120.4	-174.2	-57	178.6	0	0	0	110.2	P1385 Q1410 M1411 W1412	P1385-I1424 HydrophobicContact CG-CD1 3.87Å; Q1410-I1424 HydrophobicContact CB-CG2 3.76Å; Q1410-I1424 HydrophobicContact CG-CG2 4.16Å; M1411-I1424 WeakPolarHBondContact O-CA 3.29Å; W1412-I1424 HydrophobicContact CB-CG1 4.16Å; W1412-I1424 HydrophobicContact CD2-CD1 4.45Å; W1412-I1424 HydrophobicContact CD2-CG1 4.11Å; W1412-I1424 HydrophobicContact CE3-CD1 4.21Å; W1412-I1424 HydrophobicContact CE3-CG1 4.01Å; W1412-I1424 HydrophobicContact CE3-CG2 4.16Å; W1412-I1424 HydrophobicContact CG-CG1 4.2Å; W1412-I1424 HydrophobicContact CZ3-CD1 4.47Å
1425	K	80.9	Confident	82.7	Confident	45 Å²	45	41.2 Å²	41.2	20%	0.196	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	156	172.9	-70.8	-160.1	178.3	-171.3	0	112.2	D973 H974 Q1410 M1411	D973-K1425 VanDerWaalsContact N-NZ 3.13Å; H974-K1425 WeakPolarHBondContact CD2-CE 3.48Å; H974-K1425 PolarHBondContact CD2-NZ 3.4Å; H974-K1425 VanDerWaalsContact CD2-NZ 3.31Å; H974-K1425 PolarHBondContact NE2-NZ 3.34Å; Q1410-K1425 CarbonylContact C-O 3.57Å; Q1410-K1425 WeakPolarHBondContact CA-O 3.25Å; M1411-K1425 PolarHBondContact N-O 3.34Å; M1411-K1425 PolarHBondContact O-N 2.95Å
1426	H	83.8	Confident	83.1	Confident	107 Å²	107	41.7 Å²	41.7	50%	0.495	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	133.3	167	-81.9	-85.2	0	0	0	110.3	C1407 S1428	C1407-H1426 PolarHBondContact O-ND1 2.84Å; H1426-S1428 PolarHBondContact O-N 3.16Å
1427	M	86.6	Confident	83.7	Confident	2 Å²	2	40.6 Å²	40.6	1%	0.01	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-61.7	124.5	-179.5	176	160.1	76.4	0	0	111.3	L1340 C1407 I1409 M1411 T1431 W1432 F1510	L1340-M1427 HydrophobicContact CD1-CE 4.22Å; L1340-M1427 HydrophobicContact CD1-SD 4.44Å; C1407-M1427 WeakPolarHBondContact CB-O 3.33Å; C1407-M1427 PolarHBondContact SG-O 2.81Å; I1409-M1427 HydrophobicContact CB-CB 4.36Å; I1409-M1427 HydrophobicContact CB-CE 3.95Å; I1409-M1427 HydrophobicContact CD1-CE 3.5Å; I1409-M1427 HydrophobicContact CG1-CE 4.28Å; I1409-M1427 HydrophobicContact CG2-CB 4.42Å; I1409-M1427 HydrophobicContact CG2-CE 4Å; I1409-M1427 PolarHBondContact O-N 3.45Å; M1411-M1427 HydrophobicContact CE-CB 3.61Å; M1411-M1427 HydrophobicContact CE-CG 3.52Å; M1411-M1427 HydrophobicContact CE-SD 3.67Å; M1427-T1431 HydrophobicContact CG-CG2 3.75Å; M1427-T1431 HydrophobicContact SD-CG2 3.93Å; M1427-W1432 HydrophobicContact CE-CB 4.04Å; M1427-W1432 HydrophobicContact CE-CG 4.09Å; M1427-F1510 HydrophobicContact SD-CE1 4.38Å
1428	S	83	Confident	84.3	Confident	38 Å²	38	36 Å²	36	27%	0.266	19%	0.187	S	C	.	.	P	Polyproline II helix	trans	-59.8	170.1	-177.6	87.3	0	0	0	0	113.9	R682 N972 H1426 D1430 T1431 W1432	R682-S1428 PolarHBondContact NH2-O 3.04Å; N972-S1428 PolarHBondContact OD1-N 3.01Å; H1426-S1428 PolarHBondContact O-N 3.16Å; S1428-D1430 PolarHBondContact OG-N 3.39Å; S1428-T1431 WeakPolarHBondContact OG-CB 3.46Å; S1428-T1431 PolarHBondContact OG-N 3.49Å; S1428-T1431 PolarHBondContact OG-OG1 3.36Å; S1428-W1432 PolarHBondContact O-N 3.04Å
1429	A	79.4	Confident	85	Confident	51 Å²	51	33.8 Å²	33.8	42%	0.421	17%	0.172	S	C	.	.	H	α-helix	trans	-62.8	-45.7	173.5	0	0	0	0	0	111.5	W1432 H1433	A1429-W1432 WeakPolarHBondContact O-CB 3.3Å; A1429-W1432 PolarHBondContact O-N 3.49Å; A1429-H1433 PolarHBondContact O-ND1 2.91Å
1430	D	84.3	Confident	85.6	Confident	54 Å²	54	25 Å²	25	29%	0.289	14%	0.139	S	C	.	.	H	α-helix	trans	-75	-39.6	-175.7	-73	27.5	0	0	0	110.9	Q964 L965 A968 S1428 W1432 H1433 L1434	Q964-D1430 PolarHBondContact NE2-OD2 3.42Å; L965-D1430 HydrophobicContact CD2-CB 3.96Å; L965-D1430 WeakPolarHBondContact CD2-O 3.38Å; A968-D1430 HydrophobicContact CB-CB 3.51Å; S1428-D1430 PolarHBondContact OG-N 3.39Å; D1430-W1432 VanDerWaalsContact C-N 3.26Å; D1430-W1432 PolarHBondContact O-N 3.34Å; D1430-H1433 CarbonylContact O-C 3.53Å; D1430-H1433 WeakPolarHBondContact O-CA 3.23Å; D1430-H1433 WeakPolarHBondContact O-CB 3.23Å; D1430-H1433 PolarHBondContact O-N 3.32Å; D1430-L1434 PolarHBondContact O-N 2.88Å; D1430-L1434 VanDerWaalsContact O-N 3.11Å
1431	T	88	Confident	86.4	Confident	0 Å²	0	22.8 Å²	22.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.6	-35.9	173.3	-53.6	0	0	0	0	112.6	A968 Y969 N972 M1411 M1427 S1428 H1433 L1434	A968-T1431 PolarHBondContact O-OG1 3.39Å; Y969-T1431 HydrophobicContact CD2-CG2 3.51Å; Y969-T1431 HydrophobicContact CE2-CG2 4.22Å; Y969-T1431 HydrophobicContact CG-CG2 4.37Å; N972-T1431 PolarHBondContact ND2-OG1 3.35Å; M1411-T1431 HydrophobicContact CE-CG2 3.6Å; M1427-T1431 HydrophobicContact CG-CG2 3.75Å; M1427-T1431 HydrophobicContact SD-CG2 3.93Å; S1428-T1431 WeakPolarHBondContact OG-CB 3.46Å; S1428-T1431 PolarHBondContact OG-N 3.49Å; S1428-T1431 PolarHBondContact OG-OG1 3.36Å; T1431-H1433 PolarHBondContact O-N 3.39Å; T1431-L1434 WeakPolarHBondContact O-CB 3.41Å; T1431-L1434 PolarHBondContact O-N 3.42Å
1432	W	88.4	Confident	86.8	Confident	5 Å²	5	19.5 Å²	19.5	2%	0.019	11%	0.11	C	C	.	.	H	α-helix	trans	-62.1	-31	174.8	-172	109.8	0	0	0	111.6	L681 R682 P1335 G1337 L1338 E1341 M1427 S1428 A1429 D1430	L681-W1432 HydrophobicContact CB-CH2 4.33Å; L681-W1432 HydrophobicContact CB-CZ3 3.73Å; R682-W1432 HydrophobicContact CG-CD2 3.99Å; R682-W1432 HydrophobicContact CG-CE3 4.03Å; R682-W1432 HydrophobicContact CG-CH2 3.87Å; R682-W1432 HydrophobicContact CG-CZ2 3.77Å; R682-W1432 HydrophobicContact CG-CZ3 4Å; R682-W1432 VanDerWaalsContact NH2-CD1 3.3Å; P1335-W1432 HydrophobicContact CB-CE3 3.94Å; P1335-W1432 HydrophobicContact CB-CH2 4.38Å; P1335-W1432 HydrophobicContact CB-CZ3 3.69Å; P1335-W1432 WeakPolarHBondContact CB-O 3.1Å; P1335-W1432 HydrophobicContact CG-CH2 4.47Å; P1335-W1432 HydrophobicContact CG-CZ3 3.87Å; G1337-W1432 PolarHBondContact N-O 2.93Å; G1337-W1432 VanDerWaalsContact N-O 3.09Å; L1338-W1432 HydrophobicContact CB-CH2 3.78Å; L1338-W1432 HydrophobicContact CB-CZ2 4.04Å; L1338-W1432 HydrophobicContact CB-CZ3 4.45Å; E1341-W1432 PolarHBondContact OE1-NE1 3.17Å; M1427-W1432 HydrophobicContact CE-CB 4.04Å; M1427-W1432 HydrophobicContact CE-CG 4.09Å; S1428-W1432 PolarHBondContact O-N 3.04Å; A1429-W1432 WeakPolarHBondContact O-CB 3.3Å; A1429-W1432 PolarHBondContact O-N 3.49Å; D1430-W1432 VanDerWaalsContact C-N 3.26Å; D1430-W1432 PolarHBondContact O-N 3.34Å
1433	H	87.5	Confident	87.4	Confident	7 Å²	7	19.3 Å²	19.3	3%	0.032	11%	0.108	C	C	.	.	H	α-helix	trans	-87.7	-7.5	178.5	-69.1	89.2	0	0	0	114.6	L681 L965 A1429 D1430 T1431	L681-H1433 PolarHBondContact N-NE2 3.42Å; L965-H1433 HydrophobicContact CD2-CB 4.15Å; A1429-H1433 PolarHBondContact O-ND1 2.91Å; D1430-H1433 CarbonylContact O-C 3.53Å; D1430-H1433 WeakPolarHBondContact O-CA 3.23Å; D1430-H1433 WeakPolarHBondContact O-CB 3.23Å; D1430-H1433 PolarHBondContact O-N 3.32Å; T1431-H1433 PolarHBondContact O-N 3.39Å
1434	L	91.8	Very high	88.3	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	S	Bend	trans	-56.1	139.5	172.6	-178.4	66.2	0	0	0	110.2	L965 Y969 P1335 L1336 D1430 T1431 F1436 K1438 F1439	L965-L1434 HydrophobicContact CB-CD1 4.02Å; Y969-L1434 HydrophobicContact CD1-CD2 4.12Å; Y969-L1434 HydrophobicContact CG-CD2 3.98Å; P1335-L1434 CarbonylContact C-O 3.6Å; P1335-L1434 WeakPolarHBondContact CA-O 3.41Å; L1336-L1434 HydrophobicContact CD2-CD2 4.43Å; L1336-L1434 PolarHBondContact N-O 2.82Å; D1430-L1434 PolarHBondContact O-N 2.88Å; D1430-L1434 VanDerWaalsContact O-N 3.11Å; T1431-L1434 WeakPolarHBondContact O-CB 3.41Å; T1431-L1434 PolarHBondContact O-N 3.42Å; L1434-F1436 PolarHBondContact O-N 2.96Å; L1434-K1438 HydrophobicContact CD1-CG 4.35Å; L1434-F1439 HydrophobicContact CD2-CB 4.04Å
1435	S	92.2	Very high	88.6	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.091	C	C	.	.	B	Isolated β-bridge	trans	-60	125.8	173.6	159.6	0	0	0	0	110.1	Y1329 D1333 V1437 K1438 F1439	Y1329-S1435 VanDerWaalsContact CE1-CB 3.44Å; D1333-S1435 PolarHBondContact OD1-OG 2.98Å; D1333-S1435 WeakPolarHBondContact OD2-CB 3.44Å; D1333-S1435 PolarHBondContact OD2-OG 3.09Å; S1435-V1437 PolarHBondContact O-N 3.19Å; S1435-V1437 PolarHBondContact OG-N 3.4Å; S1435-K1438 PolarHBondContact O-N 2.77Å; S1435-K1438 VanDerWaalsContact O-N 3.14Å; S1435-K1438 PolarHBondContact OG-N 3.17Å; S1435-F1439 PolarHBondContact O-N 3.42Å
1436	F	94.8	Very high	88.7	Confident	10 Å²	10	14.5 Å²	14.5	4%	0.044	8%	0.083	C	C	.	.	H	α-helix	trans	-57.2	-39.3	174.8	171	-107.5	0	0	0	111.2	L1334 L1336 F1339 F1366 L1434 F1439 L1440 F1519	L1334-F1436 WeakPolarHBondContact O-CB 3.26Å; L1334-F1436 PolarHBondContact O-N 3.47Å; L1336-F1436 HydrophobicContact CD1-CD2 3.95Å; F1339-F1436 HydrophobicContact CB-CB 4.27Å; F1339-F1436 HydrophobicContact CB-CD2 4.1Å; F1339-F1436 HydrophobicContact CB-CG 4.12Å; F1339-F1436 AromaticContact CD1-CD2 3.68Å; F1339-F1436 HydrophobicContact CD1-CD2 3.68Å; F1339-F1436 AromaticContact CD1-CE2 3.59Å; F1339-F1436 HydrophobicContact CD1-CE2 3.59Å; F1339-F1436 HydrophobicContact CD1-CG 4.32Å; F1339-F1436 HydrophobicContact CD1-CZ 4.15Å; F1339-F1436 AromaticContact CD2-CD1 3.88Å; F1339-F1436 HydrophobicContact CD2-CD1 3.88Å; F1339-F1436 HydrophobicContact CD2-CD2 4.13Å; F1339-F1436 AromaticContact CD2-CE1 3.98Å; F1339-F1436 HydrophobicContact CD2-CE1 3.98Å; F1339-F1436 HydrophobicContact CD2-CE2 4.24Å; F1339-F1436 AromaticContact CD2-CG 3.97Å; F1339-F1436 HydrophobicContact CD2-CG 3.97Å; F1339-F1436 HydrophobicContact CD2-CZ 4.17Å; F1339-F1436 HydrophobicContact CE1-CD2 4.15Å; F1339-F1436 AromaticContact CE1-CE2 3.57Å; F1339-F1436 HydrophobicContact CE1-CE2 3.57Å; F1339-F1436 AromaticContact CE1-CZ 3.8Å; F1339-F1436 HydrophobicContact CE1-CZ 3.8Å; F1339-F1436 HydrophobicContact CE2-CD1 4.14Å; F1339-F1436 AromaticContact CE2-CE1 3.75Å; F1339-F1436 HydrophobicContact CE2-CE1 3.75Å; F1339-F1436 HydrophobicContact CE2-CE2 4.22Å; F1339-F1436 AromaticContact CE2-CZ 3.8Å; F1339-F1436 HydrophobicContact CE2-CZ 3.8Å; F1339-F1436 HydrophobicContact CG-CD1 4.25Å; F1339-F1436 AromaticContact CG-CD2 3.68Å; F1339-F1436 HydrophobicContact CG-CD2 3.68Å; F1339-F1436 HydrophobicContact CG-CE1 4.48Å; F1339-F1436 AromaticContact CG-CE2 3.95Å; F1339-F1436 HydrophobicContact CG-CE2 3.95Å; F1339-F1436 AromaticContact CG-CG 3.86Å; F1339-F1436 HydrophobicContact CG-CG 3.86Å; F1339-F1436 HydrophobicContact CG-CZ 4.34Å; F1339-F1436 HydrophobicContact CZ-CE1 4.06Å; F1339-F1436 AromaticContact CZ-CE2 3.9Å; F1339-F1436 HydrophobicContact CZ-CE2 3.9Å; F1339-F1436 AromaticContact CZ-CZ 3.61Å; F1339-F1436 HydrophobicContact CZ-CZ 3.61Å; F1366-F1436 AromaticContact CE1-CE1 3.89Å; F1366-F1436 HydrophobicContact CE1-CE1 3.89Å; F1366-F1436 AromaticContact CE1-CZ 4Å; F1366-F1436 HydrophobicContact CE1-CZ 4Å; F1366-F1436 HydrophobicContact CE2-CZ 4Å; F1366-F1436 AromaticContact CZ-CE1 3.89Å; F1366-F1436 HydrophobicContact CZ-CE1 3.89Å; F1366-F1436 AromaticContact CZ-CZ 3.54Å; F1366-F1436 HydrophobicContact CZ-CZ 3.54Å; L1434-F1436 PolarHBondContact O-N 2.96Å; F1436-F1439 HydrophobicContact CD2-CD1 4.24Å; F1436-F1439 HydrophobicContact CE2-CD1 4.24Å; F1436-F1439 WeakPolarHBondContact O-CB 3.45Å; F1436-F1439 PolarHBondContact O-N 3.49Å; F1436-L1440 HydrophobicContact CD1-CD1 4.4Å; F1436-L1440 HydrophobicContact CE1-CD1 3.63Å; F1436-L1440 HydrophobicContact CE1-CG 4.2Å; F1436-L1440 HydrophobicContact CE2-CD2 4.41Å; F1436-L1440 HydrophobicContact CE2-CG 4.34Å; F1436-L1440 HydrophobicContact CZ-CD1 3.74Å; F1436-L1440 HydrophobicContact CZ-CD2 4.09Å; F1436-L1440 HydrophobicContact CZ-CG 3.94Å; F1436-L1440 PolarHBondContact O-N 3.09Å; F1436-L1440 VanDerWaalsContact O-N 3.08Å; F1436-F1519 AromaticContact CE2-CE1 3.69Å; F1436-F1519 HydrophobicContact CE2-CE1 3.69Å; F1436-F1519 AromaticContact CE2-CZ 3.84Å; F1436-F1519 HydrophobicContact CE2-CZ 3.84Å; F1436-F1519 HydrophobicContact CZ-CE1 4.15Å
1437	V	93.2	Very high	88	Confident	4 Å²	4	10.2 Å²	10.2	2%	0.024	7%	0.065	C	C	.	.	H	α-helix	trans	-74.7	-30.5	179	178.2	0	0	0	0	112.1	L1300 F1302 V1326 F1328 D1333 S1435 L1440 D1441	L1300-V1437 HydrophobicContact CB-CG1 3.45Å; L1300-V1437 VanDerWaalsContact CB-CG1 3.45Å; L1300-V1437 HydrophobicContact CD2-CG1 3.97Å; L1300-V1437 HydrophobicContact CG-CG1 4.34Å; F1302-V1437 HydrophobicContact CE1-CG1 4Å; F1302-V1437 HydrophobicContact CE1-CG2 4.1Å; F1302-V1437 HydrophobicContact CZ-CG2 4.44Å; V1326-V1437 HydrophobicContact CB-CB 4.48Å; V1326-V1437 HydrophobicContact CB-CG1 4.18Å; V1326-V1437 HydrophobicContact CB-CG2 3.93Å; V1326-V1437 HydrophobicContact CG1-CB 4.34Å; V1326-V1437 HydrophobicContact CG1-CG2 3.78Å; V1326-V1437 HydrophobicContact CG2-CG2 4.41Å; F1328-V1437 HydrophobicContact CD1-CB 4.34Å; F1328-V1437 HydrophobicContact CD1-CG1 4.07Å; F1328-V1437 HydrophobicContact CE1-CG1 3.95Å; D1333-V1437 WeakPolarHBondContact OD1-CG2 3.48Å; D1333-V1437 PolarHBondContact OD1-N 3.3Å; S1435-V1437 PolarHBondContact O-N 3.19Å; S1435-V1437 PolarHBondContact OG-N 3.4Å; V1437-L1440 PolarHBondContact O-N 2.87Å; V1437-D1441 WeakPolarHBondContact O-CB 3.2Å; V1437-D1441 PolarHBondContact O-N 3.03Å
1438	K	92.9	Very high	86.9	Confident	5 Å²	5	13.5 Å²	13.5	2%	0.022	8%	0.083	C	C	.	.	H	α-helix	trans	-69.4	-33.6	169.7	-177.7	59.4	-165.5	162.5	0	112.2	E966 S1064 F1328 L1434 S1435 D1441 L1442	E966-K1438 WeakPolarHBondContact OE2-CE 3.4Å; E966-K1438 IonicContact OE2-NZ 3.27Å; S1064-K1438 VanDerWaalsContact CB-NZ 3.31Å; F1328-K1438 HydrophobicContact CD1-CB 3.79Å; F1328-K1438 HydrophobicContact CD1-CD 4.43Å; F1328-K1438 HydrophobicContact CE1-CB 4.15Å; F1328-K1438 HydrophobicContact CE1-CD 4.24Å; F1328-K1438 HydrophobicContact CG-CB 4.34Å; F1328-K1438 HydrophobicContact CZ-CD 4.29Å; L1434-K1438 HydrophobicContact CD1-CG 4.35Å; S1435-K1438 PolarHBondContact O-N 2.77Å; S1435-K1438 VanDerWaalsContact O-N 3.14Å; S1435-K1438 PolarHBondContact OG-N 3.17Å; K1438-D1441 HydrophobicContact CD-CB 4.35Å; K1438-D1441 IonicContact NZ-OD2 2.74Å; K1438-D1441 PolarHBondContact NZ-OD2 3.19Å; K1438-D1441 PolarHBondContact O-N 2.75Å; K1438-L1442 HydrophobicContact CG-CD1 4.38Å; K1438-L1442 VanDerWaalsContact O-CG 3.32Å; K1438-L1442 WeakPolarHBondContact O-CG 3Å; K1438-L1442 PolarHBondContact O-N 2.96Å
1439	F	93.6	Very high	85.5	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.1	-41.1	171.3	162.8	-100.4	0	0	0	111.9	Y969 L1336 L1434 S1435 F1436 L1442 I1443 H1508 F1510 F1519	Y969-F1439 HydrophobicContact CE1-CD2 4.05Å; Y969-F1439 HydrophobicContact CE1-CE2 4.3Å; L1336-F1439 HydrophobicContact CD1-CD1 3.78Å; L1336-F1439 HydrophobicContact CD1-CE1 4.08Å; L1336-F1439 HydrophobicContact CD1-CG 4.07Å; L1336-F1439 HydrophobicContact CD2-CB 4.38Å; L1336-F1439 HydrophobicContact CD2-CD2 4.06Å; L1336-F1439 HydrophobicContact CD2-CG 4.1Å; L1434-F1439 HydrophobicContact CD2-CB 4.04Å; S1435-F1439 PolarHBondContact O-N 3.42Å; F1436-F1439 HydrophobicContact CD2-CD1 4.24Å; F1436-F1439 HydrophobicContact CE2-CD1 4.24Å; F1436-F1439 WeakPolarHBondContact O-CB 3.45Å; F1436-F1439 PolarHBondContact O-N 3.49Å; F1439-L1442 PolarHBondContact O-N 3.37Å; F1439-I1443 HydrophobicContact CD2-CD1 4.24Å; F1439-I1443 HydrophobicContact CE1-CD1 3.93Å; F1439-I1443 HydrophobicContact CE2-CD1 3.57Å; F1439-I1443 HydrophobicContact CE2-CG1 4.42Å; F1439-I1443 HydrophobicContact CZ-CD1 3.39Å; F1439-I1443 PolarHBondContact O-N 3.25Å; F1439-H1508 HydrophobicContact CZ-CB 4.29Å; F1439-F1510 HydrophobicContact CE2-CE2 4.19Å; F1439-F1510 AromaticContact CE2-CZ 3.91Å; F1439-F1510 HydrophobicContact CE2-CZ 3.91Å; F1439-F1510 AromaticContact CZ-CE2 3.76Å; F1439-F1510 HydrophobicContact CZ-CE2 3.76Å; F1439-F1510 AromaticContact CZ-CZ 3.91Å; F1439-F1510 HydrophobicContact CZ-CZ 3.91Å; F1439-F1519 HydrophobicContact CE1-CB 4.43Å; F1439-F1519 AromaticContact CE1-CD1 3.86Å; F1439-F1519 HydrophobicContact CE1-CD1 3.86Å; F1439-F1519 AromaticContact CE1-CD2 3.88Å; F1439-F1519 HydrophobicContact CE1-CD2 3.88Å; F1439-F1519 AromaticContact CE1-CE1 3.96Å; F1439-F1519 HydrophobicContact CE1-CE1 3.96Å; F1439-F1519 AromaticContact CE1-CE2 3.98Å; F1439-F1519 HydrophobicContact CE1-CE2 3.98Å; F1439-F1519 AromaticContact CE1-CG 3.8Å; F1439-F1519 HydrophobicContact CE1-CG 3.8Å; F1439-F1519 HydrophobicContact CE1-CZ 4.01Å; F1439-F1519 HydrophobicContact CZ-CB 4.23Å; F1439-F1519 HydrophobicContact CZ-CD1 4.46Å; F1439-F1519 AromaticContact CZ-CD2 3.87Å; F1439-F1519 HydrophobicContact CZ-CD2 3.87Å; F1439-F1519 HydrophobicContact CZ-CE2 4.28Å; F1439-F1519 AromaticContact CZ-CG 3.95Å; F1439-F1519 HydrophobicContact CZ-CG 3.95Å
1440	L	93.1	Very high	84	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-63.7	-44.8	170.9	-67	179.1	0	0	0	112.3	L1300 F1366 V1373 F1436 V1437 L1442 I1443 I1444	L1300-L1440 HydrophobicContact CD2-CB 4.11Å; F1366-L1440 HydrophobicContact CB-CD1 4.02Å; F1366-L1440 HydrophobicContact CB-CD2 4.41Å; F1366-L1440 HydrophobicContact CD1-CD1 3.64Å; F1366-L1440 HydrophobicContact CD2-CD1 4.25Å; F1366-L1440 HydrophobicContact CD2-CD2 4.04Å; F1366-L1440 HydrophobicContact CE1-CD1 4.06Å; F1366-L1440 HydrophobicContact CG-CD1 3.73Å; F1366-L1440 HydrophobicContact CG-CD2 4.22Å; V1373-L1440 HydrophobicContact CB-CD2 3.99Å; V1373-L1440 HydrophobicContact CG1-CD2 4.03Å; V1373-L1440 HydrophobicContact CG2-CD2 4.13Å; F1436-L1440 HydrophobicContact CD1-CD1 4.4Å; F1436-L1440 HydrophobicContact CE1-CD1 3.63Å; F1436-L1440 HydrophobicContact CE1-CG 4.2Å; F1436-L1440 HydrophobicContact CE2-CD2 4.41Å; F1436-L1440 HydrophobicContact CE2-CG 4.34Å; F1436-L1440 HydrophobicContact CZ-CD1 3.74Å; F1436-L1440 HydrophobicContact CZ-CD2 4.09Å; F1436-L1440 HydrophobicContact CZ-CG 3.94Å; F1436-L1440 PolarHBondContact O-N 3.09Å; F1436-L1440 VanDerWaalsContact O-N 3.08Å; V1437-L1440 PolarHBondContact O-N 2.87Å; L1440-L1442 VanDerWaalsContact C-N 3.32Å; L1440-L1442 PolarHBondContact O-N 2.94Å; L1440-I1443 PolarHBondContact O-N 2.96Å; L1440-I1443 VanDerWaalsContact O-N 3.16Å; L1440-I1444 VanDerWaalsContact O-CG1 3.29Å; L1440-I1444 WeakPolarHBondContact O-CG1 3.35Å; L1440-I1444 PolarHBondContact O-N 3.22Å
1441	D	91.1	Very high	82.3	Confident	4 Å²	4	16 Å²	16	2%	0.021	9%	0.086	C	C	.	.	H	α-helix	trans	-57.6	-41.5	177.1	176.1	57.1	0	0	0	112.5	L1300 F1328 V1437 K1438 I1444 N1445	L1300-D1441 HydrophobicContact CD1-CB 4.15Å; L1300-D1441 HydrophobicContact CD2-CB 4.16Å; F1328-D1441 HydrophobicContact CE1-CB 3.91Å; F1328-D1441 HydrophobicContact CZ-CB 3.94Å; V1437-D1441 WeakPolarHBondContact O-CB 3.2Å; V1437-D1441 PolarHBondContact O-N 3.03Å; K1438-D1441 HydrophobicContact CD-CB 4.35Å; K1438-D1441 IonicContact NZ-OD2 2.74Å; K1438-D1441 PolarHBondContact NZ-OD2 3.19Å; K1438-D1441 PolarHBondContact O-N 2.75Å; D1441-I1444 PolarHBondContact O-N 2.71Å; D1441-N1445 WeakPolarHBondContact O-CB 3.32Å; D1441-N1445 PolarHBondContact O-N 3.43Å; D1441-N1445 PolarHBondContact OD1-ND2 3.29Å
1442	L	89.2	Confident	80.4	Confident	0 Å²	0	19.5 Å²	19.5	0%	0	10%	0.1	C	C	.	.	H	α-helix	trans	-63.3	-40.7	174.9	-72.6	163.9	0	0	0	112.7	E966 V1067 K1438 F1439 L1440 S1446 Y1503	E966-L1442 HydrophobicContact CG-CD1 4.07Å; E966-L1442 HydrophobicContact CG-CD2 4.26Å; V1067-L1442 HydrophobicContact CG2-CD2 3.95Å; K1438-L1442 HydrophobicContact CG-CD1 4.38Å; K1438-L1442 VanDerWaalsContact O-CG 3.32Å; K1438-L1442 WeakPolarHBondContact O-CG 3Å; K1438-L1442 PolarHBondContact O-N 2.96Å; F1439-L1442 PolarHBondContact O-N 3.37Å; L1440-L1442 VanDerWaalsContact C-N 3.32Å; L1440-L1442 PolarHBondContact O-N 2.94Å; L1442-S1446 VanDerWaalsContact O-CB 3.31Å; L1442-S1446 WeakPolarHBondContact O-CB 3.3Å; L1442-S1446 PolarHBondContact O-OG 2.92Å; L1442-Y1503 HydrophobicContact CB-CE1 4.16Å
1443	I	89.9	Confident	77.8	Confident	1 Å²	1	19.9 Å²	19.9	1%	0.005	10%	0.103	C	C	.	.	H	α-helix	trans	-70.3	-35.3	179.1	-68.8	177	0	0	0	111.9	V1373 F1439 L1440 Y1503 F1519 Y1521	V1373-I1443 HydrophobicContact CG1-CG2 4.43Å; V1373-I1443 HydrophobicContact CG2-CB 4.04Å; V1373-I1443 HydrophobicContact CG2-CG2 3.48Å; V1373-I1443 VanDerWaalsContact CG2-CG2 3.48Å; F1439-I1443 HydrophobicContact CD2-CD1 4.24Å; F1439-I1443 HydrophobicContact CE1-CD1 3.93Å; F1439-I1443 HydrophobicContact CE2-CD1 3.57Å; F1439-I1443 HydrophobicContact CE2-CG1 4.42Å; F1439-I1443 HydrophobicContact CZ-CD1 3.39Å; F1439-I1443 PolarHBondContact O-N 3.25Å; L1440-I1443 PolarHBondContact O-N 2.96Å; L1440-I1443 VanDerWaalsContact O-N 3.16Å; I1443-Y1503 HydrophobicContact CG1-CD1 4.29Å; I1443-F1519 HydrophobicContact CD1-CB 4.43Å; I1443-Y1521 HydrophobicContact CG2-CD2 4.38Å
1444	I	89.6	Confident	75.4	Confident	2 Å²	2	20.8 Å²	20.8	1%	0.01	11%	0.114	C	C	.	.	H	α-helix	trans	-87.6	-43.2	-174.2	-60	169	0	0	0	112.2	Q1368 S1370 V1373 L1440 D1441	Q1368-I1444 HydrophobicContact CB-CG2 4.13Å; S1370-I1444 WeakPolarHBondContact OG-CG2 3.43Å; V1373-I1444 HydrophobicContact CG2-CD1 3.92Å; V1373-I1444 HydrophobicContact CG2-CG1 3.51Å; L1440-I1444 VanDerWaalsContact O-CG1 3.29Å; L1440-I1444 WeakPolarHBondContact O-CG1 3.35Å; L1440-I1444 PolarHBondContact O-N 3.22Å; D1441-I1444 PolarHBondContact O-N 2.71Å
1445	N	87.3	Confident	72.3	Confident	11 Å²	11	24 Å²	24	6%	0.059	13%	0.131	C	C	.	.	H	α-helix	trans	-109.9	9.7	-164.2	-58.2	-48.7	0	0	0	114.4	V1067 E1068 Q1368 S1370 D1441	V1067-N1445 HydrophobicContact CG1-CB 3.64Å; E1068-N1445 PolarHBondContact N-O 3.17Å; Q1368-N1445 PolarHBondContact OE1-ND2 3.38Å; Q1368-N1445 PolarHBondContact OE1-OD1 3Å; S1370-N1445 VanDerWaalsContact CB-OD1 3.26Å; S1370-N1445 WeakPolarHBondContact CB-OD1 3.46Å; S1370-N1445 PolarHBondContact OG-OD1 2.87Å; D1441-N1445 WeakPolarHBondContact O-CB 3.32Å; D1441-N1445 PolarHBondContact O-N 3.43Å; D1441-N1445 PolarHBondContact OD1-ND2 3.29Å
1446	S	82.7	Confident	69	Low	3 Å²	3	32.4 Å²	32.4	2%	0.021	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-70.1	148.7	169.3	63.9	0	0	0	0	112.3	S1066 L1442 Y1503 K1504	S1066-S1446 VanDerWaalsContact O-CA 3.32Å; S1066-S1446 WeakPolarHBondContact O-CA 3.3Å; L1442-S1446 VanDerWaalsContact O-CB 3.31Å; L1442-S1446 WeakPolarHBondContact O-CB 3.3Å; L1442-S1446 PolarHBondContact O-OG 2.92Å; S1446-Y1503 VanDerWaalsContact CB-CD2 3.49Å; S1446-Y1503 WeakPolarHBondContact OG-CB 3.29Å; S1446-Y1503 WeakPolarHBondContact OG-CD2 3.49Å; S1446-K1504 WeakPolarHBondContact O-CE 3.37Å; S1446-K1504 PolarHBondContact O-NZ 3.21Å
1447	S	68.6	Low	65.6	Low	18 Å²	18	37.2 Å²	37.2	13%	0.126	19%	0.194	C	C	.	.			trans	-73.7	151.8	169	81.3	0	0	0	0	111.5	E1068 N1449 L1450	E1068-S1447 VanDerWaalsContact OE2-CB 3.31Å; E1068-S1447 WeakPolarHBondContact OE2-CB 3.49Å; S1447-N1449 VanDerWaalsContact C-N 3.29Å; S1447-N1449 PolarHBondContact O-N 3.22Å; S1447-L1450 WeakPolarHBondContact OG-CB 3.19Å; S1447-L1450 WeakPolarHBondContact OG-CD1 3.13Å; S1447-L1450 WeakPolarHBondContact OG-CG 3.24Å
1448	D	64.6	Low	62.2	Low	70 Å²	70	44.2 Å²	44.2	37%	0.374	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.9	-28.2	-175	-60.1	-75.1	0	0	0	112.9	K1504	D1448-K1504 VanDerWaalsContact OD1-CD 3.23Å; D1448-K1504 WeakPolarHBondContact OD1-CD 3.44Å; D1448-K1504 VanDerWaalsContact OD1-CE 3.3Å; D1448-K1504 WeakPolarHBondContact OD1-CE 3.14Å; D1448-K1504 IonicContact OD1-NZ 3.82Å; D1448-K1504 PolarHBondContact OD1-NZ 2.61Å; D1448-K1504 IonicContact OD2-NZ 2.76Å; D1448-K1504 PolarHBondContact OD2-NZ 3.05Å
1449	N	53.6	Low	58.9	Low	118 Å²	118	49.3 Å²	49.3	63%	0.631	26%	0.256	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-16	-175.3	-58.6	-10.4	0	0	0	113.5	S1447 Y1452	S1447-N1449 VanDerWaalsContact C-N 3.29Å; S1447-N1449 PolarHBondContact O-N 3.22Å; N1449-Y1452 WeakPolarHBondContact O-CE2 3.48Å
1450	L	47.1	Very low	55.5	Low	77 Å²	77	51.7 Å²	51.7	40%	0.403	27%	0.272	S	S	.	.	S	Bend	trans	-87	-10.6	-167.2	-98.9	174.7	0	0	0	115.4	L978 S1447	L978-L1450 VanDerWaalsContact CD1-O 3.28Å; L978-L1450 WeakPolarHBondContact CD1-O 3.4Å; L978-L1450 WeakPolarHBondContact CD2-O 3.48Å; L978-L1450 WeakPolarHBondContact CG-O 3.43Å; S1447-L1450 WeakPolarHBondContact OG-CB 3.19Å; S1447-L1450 WeakPolarHBondContact OG-CD1 3.13Å; S1447-L1450 WeakPolarHBondContact OG-CG 3.24Å
1451	A	48.3	Very low	52.1	Low	2 Å²	2	56 Å²	56	2%	0.017	30%	0.295	C	S	.	.			trans	-151.5	113.5	-178.3	0	0	0	0	0	112.6	L978 S1501 V1502 Y1503	L978-A1451 HydrophobicContact CD1-CB 4.25Å; A1451-S1501 CarbonylContact O-C 2.79Å; A1451-S1501 VanDerWaalsContact O-CA 3.31Å; A1451-S1501 WeakPolarHBondContact O-CA 3.26Å; A1451-V1502 HydrophobicContact CB-CB 4Å; A1451-V1502 HydrophobicContact CB-CG2 4.16Å; A1451-V1502 PolarHBondContact O-N 2.75Å; A1451-Y1503 HydrophobicContact CB-CD2 3.99Å; A1451-Y1503 HydrophobicContact CB-CE2 3.82Å
1452	Y	48.1	Very low	48.9	Very low	72 Å²	72	63.4 Å²	63.4	28%	0.282	34%	0.335	S	S	.	.			trans	-119.5	-179.9	169.2	-60.7	-86	0	0	0	109.3	Q977 P979 N1449 P1499 V1502	Q977-Y1452 VanDerWaalsContact O-O 3.09Å; P979-Y1452 HydrophobicContact CG-CD2 3.58Å; P979-Y1452 HydrophobicContact CG-CE2 4.48Å; P979-Y1452 HydrophobicContact CG-CG 4.24Å; N1449-Y1452 WeakPolarHBondContact O-CE2 3.48Å; Y1452-P1499 VanDerWaalsContact CD1-C 3.46Å; Y1452-P1499 WeakPolarHBondContact CD1-O 3.26Å; Y1452-P1499 WeakPolarHBondContact CE1-O 3.41Å; Y1452-V1502 WeakPolarHBondContact O-CG2 3.27Å
1453	C	34.6	Very low	45.6	Very low	13 Å²	13	69.3 Å²	69.3	9%	0.088	37%	0.371	C	S	.	.	B	Isolated β-bridge	trans	-122	102.6	-176.5	173.8	0	0	0	0	111.5	Q1497 C1498 V1502 L1506	C1453-Q1497 CarbonylContact O-C 3.05Å; C1453-Q1497 WeakPolarHBondContact O-CA 3.38Å; C1453-C1498 HydrophobicContact CB-CB 4.02Å; C1453-C1498 PolarHBondContact N-O 3.08Å; C1453-C1498 VanDerWaalsContact N-O 3.16Å; C1453-C1498 PolarHBondContact O-N 3.34Å; C1453-V1502 HydrophobicContact CB-CG2 4.32Å; C1453-L1506 HydrophobicContact CB-CD2 4.35Å
1454	G	36.1	Very low	42.4	Very low	26 Å²	26	76.3 Å²	76.3	27%	0.268	41%	0.414	S	S	.	.			trans	103.1	141.6	163.2	0	0	0	0	0	116.1	F1496	G1454-F1496 WeakPolarHBondContact CA-O 3.02Å
1455	L	27.3	Very low	39	Very low	69 Å²	69	81 Å²	81	36%	0.361	45%	0.447	S	S	.	.			trans	-85.1	149.3	176.3	-72.2	170.8	0	0	0	113.5	Q977 N1457 Q1497	Q977-L1455 HydrophobicContact CG-CD1 4.48Å; Q977-L1455 HydrophobicContact CG-CG 4.22Å; L1455-N1457 PolarHBondContact O-N 2.98Å; L1455-Q1497 VanDerWaalsContact O-CG 3.26Å; L1455-Q1497 WeakPolarHBondContact O-CG 3.47Å; L1455-Q1497 PolarHBondContact O-NE2 3.08Å
1456	F	23.6	Very low	35.8	Very low	176 Å²	176	89.2 Å²	89.2	77%	0.772	49%	0.485	S	S	*	.			trans	-68.1	112.9	170.6	-69.2	-86.2	0	0	0	111.5
1457	N	23.3	Very low	32.8	Very low	111 Å²	111	95.8 Å²	95.8	59%	0.594	53%	0.525	S	S	*	.			trans	-110.9	134.4	161.9	-99.2	-7	0	0	0	109.5	L1455 Q1495 Q1497	L1455-N1457 PolarHBondContact O-N 2.98Å; N1457-Q1495 PolarHBondContact O-NE2 3.47Å; N1457-Q1497 VanDerWaalsContact N-NE2 3.18Å
1458	K	22	Very low	30.4	Very low	150 Å²	150	101.9 Å²	101.9	65%	0.652	56%	0.556	S	S	*	*			trans	-110.4	129	-176.7	-65.4	164	125.2	-178.3	0	109.5	V993	V993-K1458 HydrophobicContact CB-CD 4.1Å; V993-K1458 HydrophobicContact CG2-CB 3.46Å; V993-K1458 VanDerWaalsContact CG2-CB 3.46Å; V993-K1458 HydrophobicContact CG2-CD 3.51Å; V993-K1458 HydrophobicContact CG2-CG 3.9Å
1459	T	23.7	Very low	28.1	Very low	113 Å²	113	104.3 Å²	104.3	69%	0.693	57%	0.573	S	S	*	*			trans	-100.7	140.2	-179.2	45.2	0	0	0	0	111.9
1460	S	21.7	Very low	26.4	Very low	49 Å²	49	104.1 Å²	104.1	34%	0.343	58%	0.576	S	S	.	*			trans	-92.4	166.4	156.9	73.4	0	0	0	0	108.7	R992	R992-S1460 WeakPolarHBondContact CD-OG 3.25Å; R992-S1460 VanDerWaalsContact CZ-OG 3.32Å; R992-S1460 PolarHBondContact NE-OG 3.01Å; R992-S1460 PolarHBondContact NH1-OG 2.86Å
1461	D	22	Very low	25.1	Very low	90 Å²	90	107.8 Å²	107.8	48%	0.481	60%	0.596	S	S	.	*			cis	-135.3	174.7	4.4	-80.6	-73.1	0	0	0	109.4	R992	R992-D1461 IonicContact CZ-OD1 3.29Å; R992-D1461 VanDerWaalsContact CZ-OD1 3.3Å; R992-D1461 IonicContact CZ-OD2 2.71Å; R992-D1461 IonicContact NE-OD1 3.83Å; R992-D1461 IonicContact NE-OD2 3.48Å; R992-D1461 IonicContact NH1-OD2 3.35Å; R992-D1461 PolarHBondContact NH1-OD2 3.49Å; R992-D1461 IonicContact NH2-OD1 3.37Å; R992-D1461 PolarHBondContact NH2-OD1 3.44Å; R992-D1461 IonicContact NH2-OD2 3.32Å; R992-D1461 PolarHBondContact NH2-OD2 3.32Å
1462	D	22.8	Very low	23.7	Very low	160 Å²	160	111.4 Å²	111.4	86%	0.856	63%	0.627	S	S	*	*			trans	-161.5	158.3	139.8	-117.8	-30.3	0	0	0	112.1
1463	T	21.5	Very low	22.3	Very low	124 Å²	124	112.6 Å²	112.6	76%	0.761	65%	0.646	S	S	*	*			trans	-141.9	119.7	-170.9	54	0	0	0	0	114
1464	V	21.4	Very low	21.6	Very low	149 Å²	149	119 Å²	119	90%	0.903	68%	0.679	S	S	*	*			trans	-143.6	150.4	157.4	179.1	0	0	0	0	109.3
1465	S	19.6	Very low	20.9	Very low	100 Å²	100	123.7 Å²	123.7	70%	0.699	69%	0.694	S	S	*	*			trans	-89.5	163.3	-177.7	53.4	0	0	0	0	114.9
1466	E	18.4	Very low	20.6	Very low	183 Å²	183	126.1 Å²	126.1	86%	0.855	71%	0.713	S	S	*	*			trans	-11.2	134	155.5	-55.7	169.3	143.7	0	0	118.4
1467	V	20.6	Very low	20.4	Very low	142 Å²	142	121.8 Å²	121.8	86%	0.861	71%	0.705	S	S	*	*				-169.5	156	119.9	142	0	0	0	0	109.4
1468	N	17.5	Very low	20.1	Very low	146 Å²	146	124.5 Å²	124.5	78%	0.781	72%	0.719	S	S	*	*			trans	-93.4	-170.7	-172	-65.2	-51.5	0	0	0	114
1469	T	17.5	Very low	19.9	Very low	120 Å²	120	124.7 Å²	124.7	74%	0.736	73%	0.727	S	S	*	*			trans	80.4	104.1	155.3	46.4	0	0	0	0	120.4
1470	T	18.3	Very low	19.7	Very low	114 Å²	114	124.2 Å²	124.2	70%	0.699	73%	0.728	S	S	*	*				61.8	150.3	126.3	58.6	0	0	0	0	122.4
1471	D	18.6	Very low	19.5	Very low	154 Å²	154	126.8 Å²	126.8	82%	0.824	74%	0.741	S	S	*	*			trans	67.5	150.7	162.5	-51.5	-32.2	0	0	0	117.7
1472	A	19	Very low	19.3	Very low	79 Å²	79	132.5 Å²	132.5	65%	0.653	76%	0.756	S	S	*	*			cis	-161.7	161.3	-28.7	0	0	0	0	0	108.2
1473	S	19.2	Very low	19.2	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	76%	0.759	S	S	*	*			trans	32.6	114.6	158.1	61	0	0	0	0	119.9
1474	N	20.2	Very low	19.1	Very low	146 Å²	146	133 Å²	133	78%	0.781	75%	0.754	S	S	*	*				156.6	136.3	116.7	-81.1	-47.8	0	0	0	113.4
1475	E	20.2	Very low	19.1	Very low	126 Å²	126	134 Å²	134	59%	0.589	75%	0.753	S	S	*	*			trans	-68	137.9	143	-90.3	-152.6	108.7	0	0	107.9	K1018	K1018-E1475 VanDerWaalsContact CD-OE1 3.31Å; K1018-E1475 WeakPolarHBondContact CD-OE1 3.48Å; K1018-E1475 WeakPolarHBondContact CD-OE2 3.48Å; K1018-E1475 WeakPolarHBondContact CE-OE1 3.08Å; K1018-E1475 IonicContact NZ-OE1 3.35Å; K1018-E1475 PolarHBondContact NZ-OE1 2.96Å; K1018-E1475 IonicContact NZ-OE2 2.69Å; K1018-E1475 PolarHBondContact NZ-OE2 3.28Å
1476	P	21.6	Very low	19	Very low	119 Å²	119	137.7 Å²	137.7	77%	0.773	76%	0.759	S	S	*	*				-135	147.6	109.2	36.8	-29.2	0	0	0	113.4
1477	S	18.7	Very low	19.1	Very low	85 Å²	85	135.5 Å²	135.5	59%	0.594	75%	0.753	S	S	*	*			trans	-77	124	167.2	54.2	0	0	0	0	111.3
1478	L	17.4	Very low	19.1	Very low	168 Å²	168	136.4 Å²	136.4	88%	0.88	75%	0.748	S	S	*	*			trans	-155.8	149.7	150.6	-144.1	72.5	0	0	0	113
1479	N	18.6	Very low	19.3	Very low	155 Å²	155	136 Å²	136	83%	0.829	75%	0.751	S	S	*	*			trans	-70.1	136.2	152.6	-59	-64	0	0	0	108.4
1480	S	18.2	Very low	19.4	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	76%	0.759	S	S	*	*			trans	-177.1	136	138.2	-149	0	0	0	0	113.8
1481	V	18	Very low	19.6	Very low	102 Å²	102	138.2 Å²	138.2	62%	0.618	76%	0.758	S	S	*	*			trans	57.6	118.4	140.1	168.7	0	0	0	0	120.6
1482	R	17.8	Very low	19.9	Very low	210 Å²	210	137.2 Å²	137.2	79%	0.792	76%	0.759	S	S	*	*				33.7	134.5	128.7	-42.7	174.5	-174.1	167	-0.1	117.2
1483	Y	20.6	Very low	20.2	Very low	231 Å²	231	140.1 Å²	140.1	91%	0.906	76%	0.763	S	S	*	*				-135.6	167.5	60.2	-99.9	-102.5	0	0	0	113.4
1484	G	19.1	Very low	20.7	Very low	65 Å²	65	141 Å²	141	67%	0.67	76%	0.759	S	S	*	*			trans	-139.5	-174.3	173.7	0	0	0	0	0	111.1
1485	I	21.4	Very low	21.3	Very low	169 Å²	169	139.8 Å²	139.8	87%	0.867	75%	0.749	S	S	*	*			trans	-135.7	135.9	165	-87.1	169	0	0	0	108
1486	E	17.2	Very low	22.2	Very low	178 Å²	178	138 Å²	138	83%	0.832	74%	0.739	S	S	*	*			trans	-87.8	137	170.2	-57.6	170.5	124.3	0	0	109.1
1487	N	20.9	Very low	23.6	Very low	137 Å²	137	135.4 Å²	135.4	73%	0.733	72%	0.717	S	S	*	*			trans	-176.5	138.4	136.2	-103.7	-66.3	0	0	0	114.1
1488	Q	22	Very low	25.5	Very low	160 Å²	160	131.5 Å²	131.5	75%	0.748	69%	0.689	S	S	*	*			trans	59.1	75.9	145.3	-65.9	170.8	51.9	0	0	120.2
1489	T	20.2	Very low	27.8	Very low	137 Å²	137	128.1 Å²	128.1	84%	0.84	68%	0.677	S	S	*	*				33.1	101.3	124.5	56.5	0	0	0	0	119.3
1490	M	19.4	Very low	30.5	Very low	187 Å²	187	122.8 Å²	122.8	92%	0.921	65%	0.647	S	S	*	*			trans	-130.4	150.2	145.5	-102.2	-64.1	165	0	0	110.3
1491	S	22.4	Very low	33.3	Very low	95 Å²	95	118.2 Å²	118.2	66%	0.664	62%	0.616	S	S	*	*			trans	-93.7	135.6	-167.5	55	0	0	0	0	113
1492	P	25.2	Very low	36	Very low	132 Å²	132	113.4 Å²	113.4	86%	0.857	59%	0.586	S	S	*	*			trans	-85.1	118.1	-173.5	31.9	-33.7	0	0	0	112.4
1493	I	25.4	Very low	39.1	Very low	141 Å²	141	104 Å²	104	72%	0.723	55%	0.551	S	S	*	*			trans	-114.5	116.9	172.8	-65.3	-178.8	0	0	0	109.9
1494	L	30.4	Very low	42.1	Very low	116 Å²	116	94.4 Å²	94.4	61%	0.607	51%	0.514	S	S	*	.			trans	53.1	96.6	159.5	-63.2	170	0	0	0	118.9
1495	Q	32.6	Very low	45.1	Very low	120 Å²	120	93.1 Å²	93.1	56%	0.561	49%	0.494	S	S	*	.			trans	-142.1	109.2	146.8	-149.3	175.8	16.7	0	0	109.4	N1457	N1457-Q1495 PolarHBondContact O-NE2 3.47Å
1496	F	39	Very low	48	Very low	87 Å²	87	85.3 Å²	85.3	38%	0.382	45%	0.454	S	S	.	.			trans	-128.2	109.1	-177.2	-89	-67	0	0	0	111.3	I1420 N1421 G1454	I1420-F1496 HydrophobicContact CG2-CD1 3.53Å; I1420-F1496 HydrophobicContact CG2-CE1 3.76Å; N1421-F1496 WeakPolarHBondContact O-CE1 3.39Å; N1421-F1496 WeakPolarHBondContact O-CZ 3.34Å; G1454-F1496 WeakPolarHBondContact CA-O 3.02Å
1497	Q	50.7	Low	51.5	Low	66 Å²	66	77.7 Å²	77.7	31%	0.308	42%	0.419	S	S	.	.			trans	-132.3	130.2	176.7	-71.7	164.3	19.5	0	0	109.2	I1420 C1453 L1455 N1457	I1420-Q1497 WeakPolarHBondContact CD1-O 3.38Å; C1453-Q1497 CarbonylContact O-C 3.05Å; C1453-Q1497 WeakPolarHBondContact O-CA 3.38Å; L1455-Q1497 VanDerWaalsContact O-CG 3.26Å; L1455-Q1497 WeakPolarHBondContact O-CG 3.47Å; L1455-Q1497 PolarHBondContact O-NE2 3.08Å; N1457-Q1497 VanDerWaalsContact N-NE2 3.18Å
1498	C	59.7	Low	54.9	Low	3 Å²	3	71.3 Å²	71.3	2%	0.02	38%	0.384	C	S	.	.	B	Isolated β-bridge	trans	-152.8	103.2	-179.7	174.5	0	0	0	0	108.8	C1415 I1420 C1453 H1500	C1415-C1498 VanDerWaalsContact CB-SG 3.56Å; C1415-C1498 PolarHBondContact SG-SG 3.2Å; I1420-C1498 HydrophobicContact CG2-CB 4.28Å; C1453-C1498 HydrophobicContact CB-CB 4.02Å; C1453-C1498 PolarHBondContact N-O 3.08Å; C1453-C1498 VanDerWaalsContact N-O 3.16Å; C1453-C1498 PolarHBondContact O-N 3.34Å; C1498-H1500 PolarHBondContact O-N 3.48Å
1499	P	63.9	Low	58.2	Low	96 Å²	96	64 Å²	64	62%	0.623	35%	0.35	S	S	*	.			trans	-81.3	38.6	-174.2	35.8	-38.1	0	0	0	112.7	Y1452	Y1452-P1499 VanDerWaalsContact CD1-C 3.46Å; Y1452-P1499 WeakPolarHBondContact CD1-O 3.26Å; Y1452-P1499 WeakPolarHBondContact CE1-O 3.41Å
1500	H	76.4	Confident	61.7	Low	44 Å²	44	57.5 Å²	57.5	20%	0.204	31%	0.311	C	S	.	.	S	Bend	trans	-114.6	148.6	180	-63.5	106.6	0	0	0	111.7	I1417 C1418 C1498 V1502 C1505 L1506	I1417-H1500 VanDerWaalsContact CD1-CD2 3.48Å; I1417-H1500 WeakPolarHBondContact CD1-CD2 3.42Å; I1417-H1500 WeakPolarHBondContact CG2-NE2 3.48Å; C1418-H1500 PolarHBondContact SG-CE1 3.14Å; C1418-H1500 PolarHBondContact SG-ND1 2.83Å; C1498-H1500 PolarHBondContact O-N 3.48Å; H1500-V1502 PolarHBondContact O-N 3.08Å; H1500-C1505 HydrophobicContact CB-CB 3.72Å; H1500-L1506 HydrophobicContact CB-CD1 3.94Å
1501	S	77.7	Confident	65	Low	7 Å²	7	48.6 Å²	48.6	5%	0.049	27%	0.267	C	S	.	.			trans	-57.9	120.5	-178.4	179.8	0	0	0	0	110.8	A1451 Y1503 K1504 C1505 L1506	A1451-S1501 CarbonylContact O-C 2.79Å; A1451-S1501 VanDerWaalsContact O-CA 3.31Å; A1451-S1501 WeakPolarHBondContact O-CA 3.26Å; S1501-Y1503 VanDerWaalsContact C-N 3.31Å; S1501-Y1503 PolarHBondContact O-N 3.25Å; S1501-K1504 PolarHBondContact O-N 3.04Å; S1501-C1505 WeakPolarHBondContact O-CA 3.38Å; S1501-C1505 WeakPolarHBondContact O-CB 3.46Å; S1501-C1505 PolarHBondContact O-N 3.47Å; S1501-L1506 PolarHBondContact O-N 3.34Å
1502	V	74.7	Confident	68.1	Low	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-59.3	-44.2	-175.5	174	0	0	0	0	111.4	F976 L1413 A1451 Y1452 C1453 H1500 L1506	F976-V1502 HydrophobicContact CD1-CB 4.32Å; F976-V1502 HydrophobicContact CD1-CG1 3.6Å; F976-V1502 HydrophobicContact CE1-CB 4.36Å; F976-V1502 HydrophobicContact CE1-CG1 3.35Å; F976-V1502 HydrophobicContact CZ-CG1 4.23Å; L1413-V1502 HydrophobicContact CD1-CG1 3.5Å; L1413-V1502 VanDerWaalsContact CD1-CG1 3.5Å; L1413-V1502 HydrophobicContact CD2-CG1 4.31Å; A1451-V1502 HydrophobicContact CB-CB 4Å; A1451-V1502 HydrophobicContact CB-CG2 4.16Å; A1451-V1502 PolarHBondContact O-N 2.75Å; Y1452-V1502 WeakPolarHBondContact O-CG2 3.27Å; C1453-V1502 HydrophobicContact CB-CG2 4.32Å; H1500-V1502 PolarHBondContact O-N 3.08Å; V1502-L1506 HydrophobicContact CG2-CD2 4.44Å; V1502-L1506 WeakPolarHBondContact O-CB 3.47Å; V1502-L1506 PolarHBondContact O-N 2.84Å
1503	Y	82.5	Confident	70.8	Confident	13 Å²	13	45.6 Å²	45.6	5%	0.051	23%	0.234	C	C	.	.	H	α-helix	trans	-77.8	-37	-176.4	-65	-64.4	0	0	0	113.3	F976 L1442 I1443 S1446 A1451 S1501	F976-Y1503 AromaticContact CE1-CE1 3.8Å; F976-Y1503 HydrophobicContact CE1-CE1 3.8Å; F976-Y1503 AromaticContact CE1-CZ 3.78Å; F976-Y1503 HydrophobicContact CZ-CE1 4.32Å; L1442-Y1503 HydrophobicContact CB-CE1 4.16Å; I1443-Y1503 HydrophobicContact CG1-CD1 4.29Å; S1446-Y1503 VanDerWaalsContact CB-CD2 3.49Å; S1446-Y1503 WeakPolarHBondContact OG-CB 3.29Å; S1446-Y1503 WeakPolarHBondContact OG-CD2 3.49Å; A1451-Y1503 HydrophobicContact CB-CD2 3.99Å; A1451-Y1503 HydrophobicContact CB-CE2 3.82Å; S1501-Y1503 VanDerWaalsContact C-N 3.31Å; S1501-Y1503 PolarHBondContact O-N 3.25Å
1504	K	83	Confident	73.4	Confident	29 Å²	29	44.3 Å²	44.3	13%	0.126	22%	0.22	C	C	.	.	H	α-helix	trans	-102.9	-15.3	-173.2	-59.6	-165.8	-147	156.6	0	115.5	S1446 D1448 S1501 Y1521	S1446-K1504 WeakPolarHBondContact O-CE 3.37Å; S1446-K1504 PolarHBondContact O-NZ 3.21Å; D1448-K1504 VanDerWaalsContact OD1-CD 3.23Å; D1448-K1504 WeakPolarHBondContact OD1-CD 3.44Å; D1448-K1504 VanDerWaalsContact OD1-CE 3.3Å; D1448-K1504 WeakPolarHBondContact OD1-CE 3.14Å; D1448-K1504 IonicContact OD1-NZ 3.82Å; D1448-K1504 PolarHBondContact OD1-NZ 2.61Å; D1448-K1504 IonicContact OD2-NZ 2.76Å; D1448-K1504 PolarHBondContact OD2-NZ 3.05Å; S1501-K1504 PolarHBondContact O-N 3.04Å; K1504-Y1521 HydrophobicContact CB-CD1 3.73Å; K1504-Y1521 HydrophobicContact CB-CD2 4.42Å; K1504-Y1521 HydrophobicContact CB-CE1 3.95Å; K1504-Y1521 HydrophobicContact CB-CG 3.99Å; K1504-Y1521 HydrophobicContact CD-CD2 4.49Å; K1504-Y1521 HydrophobicContact CD-CE1 4.03Å; K1504-Y1521 HydrophobicContact CD-CE2 3.97Å; K1504-Y1521 HydrophobicContact CG-CD1 4.14Å; K1504-Y1521 HydrophobicContact CG-CD2 4.01Å; K1504-Y1521 HydrophobicContact CG-CE1 4.13Å; K1504-Y1521 HydrophobicContact CG-CE2 3.99Å; K1504-Y1521 HydrophobicContact CG-CG 4.09Å; K1504-Y1521 VanDerWaalsContact O-CD1 3.23Å; K1504-Y1521 WeakPolarHBondContact O-CD1 3.4Å
1505	C	81.5	Confident	76.1	Confident	38 Å²	38	40.5 Å²	40.5	26%	0.257	20%	0.199	S	C	.	.	H	α-helix	trans	-110	-33.6	178.1	-56.7	0	0	0	0	113.3	P1416 I1417 H1500 S1501	P1416-C1505 WeakPolarHBondContact CD-O 3.01Å; P1416-C1505 WeakPolarHBondContact CG-O 3.48Å; I1417-C1505 HydrophobicContact CD1-CB 4.17Å; H1500-C1505 HydrophobicContact CB-CB 3.72Å; S1501-C1505 WeakPolarHBondContact O-CA 3.38Å; S1501-C1505 WeakPolarHBondContact O-CB 3.46Å; S1501-C1505 PolarHBondContact O-N 3.47Å
1506	L	84	Confident	78.9	Confident	6 Å²	6	35.4 Å²	35.4	3%	0.031	18%	0.175	C	C	.	.	S	Bend	trans	-90.7	145.7	-174.6	-74.6	54.9	0	0	0	111.2	L1413 F1414 C1415 C1453 H1500 S1501 V1502	L1413-L1506 HydrophobicContact CB-CB 4.23Å; L1413-L1506 HydrophobicContact CB-CD2 3.94Å; L1413-L1506 HydrophobicContact CD1-CD2 3.93Å; L1413-L1506 HydrophobicContact CD2-CB 4.12Å; L1413-L1506 HydrophobicContact CG-CD2 4.45Å; F1414-L1506 CarbonylContact O-C 3.56Å; F1414-L1506 WeakPolarHBondContact O-CA 3.36Å; C1415-L1506 HydrophobicContact CB-CD1 3.97Å; C1415-L1506 HydrophobicContact CB-CG 3.88Å; C1453-L1506 HydrophobicContact CB-CD2 4.35Å; H1500-L1506 HydrophobicContact CB-CD1 3.94Å; S1501-L1506 PolarHBondContact O-N 3.34Å; V1502-L1506 HydrophobicContact CG2-CD2 4.44Å; V1502-L1506 WeakPolarHBondContact O-CB 3.47Å; V1502-L1506 PolarHBondContact O-N 2.84Å
1507	E	89.6	Confident	81.4	Confident	18 Å²	18	31.3 Å²	31.3	8%	0.084	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	118.5	177.2	-61.4	-175.5	-171.2	0	0	109.2	L1413 F1414 P1416 C1509 I1518 F1519 K1520	L1413-E1507 WeakPolarHBondContact CA-O 3.32Å; F1414-E1507 HydrophobicContact CB-CB 4.41Å; F1414-E1507 HydrophobicContact CD1-CB 4.39Å; F1414-E1507 HydrophobicContact CD1-CG 4.45Å; F1414-E1507 PolarHBondContact N-O 3Å; F1414-E1507 PolarHBondContact O-N 2.94Å; P1416-E1507 HydrophobicContact CG-CG 4.49Å; E1507-C1509 PolarHBondContact O-N 3.41Å; E1507-I1518 HydrophobicContact CB-CG2 3.79Å; E1507-I1518 HydrophobicContact CG-CG2 4.45Å; E1507-F1519 CarbonylContact C-O 3.56Å; E1507-F1519 WeakPolarHBondContact CA-O 3.49Å; E1507-K1520 HydrophobicContact CG-CB 4.1Å; E1507-K1520 HydrophobicContact CG-CD 4.21Å; E1507-K1520 HydrophobicContact CG-CG 4.06Å; E1507-K1520 WeakPolarHBondContact OE1-CD 3.28Å; E1507-K1520 WeakPolarHBondContact OE1-CE 3.48Å; E1507-K1520 IonicContact OE1-NZ 2.83Å; E1507-K1520 PolarHBondContact OE1-NZ 3.16Å
1508	H	92.7	Very high	83.5	Confident	2 Å²	2	28.4 Å²	28.4	1%	0.009	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	109.4	-178.1	-62.6	-120.7	0	0	0	109.9	Y969 L1413 F1439 F1510 F1519	Y969-H1508 PolarHBondContact OH-ND1 2.87Å; L1413-H1508 HydrophobicContact CD2-CB 4.22Å; F1439-H1508 HydrophobicContact CZ-CB 4.29Å; H1508-F1510 HydrophobicContact CB-CE2 4.05Å; H1508-F1519 HydrophobicContact CB-CB 4.29Å; H1508-F1519 PolarHBondContact N-O 2.94Å; H1508-F1519 PolarHBondContact O-N 2.72Å
1509	C	91.2	Very high	85.2	Confident	6 Å²	6	28.2 Å²	28.2	4%	0.041	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	131.1	-173.2	-72.1	0	0	0	0	111.5	M1411 W1412 E1507 L1516	M1411-C1509 WeakPolarHBondContact CA-O 3.33Å; M1411-C1509 WeakPolarHBondContact CB-O 3.26Å; W1412-C1509 HydrophobicContact CD2-CB 3.58Å; W1412-C1509 HydrophobicContact CE3-CB 4.07Å; W1412-C1509 HydrophobicContact CG-CB 4.01Å; W1412-C1509 HydrophobicContact CH2-CB 4.21Å; W1412-C1509 HydrophobicContact CZ2-CB 3.72Å; W1412-C1509 HydrophobicContact CZ3-CB 4.36Å; W1412-C1509 PolarHBondContact N-O 3.08Å; W1412-C1509 WeakPolarHBondContact O-CB 3.47Å; W1412-C1509 PolarHBondContact O-N 3.47Å; E1507-C1509 PolarHBondContact O-N 3.41Å; C1509-L1516 HydrophobicContact CB-CD1 3.8Å
1510	F	93.5	Very high	86.5	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.009	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	123.3	175.6	-58.2	-97.8	0	0	0	110.4	L1336 L1340 F1345 I1409 Q1410 M1411 M1427 F1439 H1508 L1516 A1517 F1519	L1336-F1510 HydrophobicContact CD2-CE1 4.1Å; L1336-F1510 HydrophobicContact CD2-CZ 4.09Å; L1340-F1510 HydrophobicContact CD1-CB 4.03Å; L1340-F1510 HydrophobicContact CD1-CD1 3.5Å; L1340-F1510 HydrophobicContact CD1-CD2 4.49Å; L1340-F1510 HydrophobicContact CD1-CE1 4Å; L1340-F1510 HydrophobicContact CD1-CG 3.78Å; L1340-F1510 HydrophobicContact CD2-CB 3.86Å; L1340-F1510 HydrophobicContact CD2-CD2 4.26Å; L1340-F1510 HydrophobicContact CD2-CG 4.02Å; F1345-F1510 HydrophobicContact CZ-CB 4.23Å; F1345-F1510 WeakPolarHBondContact CZ-O 3.45Å; I1409-F1510 HydrophobicContact CG2-CB 4.3Å; I1409-F1510 HydrophobicContact CG2-CD1 4.37Å; Q1410-F1510 CarbonylContact O-C 3.55Å; Q1410-F1510 WeakPolarHBondContact O-CA 3.34Å; M1411-F1510 HydrophobicContact CB-CD1 3.91Å; M1411-F1510 HydrophobicContact CB-CE1 4.23Å; M1411-F1510 HydrophobicContact CE-CD1 4.15Å; M1411-F1510 HydrophobicContact CE-CE1 3.62Å; M1427-F1510 HydrophobicContact SD-CE1 4.38Å; F1439-F1510 HydrophobicContact CE2-CE2 4.19Å; F1439-F1510 AromaticContact CE2-CZ 3.91Å; F1439-F1510 HydrophobicContact CE2-CZ 3.91Å; F1439-F1510 AromaticContact CZ-CE2 3.76Å; F1439-F1510 HydrophobicContact CZ-CE2 3.76Å; F1439-F1510 AromaticContact CZ-CZ 3.91Å; F1439-F1510 HydrophobicContact CZ-CZ 3.91Å; H1508-F1510 HydrophobicContact CB-CE2 4.05Å; F1510-L1516 WeakPolarHBondContact O-CA 3.14Å; F1510-A1517 HydrophobicContact CB-CB 4.49Å; F1510-A1517 PolarHBondContact N-O 3.21Å; F1510-A1517 PolarHBondContact O-N 2.92Å; F1510-F1519 AromaticContact CD2-CD2 3.84Å; F1510-F1519 HydrophobicContact CD2-CD2 3.84Å; F1510-F1519 AromaticContact CD2-CE2 3.86Å; F1510-F1519 HydrophobicContact CD2-CE2 3.86Å; F1510-F1519 AromaticContact CE2-CD2 3.68Å; F1510-F1519 HydrophobicContact CE2-CD2 3.68Å; F1510-F1519 AromaticContact CE2-CE2 3.86Å; F1510-F1519 HydrophobicContact CE2-CE2 3.86Å
1511	A	89.6	Confident	87.3	Confident	0 Å²	0	26.2 Å²	26.2	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	141.6	-176.9	0	0	0	0	0	113.9	P1384 I1409 Q1410 W1412 K1515	P1384-A1511 HydrophobicContact CG-CB 4.19Å; I1409-A1511 WeakPolarHBondContact CA-O 3.33Å; Q1410-A1511 PolarHBondContact N-O 3.01Å; Q1410-A1511 PolarHBondContact O-N 2.83Å; W1412-A1511 HydrophobicContact CH2-CB 3.97Å; W1412-A1511 HydrophobicContact CZ3-CB 3.69Å; A1511-K1515 CarbonylContact C-O 3.55Å; A1511-K1515 VanDerWaalsContact CA-O 3.27Å; A1511-K1515 WeakPolarHBondContact CA-O 3.46Å
1512	F	87.8	Confident	87.8	Confident	49 Å²	49	29.2 Å²	29.2	22%	0.215	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.5	133.1	170.3	177.4	-124.3	0	0	0	110.6	F1345 R1408 I1409 R1514 K1515	F1345-F1512 HydrophobicContact CB-CD1 3.9Å; F1345-F1512 HydrophobicContact CD1-CB 4.17Å; F1345-F1512 HydrophobicContact CD2-CB 3.61Å; F1345-F1512 AromaticContact CD2-CD1 3.85Å; F1345-F1512 HydrophobicContact CD2-CD1 3.85Å; F1345-F1512 HydrophobicContact CD2-CG 4.17Å; F1345-F1512 HydrophobicContact CE1-CB 4.18Å; F1345-F1512 HydrophobicContact CE2-CB 3.61Å; F1345-F1512 HydrophobicContact CG-CB 3.91Å; F1345-F1512 AromaticContact CG-CD1 4Å; F1345-F1512 HydrophobicContact CG-CD1 4Å; F1345-F1512 HydrophobicContact CG-CG 4.47Å; F1345-F1512 HydrophobicContact CZ-CB 3.91Å; R1408-F1512 HydrophobicContact CB-CD2 3.77Å; R1408-F1512 HydrophobicContact CB-CE2 3.48Å; R1408-F1512 VanDerWaalsContact CB-CE2 3.48Å; R1408-F1512 HydrophobicContact CG-CE2 4.39Å; I1409-F1512 HydrophobicContact CG1-CB 4.26Å; F1512-R1514 PolarHBondContact O-N 3.25Å; F1512-K1515 PolarHBondContact N-O 3.13Å; F1512-K1515 PolarHBondContact O-N 3.13Å
1513	N	80.6	Confident	88.4	Confident	115 Å²	115	33.5 Å²	33.5	62%	0.615	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	45.8	54.8	179.3	-64.6	-10.4	0	0	0	113.6	K1515	N1513-K1515 PolarHBondContact O-N 3.1Å
1514	R	80.7	Confident	88.7	Confident	113 Å²	113	34 Å²	34	43%	0.426	17%	0.168	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.8	8.2	-176.4	-56.8	-176.1	-174.3	-178.2	-2.2	116.3	Q1379 L1380 D1383 F1512	Q1379-R1514 VanDerWaalsContact NE2-CB 3.27Å; Q1379-R1514 PolarHBondContact NE2-O 3.33Å; Q1379-R1514 VanDerWaalsContact NE2-O 3.07Å; L1380-R1514 HydrophobicContact CB-CB 4.47Å; L1380-R1514 WeakPolarHBondContact CB-O 3.48Å; L1380-R1514 PolarHBondContact N-O 3.39Å; D1383-R1514 WeakPolarHBondContact OD1-CG 3.47Å; D1383-R1514 IonicContact OD1-NE 2.7Å; D1383-R1514 PolarHBondContact OD1-NE 2.93Å; D1383-R1514 IonicContact OD2-CZ 3.16Å; D1383-R1514 VanDerWaalsContact OD2-CZ 3.25Å; D1383-R1514 IonicContact OD2-NE 3.77Å; D1383-R1514 PolarHBondContact OD2-NE 3.24Å; D1383-R1514 IonicContact OD2-NH2 3.88Å; D1383-R1514 PolarHBondContact OD2-NH2 3.13Å; F1512-R1514 PolarHBondContact O-N 3.25Å
1515	K	86.1	Confident	89	Confident	37 Å²	37	36.7 Å²	36.7	16%	0.161	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	133.4	168.2	-69.7	-180	179.1	-174.9	0	109.9	F1345 A1511 F1512 N1513	F1345-K1515 HydrophobicContact CD1-CB 3.77Å; F1345-K1515 HydrophobicContact CE1-CB 4.32Å; F1345-K1515 WeakPolarHBondContact CE1-O 3.43Å; F1345-K1515 VanDerWaalsContact O-CD 3.31Å; F1345-K1515 WeakPolarHBondContact O-CD 3.16Å; F1345-K1515 PolarHBondContact O-NZ 3.17Å; A1511-K1515 CarbonylContact C-O 3.55Å; A1511-K1515 VanDerWaalsContact CA-O 3.27Å; A1511-K1515 WeakPolarHBondContact CA-O 3.46Å; F1512-K1515 PolarHBondContact N-O 3.13Å; F1512-K1515 PolarHBondContact O-N 3.13Å; N1513-K1515 PolarHBondContact O-N 3.1Å
1516	L	91.4	Very high	89.3	Confident	13 Å²	13	35.5 Å²	35.5	7%	0.068	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.6	176.2	169.9	58	0	0	0	108.9	I1377 R1378 L1380 W1412 C1509 F1510 I1518	I1377-L1516 CarbonylContact C-O 3.6Å; I1377-L1516 WeakPolarHBondContact CA-O 3.43Å; R1378-L1516 PolarHBondContact N-O 2.88Å; R1378-L1516 PolarHBondContact O-N 3.37Å; L1380-L1516 HydrophobicContact CD1-CB 4.12Å; L1380-L1516 HydrophobicContact CD2-CB 4.09Å; L1380-L1516 HydrophobicContact CD2-CD2 3.93Å; L1380-L1516 HydrophobicContact CG-CB 3.95Å; W1412-L1516 HydrophobicContact CH2-CD1 3.73Å; W1412-L1516 HydrophobicContact CH2-CD2 4.42Å; W1412-L1516 HydrophobicContact CZ2-CD1 4.03Å; W1412-L1516 HydrophobicContact CZ2-CD2 4.27Å; W1412-L1516 HydrophobicContact CZ3-CD1 4.44Å; C1509-L1516 HydrophobicContact CB-CD1 3.8Å; F1510-L1516 WeakPolarHBondContact O-CA 3.14Å; L1516-I1518 HydrophobicContact CD1-CG1 4.13Å; L1516-I1518 HydrophobicContact CD2-CD1 3.91Å; L1516-I1518 HydrophobicContact CD2-CG1 3.94Å; L1516-I1518 HydrophobicContact CG-CD1 4.21Å; L1516-I1518 HydrophobicContact CG-CG1 3.7Å
1517	A	92.9	Very high	89.7	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	129.7	164.7	0	0	0	0	0	108.7	L1340 C1344 F1345 L1375 M1376 F1510	L1340-A1517 HydrophobicContact CD2-CB 3.93Å; C1344-A1517 HydrophobicContact CB-CB 3.88Å; F1345-A1517 HydrophobicContact CE1-CB 4.32Å; L1375-A1517 HydrophobicContact CD1-CB 4.13Å; M1376-A1517 WeakPolarHBondContact O-CA 3.34Å; F1510-A1517 HydrophobicContact CB-CB 4.49Å; F1510-A1517 PolarHBondContact N-O 3.21Å; F1510-A1517 PolarHBondContact O-N 2.92Å
1518	I	93.6	Very high	89.6	Confident	5 Å²	5	35.7 Å²	35.7	3%	0.026	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	123.5	178.3	-49.3	179.7	0	0	0	107.6	L1375 M1376 E1507 L1516	L1375-I1518 WeakPolarHBondContact CA-O 3.43Å; M1376-I1518 HydrophobicContact CE-CB 4.47Å; M1376-I1518 HydrophobicContact CE-CG2 4.36Å; M1376-I1518 PolarHBondContact N-O 3.14Å; M1376-I1518 PolarHBondContact O-N 3.02Å; E1507-I1518 HydrophobicContact CB-CG2 3.79Å; E1507-I1518 HydrophobicContact CG-CG2 4.45Å; L1516-I1518 HydrophobicContact CD1-CG1 4.13Å; L1516-I1518 HydrophobicContact CD2-CD1 3.91Å; L1516-I1518 HydrophobicContact CD2-CG1 3.94Å; L1516-I1518 HydrophobicContact CG-CD1 4.21Å; L1516-I1518 HydrophobicContact CG-CG1 3.7Å
1519	F	95.4	Very high	89.5	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	123.5	166.9	-62.3	-96.5	0	0	0	108.9	F1339 L1340 V1373 L1375 F1436 F1439 I1443 E1507 H1508 F1510	F1339-F1519 HydrophobicContact CD1-CZ 4.42Å; F1339-F1519 HydrophobicContact CE1-CE1 4.42Å; F1339-F1519 AromaticContact CE1-CZ 3.99Å; F1339-F1519 HydrophobicContact CE1-CZ 3.99Å; L1340-F1519 HydrophobicContact CD2-CE2 4.06Å; L1340-F1519 HydrophobicContact CD2-CZ 4.49Å; V1373-F1519 HydrophobicContact CG1-CB 3.82Å; V1373-F1519 HydrophobicContact CG1-CD1 3.88Å; V1373-F1519 HydrophobicContact CG1-CG 4.35Å; L1375-F1519 HydrophobicContact CB-CD1 4.04Å; L1375-F1519 HydrophobicContact CB-CE1 3.99Å; L1375-F1519 HydrophobicContact CD1-CD1 4.17Å; L1375-F1519 HydrophobicContact CD1-CD2 4.34Å; L1375-F1519 HydrophobicContact CD1-CE1 3.84Å; L1375-F1519 HydrophobicContact CD1-CE2 4.04Å; L1375-F1519 HydrophobicContact CD1-CG 4.42Å; L1375-F1519 HydrophobicContact CD1-CZ 3.78Å; L1375-F1519 HydrophobicContact CD2-CE1 4.03Å; L1375-F1519 HydrophobicContact CD2-CZ 4.25Å; L1375-F1519 HydrophobicContact CG-CE1 4.17Å; L1375-F1519 HydrophobicContact CG-CZ 4.48Å; F1436-F1519 AromaticContact CE2-CE1 3.69Å; F1436-F1519 HydrophobicContact CE2-CE1 3.69Å; F1436-F1519 AromaticContact CE2-CZ 3.84Å; F1436-F1519 HydrophobicContact CE2-CZ 3.84Å; F1436-F1519 HydrophobicContact CZ-CE1 4.15Å; F1439-F1519 HydrophobicContact CE1-CB 4.43Å; F1439-F1519 AromaticContact CE1-CD1 3.86Å; F1439-F1519 HydrophobicContact CE1-CD1 3.86Å; F1439-F1519 AromaticContact CE1-CD2 3.88Å; F1439-F1519 HydrophobicContact CE1-CD2 3.88Å; F1439-F1519 AromaticContact CE1-CE1 3.96Å; F1439-F1519 HydrophobicContact CE1-CE1 3.96Å; F1439-F1519 AromaticContact CE1-CE2 3.98Å; F1439-F1519 HydrophobicContact CE1-CE2 3.98Å; F1439-F1519 AromaticContact CE1-CG 3.8Å; F1439-F1519 HydrophobicContact CE1-CG 3.8Å; F1439-F1519 HydrophobicContact CE1-CZ 4.01Å; F1439-F1519 HydrophobicContact CZ-CB 4.23Å; F1439-F1519 HydrophobicContact CZ-CD1 4.46Å; F1439-F1519 AromaticContact CZ-CD2 3.87Å; F1439-F1519 HydrophobicContact CZ-CD2 3.87Å; F1439-F1519 HydrophobicContact CZ-CE2 4.28Å; F1439-F1519 AromaticContact CZ-CG 3.95Å; F1439-F1519 HydrophobicContact CZ-CG 3.95Å; I1443-F1519 HydrophobicContact CD1-CB 4.43Å; E1507-F1519 CarbonylContact C-O 3.56Å; E1507-F1519 WeakPolarHBondContact CA-O 3.49Å; H1508-F1519 HydrophobicContact CB-CB 4.29Å; H1508-F1519 PolarHBondContact N-O 2.94Å; H1508-F1519 PolarHBondContact O-N 2.72Å; F1510-F1519 AromaticContact CD2-CD2 3.84Å; F1510-F1519 HydrophobicContact CD2-CD2 3.84Å; F1510-F1519 AromaticContact CD2-CE2 3.86Å; F1510-F1519 HydrophobicContact CD2-CE2 3.86Å; F1510-F1519 AromaticContact CE2-CD2 3.68Å; F1510-F1519 HydrophobicContact CE2-CD2 3.68Å; F1510-F1519 AromaticContact CE2-CE2 3.86Å; F1510-F1519 HydrophobicContact CE2-CE2 3.86Å
1520	K	92.5	Very high	89.2	Confident	65 Å²	65	35.7 Å²	35.7	28%	0.283	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	127.5	-178	173.9	172.1	-168.4	139.4	0	110.2	V1373 Q1374 M1376 E1507	V1373-K1520 CarbonylContact C-O 3.59Å; V1373-K1520 WeakPolarHBondContact CA-O 3.3Å; Q1374-K1520 PolarHBondContact N-O 2.83Å; Q1374-K1520 PolarHBondContact O-N 2.84Å; M1376-K1520 HydrophobicContact CE-CB 4.49Å; E1507-K1520 HydrophobicContact CG-CB 4.1Å; E1507-K1520 HydrophobicContact CG-CD 4.21Å; E1507-K1520 HydrophobicContact CG-CG 4.06Å; E1507-K1520 WeakPolarHBondContact OE1-CD 3.28Å; E1507-K1520 WeakPolarHBondContact OE1-CE 3.48Å; E1507-K1520 IonicContact OE1-NZ 2.83Å; E1507-K1520 PolarHBondContact OE1-NZ 3.16Å
1521	Y	93.3	Very high	88.5	Confident	32 Å²	32	35.9 Å²	35.9	13%	0.125	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	142.1	167.6	178.4	-87.9	0	0	0	111.1	S1370 S1372 I1443 K1504 P1523	S1370-Y1521 PolarHBondContact O-OH 3.24Å; S1370-Y1521 VanDerWaalsContact O-OH 3.1Å; S1372-Y1521 CarbonylContact O-C 3.59Å; S1372-Y1521 VanDerWaalsContact O-CA 3.32Å; S1372-Y1521 WeakPolarHBondContact O-CA 3.46Å; I1443-Y1521 HydrophobicContact CG2-CD2 4.38Å; K1504-Y1521 HydrophobicContact CB-CD1 3.73Å; K1504-Y1521 HydrophobicContact CB-CD2 4.42Å; K1504-Y1521 HydrophobicContact CB-CE1 3.95Å; K1504-Y1521 HydrophobicContact CB-CG 3.99Å; K1504-Y1521 HydrophobicContact CD-CD2 4.49Å; K1504-Y1521 HydrophobicContact CD-CE1 4.03Å; K1504-Y1521 HydrophobicContact CD-CE2 3.97Å; K1504-Y1521 HydrophobicContact CG-CD1 4.14Å; K1504-Y1521 HydrophobicContact CG-CD2 4.01Å; K1504-Y1521 HydrophobicContact CG-CE1 4.13Å; K1504-Y1521 HydrophobicContact CG-CE2 3.99Å; K1504-Y1521 HydrophobicContact CG-CG 4.09Å; K1504-Y1521 VanDerWaalsContact O-CD1 3.23Å; K1504-Y1521 WeakPolarHBondContact O-CD1 3.4Å; Y1521-P1523 HydrophobicContact CE1-CB 4.3Å
1522	Q	87.8	Confident	87.7	Confident	71 Å²	71	36.2 Å²	36.2	33%	0.332	18%	0.179	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	130	169.4	-176.9	177.5	-10.8	0	0	109	S1372	S1372-Q1522 PolarHBondContact N-O 2.86Å; S1372-Q1522 PolarHBondContact O-N 3.2Å; S1372-Q1522 PolarHBondContact OG-O 2.84Å
1523	P	87.3	Confident	86.4	Confident	89 Å²	89	36.1 Å²	36.1	58%	0.578	18%	0.183	S	C	*	.			trans	-64.3	158.9	176.4	28.9	-35.7	0	0	0	111.5	Y1521	Y1521-P1523 HydrophobicContact CE1-CB 4.3Å
1524	V	88.1	Confident	85.2	Confident	25 Å²	25	32.4 Å²	32.4	15%	0.152	17%	0.166	C	C	.	.			trans	-131.5	125.1	-174.3	179.5	0	0	0	0	109.2	I1367 V1526 Y2553 L2650	I1367-V1524 HydrophobicContact CG2-CG1 4.19Å; I1367-V1524 HydrophobicContact CG2-CG2 3.81Å; V1524-V1526 HydrophobicContact CG1-CG2 4.19Å; V1524-Y2553 HydrophobicContact CG1-CD2 3.43Å; V1524-Y2553 VanDerWaalsContact CG1-CD2 3.43Å; V1524-Y2553 HydrophobicContact CG1-CE2 3.62Å; V1524-Y2553 HydrophobicContact CG1-CG 4.19Å; V1524-L2650 HydrophobicContact CG1-CD2 3.92Å
1525	N	88.8	Confident	83.9	Confident	84 Å²	84	30.7 Å²	30.7	45%	0.449	16%	0.163	S	C	.	.			trans	-76.7	128.8	169.3	-66.5	16.1	0	0	0	108.6	Y1527	N1525-Y1527 HydrophobicContact CB-CE2 3.98Å
1526	V	89.5	Confident	82.3	Confident	14 Å²	14	29.4 Å²	29.4	9%	0.085	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	118.3	-178.4	-168.5	0	0	0	0	107.3	T1369 V1524 R2555 L2650	T1369-V1526 HydrophobicContact CG2-CG1 4.3Å; V1524-V1526 HydrophobicContact CG1-CG2 4.19Å; V1526-R2555 HydrophobicContact CG1-CG 3.51Å; V1526-L2650 HydrophobicContact CB-CD2 4.45Å; V1526-L2650 HydrophobicContact CG1-CD2 4.13Å; V1526-L2650 HydrophobicContact CG2-CD2 3.54Å
1527	Y	90.7	Very high	80	Confident	13 Å²	13	36.3 Å²	36.3	5%	0.051	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	144.9	-173.4	-56.8	-97.5	0	0	0	111.2	N1525 L2552 Y2553 L2554 V2587 N2592 L2594	N1525-Y1527 HydrophobicContact CB-CE2 3.98Å; Y1527-L2552 HydrophobicContact CD2-CD2 4.27Å; Y1527-L2552 HydrophobicContact CE2-CD2 3.7Å; Y1527-Y2553 PolarHBondContact N-O 3.21Å; Y1527-L2554 VanDerWaalsContact O-CD2 3.29Å; Y1527-L2554 WeakPolarHBondContact O-CD2 3.31Å; Y1527-V2587 HydrophobicContact CD1-CG1 4.41Å; Y1527-V2587 HydrophobicContact CE1-CG1 3.71Å; Y1527-N2592 VanDerWaalsContact CA-O 3.27Å; Y1527-N2592 WeakPolarHBondContact CA-O 3.42Å; Y1527-N2592 HydrophobicContact CD1-CB 4.33Å; Y1527-L2594 HydrophobicContact CD1-CD2 3.68Å; Y1527-L2594 HydrophobicContact CD1-CG 4.39Å; Y1527-L2594 HydrophobicContact CD2-CD2 4.42Å; Y1527-L2594 HydrophobicContact CE1-CD2 4.3Å; Y1527-L2594 HydrophobicContact CG-CD2 3.76Å; Y1527-L2594 HydrophobicContact CG-CG 4.12Å
1528	E	88.9	Confident	77.3	Confident	14 Å²	14	38.1 Å²	38.1	7%	0.065	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	149	162.2	-61	-53.4	162.6	0	0	111	Y1073 R2555 H2557 S2558 N2592 Q2593 L2594	Y1073-E1528 HydrophobicContact CE1-CG 3.95Å; Y1073-E1528 WeakPolarHBondContact CE1-OE1 3.42Å; E1528-R2555 WeakPolarHBondContact OE1-CD 3.37Å; E1528-R2555 VanDerWaalsContact OE1-CG 3.26Å; E1528-R2555 WeakPolarHBondContact OE1-CG 3.48Å; E1528-R2555 IonicContact OE1-CZ 3.25Å; E1528-R2555 IonicContact OE1-NE 2.9Å; E1528-R2555 PolarHBondContact OE1-NE 2.82Å; E1528-R2555 IonicContact OE1-NH2 3.91Å; E1528-H2557 VanDerWaalsContact CD-CE1 3.41Å; E1528-H2557 IonicContact OE1-CE1 2.77Å; E1528-H2557 PolarHBondContact OE1-CE1 3.35Å; E1528-H2557 IonicContact OE2-CE1 3.92Å; E1528-H2557 PolarHBondContact OE2-CE1 3.28Å; E1528-H2557 IonicContact OE2-ND1 3.85Å; E1528-H2557 IonicContact OE2-NE2 2.7Å; E1528-H2557 PolarHBondContact OE2-NE2 3.32Å; E1528-S2558 VanDerWaalsContact OE2-CB 3.29Å; E1528-S2558 WeakPolarHBondContact OE2-CB 3.32Å; E1528-S2558 PolarHBondContact OE2-OG 2.95Å; E1528-N2592 PolarHBondContact N-O 3.26Å; E1528-Q2593 CarbonylContact O-C 3.52Å; E1528-Q2593 VanDerWaalsContact O-CA 3.31Å; E1528-Q2593 WeakPolarHBondContact O-CA 3.23Å; E1528-L2594 PolarHBondContact O-N 3.1Å
1529	I	90	Very high	74.6	Confident	1 Å²	1	44.7 Å²	44.7	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	141.1	172	68.6	-170.4	0	0	0	110.8	L1084 M1531 L2554 S2558 A2561 L2562 L2594 I2596	L1084-I1529 HydrophobicContact CD1-CD1 4.35Å; L1084-I1529 HydrophobicContact CD1-CG1 3.9Å; I1529-M1531 HydrophobicContact CD1-CE 3.46Å; I1529-M1531 VanDerWaalsContact CD1-CE 3.46Å; I1529-M1531 HydrophobicContact CG1-CE 4.29Å; I1529-L2554 HydrophobicContact CG2-CD1 3.84Å; I1529-L2554 HydrophobicContact CG2-CD2 3.67Å; I1529-L2554 HydrophobicContact CG2-CG 4.43Å; I1529-S2558 WeakPolarHBondContact CD1-O 3.3Å; I1529-S2558 PolarHBondContact N-OG 3.27Å; I1529-S2558 VanDerWaalsContact N-OG 3.12Å; I1529-A2561 HydrophobicContact CD1-CB 4.19Å; I1529-L2562 HydrophobicContact CD1-CB 3.68Å; I1529-L2594 CarbonylContact C-O 3.57Å; I1529-L2594 WeakPolarHBondContact CA-O 3.18Å; I1529-L2594 HydrophobicContact CG2-CB 4.4Å; I1529-I2596 HydrophobicContact CB-CD1 3.92Å; I1529-I2596 HydrophobicContact CB-CG1 4.4Å; I1529-I2596 HydrophobicContact CD1-CD1 4.01Å; I1529-I2596 HydrophobicContact CG1-CD1 4.33Å; I1529-I2596 HydrophobicContact CG2-CD1 4.23Å
1530	V	84.2	Confident	71.5	Confident	8 Å²	8	49 Å²	49	5%	0.048	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.8	120.2	161.8	-177.8	0	0	0	0	108.9	Y1083 Q2593 L2594 I2596	Y1083-V1530 HydrophobicContact CD1-CB 4.35Å; Y1083-V1530 HydrophobicContact CD1-CG1 3.92Å; Y1083-V1530 HydrophobicContact CD1-CG2 4.38Å; Y1083-V1530 HydrophobicContact CD2-CG1 3.59Å; Y1083-V1530 HydrophobicContact CE1-CG1 4.04Å; Y1083-V1530 HydrophobicContact CE2-CG1 3.69Å; Y1083-V1530 HydrophobicContact CG-CB 4.31Å; Y1083-V1530 HydrophobicContact CG-CG1 3.71Å; Y1083-V1530 HydrophobicContact CG-CG2 4.05Å; V1530-Q2593 HydrophobicContact CG2-CB 4.42Å; V1530-Q2593 HydrophobicContact CG2-CG 4.29Å; V1530-Q2593 VanDerWaalsContact CG2-OE1 3.29Å; V1530-L2594 PolarHBondContact N-O 3.46Å; V1530-I2596 WeakPolarHBondContact O-CG1 3.3Å; V1530-I2596 PolarHBondContact O-N 2.76Å
1531	M	79.6	Confident	68.4	Low	6 Å²	6	51.3 Å²	51.3	3%	0.03	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-86	173.4	176.4	-60.7	-173.9	-179.1	0	0	110.5	Y1083 I1529 L2414 V2416 A2561 C2565 I2596	Y1083-M1531 HydrophobicContact CE1-CB 4.03Å; Y1083-M1531 PolarHBondContact OH-O 3.05Å; I1529-M1531 HydrophobicContact CD1-CE 3.46Å; I1529-M1531 VanDerWaalsContact CD1-CE 3.46Å; I1529-M1531 HydrophobicContact CG1-CE 4.29Å; M1531-L2414 HydrophobicContact CE-CD1 4.24Å; M1531-L2414 HydrophobicContact SD-CB 3.92Å; M1531-L2414 HydrophobicContact SD-CD1 4.12Å; M1531-L2414 HydrophobicContact SD-CD2 4.18Å; M1531-L2414 HydrophobicContact SD-CG 4.31Å; M1531-V2416 HydrophobicContact CB-CG1 4.43Å; M1531-V2416 HydrophobicContact CE-CG1 4.22Å; M1531-V2416 HydrophobicContact CG-CG1 3.9Å; M1531-V2416 HydrophobicContact SD-CG1 3.89Å; M1531-A2561 HydrophobicContact CE-CB 3.73Å; M1531-C2565 HydrophobicContact CE-CB 4.39Å; M1531-C2565 VanDerWaalsContact CE-SG 3.54Å; M1531-I2596 HydrophobicContact CG-CD1 4.08Å; M1531-I2596 HydrophobicContact CG-CG1 4.27Å
1532	P	71.6	Confident	65.2	Low	7 Å²	7	58.6 Å²	58.6	5%	0.045	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-62	126.8	163.7	-18	32.1	0	0	0	110.1	Y1083 R2419 E2445 L2447 I2596	Y1083-P1532 PolarHBondContact OH-O 3.47Å; P1532-R2419 PolarHBondContact O-NH2 2.92Å; P1532-E2445 WeakPolarHBondContact CB-OE1 3.32Å; P1532-L2447 HydrophobicContact CB-CD2 4.47Å; P1532-L2447 HydrophobicContact CG-CD2 3.82Å; P1532-I2596 WeakPolarHBondContact CD-O 3.4Å
1533	P	62.3	Low	62.3	Low	47 Å²	47	59.6 Å²	59.6	31%	0.305	32%	0.323	S	S	.	.	P	Polyproline II helix	trans	-68.7	144.7	-176.4	30.2	-36.4	0	0	0	112	Y1083 E1535 R2419	Y1083-P1533 HydrophobicContact CE2-CB 4.23Å; Y1083-P1533 WeakPolarHBondContact OH-CA 3.42Å; P1533-E1535 VanDerWaalsContact CB-O 3.27Å; P1533-E1535 WeakPolarHBondContact CB-O 3.49Å; P1533-E1535 VanDerWaalsContact CG-O 3.24Å; P1533-E1535 WeakPolarHBondContact CG-O 3.23Å; P1533-E1535 PolarHBondContact O-N 3.41Å; P1533-E1535 VanDerWaalsContact O-N 3.1Å; P1533-R2419 VanDerWaalsContact C-NH2 3.35Å; P1533-R2419 PolarHBondContact O-NH1 3.18Å; P1533-R2419 PolarHBondContact O-NH2 3.3Å
1534	S	55.1	Low	59.3	Low	37 Å²	37	62 Å²	62	26%	0.259	33%	0.33	S	S	.	.	S	Bend	trans	-50.4	-34.8	170.5	-52.7	0	0	0	0	111	I2344 Q2412 R2419	S1534-I2344 WeakPolarHBondContact O-CB 3.06Å; S1534-Q2412 PolarHBondContact OG-OE1 3.24Å; S1534-Q2412 VanDerWaalsContact OG-OE1 3.05Å; S1534-R2419 PolarHBondContact O-NH1 3.35Å
1535	E	52.1	Low	56.3	Low	76 Å²	76	68.3 Å²	68.3	36%	0.355	36%	0.363	S	S	.	.	S	Bend	trans	-116.7	121.6	178	-60.1	165.3	-172.9	0	0	112.2	P1533 R1537 I2344	P1533-E1535 VanDerWaalsContact CB-O 3.27Å; P1533-E1535 WeakPolarHBondContact CB-O 3.49Å; P1533-E1535 VanDerWaalsContact CG-O 3.24Å; P1533-E1535 WeakPolarHBondContact CG-O 3.23Å; P1533-E1535 PolarHBondContact O-N 3.41Å; P1533-E1535 VanDerWaalsContact O-N 3.1Å; E1535-R1537 HydrophobicContact CB-CG 4.31Å; E1535-R1537 PolarHBondContact O-N 2.75Å; E1535-R1537 VanDerWaalsContact O-N 3.12Å; E1535-R1537 IonicContact OE2-CZ 3.43Å; E1535-R1537 VanDerWaalsContact OE2-CZ 3.23Å; E1535-R1537 IonicContact OE2-NE 3.13Å; E1535-R1537 PolarHBondContact OE2-NE 3.32Å; E1535-R1537 IonicContact OE2-NH2 3.37Å; E1535-R1537 PolarHBondContact OE2-NH2 3.28Å; E1535-I2344 CarbonylContact C-O 3.51Å; E1535-I2344 WeakPolarHBondContact CA-O 3.26Å
1536	I	52.2	Low	53.3	Low	11 Å²	11	71.4 Å²	71.4	6%	0.056	38%	0.379	C	S	.	.			trans	-81.7	85.4	174.4	-52.9	176.8	0	0	0	109	I2344 M2345 P2346 L2421	I1536-I2344 HydrophobicContact CD1-CD1 4.08Å; I1536-I2344 HydrophobicContact CD1-CG1 4.12Å; I1536-I2344 HydrophobicContact CG1-CG1 4.49Å; I1536-I2344 PolarHBondContact N-O 2.8Å; I1536-M2345 HydrophobicContact CB-CG 4.29Å; I1536-M2345 HydrophobicContact CD1-CG 4.39Å; I1536-P2346 WeakPolarHBondContact O-CD 3.44Å; I1536-L2421 HydrophobicContact CD1-CD1 4.03Å; I1536-L2421 HydrophobicContact CD1-CD2 3.91Å
1537	R	44.6	Very low	50.1	Low	158 Å²	158	79.5 Å²	79.5	60%	0.596	41%	0.413	S	S	*	.			trans	-70.6	146.1	-175.2	-64	-173.7	174.4	-161.5	-3.2	113.3	E1535 P2346	E1535-R1537 HydrophobicContact CB-CG 4.31Å; E1535-R1537 PolarHBondContact O-N 2.75Å; E1535-R1537 VanDerWaalsContact O-N 3.12Å; E1535-R1537 IonicContact OE2-CZ 3.43Å; E1535-R1537 VanDerWaalsContact OE2-CZ 3.23Å; E1535-R1537 IonicContact OE2-NE 3.13Å; E1535-R1537 PolarHBondContact OE2-NE 3.32Å; E1535-R1537 IonicContact OE2-NH2 3.37Å; E1535-R1537 PolarHBondContact OE2-NH2 3.28Å; R1537-P2346 HydrophobicContact CG-CG 4.35Å
1538	V	36	Very low	46.9	Very low	38 Å²	38	83.4 Å²	83.4	23%	0.23	44%	0.442	C	S	.	.			trans	-110.1	122.5	-173	172.2	0	0	0	0	110.6	N2347	V1538-N2347 HydrophobicContact CB-CB 4.28Å; V1538-N2347 HydrophobicContact CG2-CB 3.95Å
1539	F	36.8	Very low	43.7	Very low	143 Å²	143	90.6 Å²	90.6	63%	0.627	48%	0.476	S	S	*	.			trans	-106.7	143.6	170	-61.2	-77.8	0	0	0	110.6
1540	P	30.4	Very low	40.4	Very low	89 Å²	89	93.6 Å²	93.6	58%	0.578	50%	0.497	S	S	*	.	P	Polyproline II helix	trans	-71.9	142.2	177.1	29.5	-34.2	0	0	0	112
1541	V	27.9	Very low	37.4	Very low	114 Å²	114	98.9 Å²	98.9	69%	0.691	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-70.1	138.8	-177.3	179.4	0	0	0	0	111.2	A1543 D2378	V1541-A1543 PolarHBondContact O-N 2.53Å; V1541-D2378 HydrophobicContact CG2-CB 4.36Å
1542	K	24.8	Very low	34.6	Very low	185 Å²	185	109.8 Å²	109.8	80%	0.804	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-70.7	119.4	167.6	-68.4	-178.3	-180	179.4	0	108.8	D1544	K1542-D1544 PolarHBondContact O-N 3.27Å
1543	A	26.6	Very low	32.1	Very low	93 Å²	93	116.2 Å²	116.2	77%	0.769	60%	0.602	S	S	*	*			trans	-77.4	104.3	175	0	0	0	0	0	110.1	V1541	V1541-A1543 PolarHBondContact O-N 2.53Å
1544	D	25.4	Very low	30.1	Very low	138 Å²	138	122.4 Å²	122.4	74%	0.738	63%	0.631	S	S	*	*			trans	-70.9	143.9	169.4	-66	-46.6	0	0	0	110.7	K1542 L1546	K1542-D1544 PolarHBondContact O-N 3.27Å; D1544-L1546 PolarHBondContact O-N 2.85Å; D1544-L1546 VanDerWaalsContact O-N 3.14Å
1545	N	25.7	Very low	28.3	Very low	158 Å²	158	125.2 Å²	125.2	85%	0.845	65%	0.647	S	S	*	*			trans	-77.4	101.3	-170.4	-59.4	-70.7	0	0	0	111.6	K1547	N1545-K1547 PolarHBondContact O-N 3.19Å
1546	L	24	Very low	26.7	Very low	149 Å²	149	127.2 Å²	127.2	78%	0.78	67%	0.665	S	S	*	*			trans	-67.3	120	159.7	-88.3	76.3	0	0	0	109.1	D1544	D1544-L1546 PolarHBondContact O-N 2.85Å; D1544-L1546 VanDerWaalsContact O-N 3.14Å
1547	K	23	Very low	25.2	Very low	184 Å²	184	136 Å²	136	80%	0.8	70%	0.702	S	S	*	*			trans	-76.5	121.8	157	-65.4	175.2	-174.3	165.6	0	107.3	N1545	N1545-K1547 PolarHBondContact O-N 3.19Å
1548	S	23.3	Very low	24	Very low	95 Å²	95	138 Å²	138	66%	0.664	72%	0.715	S	S	*	*			trans	-97.7	96.4	168.8	57.7	0	0	0	0	109.2
1549	E	21.6	Very low	23.1	Very low	165 Å²	165	143.2 Å²	143.2	77%	0.771	74%	0.741	S	S	*	*			trans	-85.6	144.5	155.4	-68.9	-169.6	151.7	0	0	108.4
1550	S	20.5	Very low	22.3	Very low	64 Å²	64	142.1 Å²	142.1	45%	0.448	75%	0.747	S	S	.	*			trans	-168.9	-177.3	169.9	-154.5	0	0	0	0	108.7
1551	T	22.4	Very low	21.7	Very low	120 Å²	120	143.2 Å²	143.2	74%	0.736	75%	0.752	S	S	*	*			trans	56.6	84.9	-178.8	43.2	0	0	0	0	115.3
1552	R	21	Very low	21.3	Very low	234 Å²	234	147 Å²	147	88%	0.883	76%	0.762	S	S	*	*			trans	-58.6	161.8	146.2	-161.5	-173.8	-170.6	179.3	4.2	109.7
1553	M	18.4	Very low	21.1	Very low	142 Å²	142	140.8 Å²	140.8	70%	0.7	75%	0.751	S	S	*	*			trans	77.5	90.2	164.8	-53.2	-160.4	69.6	0	0	118.6	T1555	M1553-T1555 HydrophobicContact CE-CG2 4.01Å
1554	L	20.4	Very low	20.8	Very low	177 Å²	177	144.1 Å²	144.1	93%	0.927	75%	0.75	S	S	*	*				-119	140.7	124.7	-101.1	169.4	0	0	0	108.6
1555	T	17.9	Very low	20.5	Very low	96 Å²	96	144.1 Å²	144.1	59%	0.589	75%	0.747	S	S	*	*			trans	-119.9	157.2	-176.3	47.6	0	0	0	0	112.1	M1553	M1553-T1555 HydrophobicContact CE-CG2 4.01Å
1556	T	18.7	Very low	20.1	Very low	118 Å²	118	142.7 Å²	142.7	72%	0.724	74%	0.739	S	S	*	*			trans	65.8	109.8	158.5	44.2	0	0	0	0	120.9
1557	K	20.2	Very low	19.9	Very low	196 Å²	196	140.9 Å²	140.9	85%	0.852	74%	0.735	S	S	*	*			trans	58.3	102.8	130.6	-62.4	-178.6	176	-179.7	0	120.8
1558	K	19.7	Very low	19.8	Very low	200 Å²	200	137.9 Å²	137.9	87%	0.87	73%	0.732	S	S	*	*				-170.9	136.6	118.7	-96.7	177	177.6	-178.3	0	107
1559	L	17.5	Very low	19.6	Very low	148 Å²	148	139.7 Å²	139.7	78%	0.775	73%	0.734	S	S	*	*			cis	85.1	94.8	41.4	-167	103	0	0	0	113.3
1560	T	18.7	Very low	19.5	Very low	120 Å²	120	137.7 Å²	137.7	74%	0.736	73%	0.728	S	S	*	*				177.5	149.5	117.3	36.3	0	0	0	0	113.8
1561	T	18.3	Very low	19.4	Very low	112 Å²	112	142.4 Å²	142.4	69%	0.687	74%	0.743	S	S	*	*			trans	59.4	120.4	149.7	49.6	0	0	0	0	123.4
1562	E	18.4	Very low	19.2	Very low	193 Å²	193	144.1 Å²	144.1	90%	0.902	75%	0.748	S	S	*	*			trans	75.4	140.6	143.3	-65	168.6	-145.8	0	0	120.2
1563	G	21.7	Very low	19.2	Very low	55 Å²	55	136.5 Å²	136.5	57%	0.567	74%	0.742	S	S	*	*			trans	147.8	-2.7	174.5	0	0	0	0	0	120.4
1564	H	20.9	Very low	19.3	Very low	162 Å²	162	140.2 Å²	140.2	75%	0.75	75%	0.75	S	S	*	*			trans	30.7	123.1	168.6	-93.7	-58.9	0	0	0	123.6
1565	M	17.3	Very low	19.2	Very low	138 Å²	138	137 Å²	137	68%	0.68	74%	0.741	S	S	*	*			trans	82.9	112.3	144.5	-59.3	-49.2	-162.9	0	0	122.3
1566	N	19.2	Very low	19.2	Very low	128 Å²	128	136.3 Å²	136.3	68%	0.684	75%	0.745	S	S	*	*			trans	63	119.4	133.7	-52.6	-5.9	0	0	0	119.3
1567	T	19.4	Very low	19.2	Very low	112 Å²	112	137.2 Å²	137.2	69%	0.687	75%	0.746	S	S	*	*			cis	76	142.4	38.7	77.3	0	0	0	0	115.8
1568	T	19.4	Very low	19.1	Very low	121 Å²	121	133.6 Å²	133.6	74%	0.742	74%	0.74	S	S	*	*			trans	74.9	145.6	176.1	77.1	0	0	0	0	115.8
1569	N	20.1	Very low	19.1	Very low	133 Å²	133	129.5 Å²	129.5	71%	0.711	73%	0.732	S	S	*	*			cis	-161.5	172.3	-18.3	-108.5	-2.8	0	0	0	109.9
1570	L	19.1	Very low	19.2	Very low	123 Å²	123	128.9 Å²	128.9	64%	0.644	73%	0.729	S	S	*	*			trans	36.4	116.5	148.1	-85.5	67.1	0	0	0	119.2
1571	E	18	Very low	19.2	Very low	162 Å²	162	130.9 Å²	130.9	76%	0.757	73%	0.73	S	S	*	*				86.8	149.9	90.9	-75.9	174.8	175	0	0	114.5
1572	D	19.8	Very low	19.2	Very low	156 Å²	156	130.8 Å²	130.8	83%	0.834	73%	0.73	S	S	*	*			trans	25.1	121.1	160.2	-60.6	-8.1	0	0	0	121.2
1573	G	20.6	Very low	19.2	Very low	74 Å²	74	127.8 Å²	127.8	76%	0.763	72%	0.724	S	S	*	*			trans	-165.3	73.7	178.5	0	0	0	0	0	117.1
1574	Y	19.5	Very low	19.1	Very low	220 Å²	220	129 Å²	129	86%	0.863	73%	0.729	S	S	*	*			trans	38.9	151.2	134.5	-83.7	-94.5	0	0	0	125.3
1575	C	18	Very low	19	Very low	110 Å²	110	128.9 Å²	128.9	74%	0.743	73%	0.734	S	S	*	*			trans	15.7	154.4	150.4	-68.9	0	0	0	0	125.2
1576	A	18.9	Very low	19.1	Very low	82 Å²	82	126.2 Å²	126.2	68%	0.678	73%	0.734	S	S	*	*			trans	-50.1	-177.3	154.6	0	0	0	0	0	116.4
1577	D	18.5	Very low	19.1	Very low	137 Å²	137	126.1 Å²	126.1	73%	0.733	74%	0.738	S	S	*	*			trans	99.4	96.6	157.2	-61.6	-20.8	0	0	0	119.8
1578	T	18.5	Very low	19	Very low	120 Å²	120	130.1 Å²	130.1	74%	0.736	75%	0.746	S	S	*	*				83.3	164.4	129.5	65.8	0	0	0	0	121.8
1579	T	19.7	Very low	19	Very low	114 Å²	114	128.9 Å²	128.9	70%	0.699	74%	0.742	S	S	*	*			trans	75.6	88.9	167.2	60.3	0	0	0	0	119.7
1580	D	18.3	Very low	19.1	Very low	135 Å²	135	131.3 Å²	131.3	72%	0.722	75%	0.749	S	S	*	*				65.7	169.5	112.5	-62	-51.1	0	0	0	123
1581	H	19.2	Very low	19.3	Very low	162 Å²	162	130.9 Å²	130.9	75%	0.75	76%	0.756	S	S	*	*			trans	77.2	84.1	161.6	-66.8	-59.5	0	0	0	120.6
1582	T	18.5	Very low	19.4	Very low	110 Å²	110	130.4 Å²	130.4	68%	0.675	75%	0.754	S	S	*	*				47.1	139.8	110.4	56.1	0	0	0	0	121.8
1583	T	18.9	Very low	19.6	Very low	129 Å²	129	127.1 Å²	127.1	79%	0.791	74%	0.743	S	S	*	*			trans	68.3	105.3	147.2	47.9	0	0	0	0	120.6
1584	A	19.4	Very low	19.6	Very low	81 Å²	81	130.5 Å²	130.5	67%	0.669	74%	0.744	S	S	*	*				67.6	129.9	117.8	0	0	0	0	0	122.3
1585	N	18.7	Very low	19.7	Very low	159 Å²	159	128.1 Å²	128.1	85%	0.85	74%	0.74	S	S	*	*			trans	78.2	132.8	143.9	-63.7	-14.4	0	0	0	122
1586	A	19.1	Very low	19.8	Very low	83 Å²	83	130.7 Å²	130.7	69%	0.686	74%	0.739	S	S	*	*			trans	81.8	109.7	140.6	0	0	0	0	0	122
1587	T	19.1	Very low	19.8	Very low	126 Å²	126	137.3 Å²	137.3	77%	0.773	75%	0.746	S	S	*	*			trans	55	109.7	133.2	63.8	0	0	0	0	119
1588	K	18.5	Very low	19.8	Very low	195 Å²	195	133.7 Å²	133.7	85%	0.848	74%	0.742	S	S	*	*				-173.8	135.6	76.8	-94.8	-179.5	177.7	174.3	0	115.1
1589	S	19.8	Very low	20	Very low	95 Å²	95	133 Å²	133	66%	0.664	74%	0.742	S	S	*	*			trans	40.2	110.2	141.3	63.1	0	0	0	0	124.8
1590	H	21.1	Very low	20	Very low	185 Å²	185	136.7 Å²	136.7	86%	0.856	75%	0.748	S	S	*	*				63.1	144.4	120.2	-73.2	-73	0	0	0	125.9
1591	S	22.5	Very low	20.1	Very low	113 Å²	113	136.6 Å²	136.6	79%	0.79	75%	0.752	S	S	*	*			trans	75.1	146.4	164.7	71.3	0	0	0	0	116.9
1592	Q	22	Very low	20.3	Very low	153 Å²	153	134 Å²	134	72%	0.715	75%	0.748	S	S	*	*			cis	-147.5	-169.7	2.4	-138.6	-179.8	34	0	0	112.6
1593	S	22.2	Very low	20.6	Very low	86 Å²	86	133.6 Å²	133.6	60%	0.601	74%	0.741	S	S	*	*			trans	-50.5	168.8	178	50.5	0	0	0	0	118
1594	N	20.5	Very low	20.7	Very low	145 Å²	145	132 Å²	132	78%	0.775	73%	0.728	S	S	*	*			cis	-168.3	141.9	1	-118.4	-27.5	0	0	0	110
1595	H	21.6	Very low	21	Very low	170 Å²	170	129.9 Å²	129.9	79%	0.787	70%	0.704	S	S	*	*				174.4	144.1	126.9	-108.3	-94.9	0	0	0	116.2
1596	K	22	Very low	21.4	Very low	164 Å²	164	128.9 Å²	128.9	71%	0.713	69%	0.692	S	S	*	*			trans	-13.4	147.7	158.4	-71.3	179.7	175	-179.5	0	119.2
1597	W	18	Very low	21.8	Very low	221 Å²	221	127.7 Å²	127.7	84%	0.837	68%	0.679	S	S	*	*			cis	-157.6	135.6	-1.3	-165.5	-64.3	0	0	0	110.8
1598	G	19.5	Very low	22.5	Very low	62 Å²	62	126.8 Å²	126.8	64%	0.639	68%	0.678	S	S	*	*			trans	-90.3	133.3	-179.4	0	0	0	0	0	116.1
1599	S	20.8	Very low	23.4	Very low	105 Å²	105	122.5 Å²	122.5	73%	0.734	66%	0.66	S	S	*	*			trans	-68.9	160.6	140.8	-87.4	0	0	0	0	109.1
1600	K	20.8	Very low	24.3	Very low	191 Å²	191	119.7 Å²	119.7	83%	0.83	64%	0.638	S	S	*	*			cis	-164.7	162.3	3	-110.8	159.5	-171.3	176.3	0	106.6
1601	V	21.2	Very low	25.3	Very low	133 Å²	133	112 Å²	112	81%	0.806	60%	0.604	S	S	*	*			trans	165.7	124.2	137.3	153.6	0	0	0	0	113.5
1602	T	23.3	Very low	26.1	Very low	108 Å²	108	110.6 Å²	110.6	66%	0.663	59%	0.594	S	S	*	*			trans	26.6	124.7	158.7	66.3	0	0	0	0	127.1
1603	N	24	Very low	27.6	Very low	101 Å²	101	110.1 Å²	110.1	54%	0.54	59%	0.587	S	S	.	*				60.5	124.4	117.8	-51.4	26.3	0	0	0	123	E1605	N1603-E1605 VanDerWaalsContact CB-OE1 3.24Å; N1603-E1605 WeakPolarHBondContact CB-OE1 3.47Å; N1603-E1605 PolarHBondContact ND2-OE1 2.75Å
1604	L	21.9	Very low	28.5	Very low	96 Å²	96	106.2 Å²	106.2	50%	0.503	56%	0.559	S	S	.	*			trans	-148.9	125.6	131.5	-177.7	132.1	0	0	0	108.3	I1039	I1039-L1604 HydrophobicContact CD1-CD1 4.04Å; I1039-L1604 HydrophobicContact CD1-CG 4.34Å
1605	E	25.7	Very low	29.9	Very low	36 Å²	36	104.6 Å²	104.6	17%	0.168	54%	0.543	C	S	.	.			trans	-111.8	-170.6	-172.4	-49.8	102.7	171.4	0	0	113.6	T1037 S1038 N1603	T1037-E1605 HydrophobicContact CG2-CB 3.9Å; T1037-E1605 HydrophobicContact CG2-CG 3.9Å; S1038-E1605 WeakPolarHBondContact CB-OE2 3.27Å; S1038-E1605 PolarHBondContact N-OE2 3.42Å; S1038-E1605 PolarHBondContact OG-OE2 2.86Å; N1603-E1605 VanDerWaalsContact CB-OE1 3.24Å; N1603-E1605 WeakPolarHBondContact CB-OE1 3.47Å; N1603-E1605 PolarHBondContact ND2-OE1 2.75Å
1606	K	25.4	Very low	31.2	Very low	138 Å²	138	100 Å²	100	60%	0.6	53%	0.528	S	S	*	.			trans	-127.1	123.2	-153.5	-60.4	-178.5	169.8	-148.2	0	113	E1835	K1606-E1835 WeakPolarHBondContact CD-OE1 3.48Å; K1606-E1835 VanDerWaalsContact CE-OE1 3.28Å; K1606-E1835 WeakPolarHBondContact CE-OE1 3.42Å; K1606-E1835 IonicContact NZ-OE1 3.35Å; K1606-E1835 PolarHBondContact NZ-OE1 3.02Å; K1606-E1835 IonicContact NZ-OE2 2.74Å; K1606-E1835 PolarHBondContact NZ-OE2 3.36Å
1607	S	28.4	Very low	32.6	Very low	58 Å²	58	94.5 Å²	94.5	41%	0.406	50%	0.504	S	S	.	.			trans	-117.8	133.9	160.7	58.2	0	0	0	0	109.4
1608	S	32.7	Very low	34	Very low	108 Å²	108	84.6 Å²	84.6	76%	0.755	47%	0.469	S	S	*	.			trans	-129.1	82.3	-174.9	51	0	0	0	0	109.9
1609	H	37.5	Very low	35.3	Very low	104 Å²	104	84 Å²	84	48%	0.481	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-100.6	149.6	-176.4	-65.4	-82.5	0	0	0	112	Y1827	H1609-Y1827 VanDerWaalsContact O-CE1 3.29Å; H1609-Y1827 WeakPolarHBondContact O-CE1 3.36Å; H1609-Y1827 PolarHBondContact O-OH 3.2Å
1610	L	39.5	Very low	36.6	Very low	36 Å²	36	83.1 Å²	83.1	19%	0.188	44%	0.442	C	S	.	.	P	Polyproline II helix	trans	-75.6	148.5	172.7	-169.4	67.8	0	0	0	110.4	Y1044 L1614 W1820 F1824 Y1827	Y1044-L1610 PolarHBondContact OH-O 2.86Å; L1610-L1614 HydrophobicContact CD1-CD1 4.29Å; L1610-W1820 HydrophobicContact CD2-CH2 4.38Å; L1610-W1820 HydrophobicContact CD2-CZ2 3.9Å; L1610-F1824 HydrophobicContact CD1-CD2 3.53Å; L1610-F1824 HydrophobicContact CD1-CE2 3.77Å; L1610-F1824 HydrophobicContact CD1-CG 4.48Å; L1610-F1824 HydrophobicContact CD2-CD2 4Å; L1610-F1824 HydrophobicContact CD2-CE2 4.12Å; L1610-F1824 HydrophobicContact CG-CD2 4.42Å; L1610-F1824 HydrophobicContact CG-CE2 4.48Å; L1610-Y1827 HydrophobicContact CD1-CD1 3.88Å; L1610-Y1827 HydrophobicContact CD1-CE1 4.36Å
1611	P	42.9	Very low	38	Very low	24 Å²	24	75.6 Å²	75.6	16%	0.156	41%	0.412	C	S	.	.	P	Polyproline II helix	trans	-63.9	137.9	175.3	-21.8	35.5	0	0	0	111.4	Y1613 L1614 Y1827	P1611-Y1613 VanDerWaalsContact C-N 3.26Å; P1611-Y1613 HydrophobicContact CB-CD1 3.58Å; P1611-Y1613 HydrophobicContact CB-CE1 3.43Å; P1611-Y1613 VanDerWaalsContact CB-CE1 3.43Å; P1611-Y1613 HydrophobicContact CG-CE1 4.09Å; P1611-Y1613 PolarHBondContact O-N 3.17Å; P1611-L1614 HydrophobicContact CG-CD1 4.49Å; P1611-L1614 PolarHBondContact O-N 3.36Å; P1611-Y1827 HydrophobicContact CG-CD1 4.44Å; P1611-Y1827 HydrophobicContact CG-CD2 3.61Å; P1611-Y1827 HydrophobicContact CG-CE1 4.23Å; P1611-Y1827 HydrophobicContact CG-CE2 3.36Å; P1611-Y1827 HydrophobicContact CG-CG 4.14Å
1612	S	39.4	Very low	39.2	Very low	83 Å²	83	72.1 Å²	72.1	58%	0.58	39%	0.389	S	S	*	.	H	α-helix	trans	-57	-36.9	-178.5	46.6	0	0	0	0	113.4	L1614 Y1615 T1616	S1612-L1614 PolarHBondContact O-N 2.77Å; S1612-Y1615 WeakPolarHBondContact O-CB 3.5Å; S1612-Y1615 PolarHBondContact O-N 2.82Å; S1612-Y1615 VanDerWaalsContact O-N 3.09Å; S1612-T1616 PolarHBondContact O-N 3.08Å; S1612-T1616 PolarHBondContact O-OG1 3.35Å
1613	Y	52.4	Low	40.3	Very low	144 Å²	144	71 Å²	71	57%	0.565	38%	0.382	S	S	*	.	H	α-helix	trans	-63	-38.7	-176.9	76.9	-92.3	0	0	0	113.4	P1611 Y1615 T1616 E1617	P1611-Y1613 VanDerWaalsContact C-N 3.26Å; P1611-Y1613 HydrophobicContact CB-CD1 3.58Å; P1611-Y1613 HydrophobicContact CB-CE1 3.43Å; P1611-Y1613 VanDerWaalsContact CB-CE1 3.43Å; P1611-Y1613 HydrophobicContact CG-CE1 4.09Å; P1611-Y1613 PolarHBondContact O-N 3.17Å; Y1613-Y1615 VanDerWaalsContact C-N 3.26Å; Y1613-Y1615 PolarHBondContact O-N 2.96Å; Y1613-T1616 WeakPolarHBondContact CA-OG1 3.47Å; Y1613-T1616 PolarHBondContact O-N 3.23Å; Y1613-T1616 PolarHBondContact O-OG1 3.36Å; Y1613-E1617 VanDerWaalsContact O-CB 3.3Å; Y1613-E1617 WeakPolarHBondContact O-CB 3.42Å; Y1613-E1617 PolarHBondContact O-N 3.02Å
1614	L	41.6	Very low	41.4	Very low	4 Å²	4	70.7 Å²	70.7	2%	0.021	38%	0.376	C	S	.	.	H	α-helix	trans	-69.6	-24.5	176.3	-68.8	177.6	0	0	0	112.6	L1610 P1611 S1612 A1618 W1820 R1823	L1610-L1614 HydrophobicContact CD1-CD1 4.29Å; P1611-L1614 HydrophobicContact CG-CD1 4.49Å; P1611-L1614 PolarHBondContact O-N 3.36Å; S1612-L1614 PolarHBondContact O-N 2.77Å; L1614-A1618 PolarHBondContact O-N 3.4Å; L1614-W1820 PolarHBondContact O-NE1 3.4Å; L1614-R1823 HydrophobicContact CD2-CB 4.47Å
1615	Y	48.5	Very low	42.7	Very low	110 Å²	110	67.1 Å²	67.1	43%	0.431	36%	0.356	S	S	.	.	H	α-helix	trans	-79.4	-44.3	175.1	-172.2	-91.6	0	0	0	111.1	S1612 Y1613 A1618 S1619	S1612-Y1615 WeakPolarHBondContact O-CB 3.5Å; S1612-Y1615 PolarHBondContact O-N 2.82Å; S1612-Y1615 VanDerWaalsContact O-N 3.09Å; Y1613-Y1615 VanDerWaalsContact C-N 3.26Å; Y1613-Y1615 PolarHBondContact O-N 2.96Å; Y1615-A1618 PolarHBondContact O-N 2.86Å; Y1615-S1619 WeakPolarHBondContact O-CB 3.27Å; Y1615-S1619 PolarHBondContact O-N 3.15Å
1616	T	49.8	Very low	43.7	Very low	75 Å²	75	72 Å²	72	46%	0.46	37%	0.374	S	S	.	.	H	α-helix	trans	-64.3	-42.3	174.7	48.4	0	0	0	0	112	S1612 Y1613 A1618 S1619 D1620	S1612-T1616 PolarHBondContact O-N 3.08Å; S1612-T1616 PolarHBondContact O-OG1 3.35Å; Y1613-T1616 WeakPolarHBondContact CA-OG1 3.47Å; Y1613-T1616 PolarHBondContact O-N 3.23Å; Y1613-T1616 PolarHBondContact O-OG1 3.36Å; T1616-A1618 VanDerWaalsContact C-N 3.35Å; T1616-A1618 PolarHBondContact O-N 2.67Å; T1616-S1619 PolarHBondContact O-N 2.99Å; T1616-D1620 PolarHBondContact O-N 3.43Å
1617	E	50.9	Low	44.6	Very low	47 Å²	47	69.3 Å²	69.3	22%	0.22	37%	0.369	C	S	.	.	H	α-helix	trans	-57.3	-45.7	176.9	-174.3	-179.7	-168.8	0	0	111.5	Y1613 V1621 R1823	Y1613-E1617 VanDerWaalsContact O-CB 3.3Å; Y1613-E1617 WeakPolarHBondContact O-CB 3.42Å; Y1613-E1617 PolarHBondContact O-N 3.02Å; E1617-V1621 WeakPolarHBondContact O-CB 3.32Å; E1617-V1621 VanDerWaalsContact O-CG2 3.23Å; E1617-V1621 WeakPolarHBondContact O-CG2 3.27Å; E1617-V1621 PolarHBondContact O-N 3.33Å; E1617-R1823 VanDerWaalsContact CD-NH1 3.33Å; E1617-R1823 IonicContact OE1-CZ 2.69Å; E1617-R1823 IonicContact OE1-NH1 2.64Å; E1617-R1823 PolarHBondContact OE1-NH1 3.08Å; E1617-R1823 IonicContact OE2-NH1 2.67Å; E1617-R1823 PolarHBondContact OE2-NH1 3.49Å; E1617-R1823 VanDerWaalsContact OE2-NH1 3.08Å
1618	A	48.5	Very low	45.3	Very low	13 Å²	13	68 Å²	68	11%	0.107	36%	0.357	C	S	.	.	H	α-helix	trans	-70	-38.5	176.6	0	0	0	0	0	113.4	L1614 Y1615 T1616 L1622 F1816	L1614-A1618 PolarHBondContact O-N 3.4Å; Y1615-A1618 PolarHBondContact O-N 2.86Å; T1616-A1618 VanDerWaalsContact C-N 3.35Å; T1616-A1618 PolarHBondContact O-N 2.67Å; A1618-L1622 WeakPolarHBondContact O-CB 3.5Å; A1618-L1622 VanDerWaalsContact O-CG 3.26Å; A1618-L1622 WeakPolarHBondContact O-CG 3.43Å; A1618-L1622 PolarHBondContact O-N 3.17Å; A1618-F1816 HydrophobicContact CB-CE1 4.32Å; A1618-F1816 HydrophobicContact CB-CZ 4.36Å
1619	S	46.1	Very low	45.9	Very low	51 Å²	51	63.6 Å²	63.6	36%	0.357	33%	0.325	S	S	.	.	H	α-helix	trans	-66.9	-45.3	-179	-171.3	0	0	0	0	112.2	Y1615 T1616 T1623	Y1615-S1619 WeakPolarHBondContact O-CB 3.27Å; Y1615-S1619 PolarHBondContact O-N 3.15Å; T1616-S1619 PolarHBondContact O-N 2.99Å; S1619-T1623 VanDerWaalsContact O-CB 3.3Å; S1619-T1623 WeakPolarHBondContact O-CB 3.32Å; S1619-T1623 PolarHBondContact O-N 3.38Å; S1619-T1623 PolarHBondContact O-OG1 3.33Å
1620	D	48.8	Very low	46.2	Very low	85 Å²	85	62.3 Å²	62.3	46%	0.455	33%	0.325	S	S	.	.	H	α-helix	trans	-61.8	-47.2	177.2	-71.2	-12.6	0	0	0	111.1	T1616 T1623 K1624	T1616-D1620 PolarHBondContact O-N 3.43Å; D1620-T1623 PolarHBondContact O-N 2.96Å; D1620-K1624 PolarHBondContact O-N 3Å
1621	V	49.2	Very low	46.3	Very low	33 Å²	33	63.3 Å²	63.3	20%	0.2	33%	0.332	C	S	.	.	H	α-helix	trans	-62	-49.4	-179.9	163.9	0	0	0	0	111.9	E1617 T1623 K1624 Y1625 W1812 F1816	E1617-V1621 WeakPolarHBondContact O-CB 3.32Å; E1617-V1621 VanDerWaalsContact O-CG2 3.23Å; E1617-V1621 WeakPolarHBondContact O-CG2 3.27Å; E1617-V1621 PolarHBondContact O-N 3.33Å; V1621-T1623 VanDerWaalsContact C-N 3.33Å; V1621-T1623 PolarHBondContact O-N 3.47Å; V1621-K1624 PolarHBondContact O-N 3.07Å; V1621-Y1625 WeakPolarHBondContact O-CB 3.38Å; V1621-Y1625 PolarHBondContact O-N 2.9Å; V1621-W1812 HydrophobicContact CG1-CH2 3.51Å; V1621-W1812 HydrophobicContact CG1-CZ3 3.64Å; V1621-W1812 HydrophobicContact CG2-CH2 4.33Å; V1621-F1816 HydrophobicContact CB-CE1 4.2Å; V1621-F1816 HydrophobicContact CB-CE2 4.41Å; V1621-F1816 HydrophobicContact CB-CZ 3.99Å; V1621-F1816 HydrophobicContact CG1-CD1 3.92Å; V1621-F1816 HydrophobicContact CG1-CD2 4.31Å; V1621-F1816 HydrophobicContact CG1-CE1 3.78Å; V1621-F1816 HydrophobicContact CG1-CE2 4.18Å; V1621-F1816 HydrophobicContact CG1-CG 4.19Å; V1621-F1816 HydrophobicContact CG1-CZ 3.92Å; V1621-F1816 HydrophobicContact CG2-CE2 4.1Å; V1621-F1816 HydrophobicContact CG2-CZ 4.09Å
1622	L	47.4	Very low	46.2	Very low	61 Å²	61	62.2 Å²	62.2	32%	0.319	33%	0.325	S	S	.	.	H	α-helix	trans	-64.3	-39.7	179.2	-72.9	169.7	0	0	0	111.3	A1618 Y1625 Y1626	A1618-L1622 WeakPolarHBondContact O-CB 3.5Å; A1618-L1622 VanDerWaalsContact O-CG 3.26Å; A1618-L1622 WeakPolarHBondContact O-CG 3.43Å; A1618-L1622 PolarHBondContact O-N 3.17Å; L1622-Y1625 PolarHBondContact O-N 2.91Å; L1622-Y1626 HydrophobicContact CB-CD2 4.49Å; L1622-Y1626 HydrophobicContact CB-CE2 4.43Å; L1622-Y1626 HydrophobicContact CD2-CE2 4.42Å; L1622-Y1626 WeakPolarHBondContact O-CD2 3.01Å; L1622-Y1626 PolarHBondContact O-N 3.15Å
1623	T	46.6	Very low	46.2	Very low	83 Å²	83	64 Å²	64	51%	0.509	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-49	178.4	-56.2	0	0	0	0	111.2	S1619 D1620 V1621 Y1625 Y1626 T1627	S1619-T1623 VanDerWaalsContact O-CB 3.3Å; S1619-T1623 WeakPolarHBondContact O-CB 3.32Å; S1619-T1623 PolarHBondContact O-N 3.38Å; S1619-T1623 PolarHBondContact O-OG1 3.33Å; D1620-T1623 PolarHBondContact O-N 2.96Å; V1621-T1623 VanDerWaalsContact C-N 3.33Å; V1621-T1623 PolarHBondContact O-N 3.47Å; T1623-Y1625 VanDerWaalsContact C-N 3.34Å; T1623-Y1625 PolarHBondContact O-N 3.3Å; T1623-Y1626 PolarHBondContact O-N 3.29Å; T1623-T1627 PolarHBondContact O-N 3.38Å; T1623-T1627 PolarHBondContact O-OG1 2.74Å; T1623-T1627 VanDerWaalsContact O-OG1 3.12Å
1624	K	46.7	Very low	45.5	Very low	95 Å²	95	60.8 Å²	60.8	41%	0.413	32%	0.32	S	S	.	.	H	α-helix	trans	-56.6	-46.2	173.5	-77	-165.9	174.4	-158.5	0	111.8	D1620 V1621 T1627 I1628 D1669	D1620-K1624 PolarHBondContact O-N 3Å; V1621-K1624 PolarHBondContact O-N 3.07Å; K1624-T1627 PolarHBondContact O-N 2.75Å; K1624-I1628 WeakPolarHBondContact O-CG1 3.23Å; K1624-I1628 PolarHBondContact O-N 3.21Å; K1624-D1669 IonicContact NZ-OD1 2.82Å; K1624-D1669 PolarHBondContact NZ-OD1 2.9Å
1625	Y	49.2	Very low	45.1	Very low	21 Å²	21	62.9 Å²	62.9	8%	0.082	33%	0.33	C	S	.	.	H	α-helix	trans	-61.1	-45.2	179.7	167.9	-96.9	0	0	0	113	V1621 L1622 T1623 T1627 I1628 N1629 L1809 M1813	V1621-Y1625 WeakPolarHBondContact O-CB 3.38Å; V1621-Y1625 PolarHBondContact O-N 2.9Å; L1622-Y1625 PolarHBondContact O-N 2.91Å; T1623-Y1625 VanDerWaalsContact C-N 3.34Å; T1623-Y1625 PolarHBondContact O-N 3.3Å; Y1625-T1627 PolarHBondContact O-N 3.03Å; Y1625-I1628 PolarHBondContact O-N 3.11Å; Y1625-N1629 WeakPolarHBondContact CE1-ND2 3.43Å; Y1625-N1629 WeakPolarHBondContact O-CB 3.3Å; Y1625-N1629 PolarHBondContact O-N 2.89Å; Y1625-N1629 PolarHBondContact OH-ND2 2.89Å; Y1625-N1629 VanDerWaalsContact OH-ND2 3.09Å; Y1625-L1809 HydrophobicContact CE2-CB 4.24Å; Y1625-M1813 HydrophobicContact CD1-SD 3.73Å; Y1625-M1813 HydrophobicContact CE1-CE 4.09Å; Y1625-M1813 HydrophobicContact CE1-SD 3.29Å; Y1625-M1813 WeakPolarHBondContact CE1-SD 3.44Å; Y1625-M1813 HydrophobicContact CE2-CB 4.45Å; Y1625-M1813 HydrophobicContact CE2-SD 4.15Å; Y1625-M1813 HydrophobicContact CG-SD 4.3Å; Y1625-M1813 VanDerWaalsContact CZ-SD 3.51Å
1626	Y	45.5	Very low	44.5	Very low	140 Å²	140	59.3 Å²	59.3	55%	0.549	32%	0.318	S	S	.	.	H	α-helix	trans	-66.1	-37.3	-179.7	-79.4	-63.6	0	0	0	112.5	L1622 T1623 T1630	L1622-Y1626 HydrophobicContact CB-CD2 4.49Å; L1622-Y1626 HydrophobicContact CB-CE2 4.43Å; L1622-Y1626 HydrophobicContact CD2-CE2 4.42Å; L1622-Y1626 WeakPolarHBondContact O-CD2 3.01Å; L1622-Y1626 PolarHBondContact O-N 3.15Å; T1623-Y1626 PolarHBondContact O-N 3.29Å; Y1626-T1630 WeakPolarHBondContact O-CB 3.4Å; Y1626-T1630 WeakPolarHBondContact O-CG2 3.46Å; Y1626-T1630 PolarHBondContact O-N 3.06Å; Y1626-T1630 PolarHBondContact O-OG1 3.32Å
1627	T	45.6	Very low	44	Very low	81 Å²	81	59.5 Å²	59.5	50%	0.497	33%	0.327	S	S	.	.	H	α-helix	trans	-61.5	-52.7	172.5	-54.9	0	0	0	0	111.2	T1623 K1624 Y1625 N1629 T1630 V1631	T1623-T1627 PolarHBondContact O-N 3.38Å; T1623-T1627 PolarHBondContact O-OG1 2.74Å; T1623-T1627 VanDerWaalsContact O-OG1 3.12Å; K1624-T1627 PolarHBondContact O-N 2.75Å; Y1625-T1627 PolarHBondContact O-N 3.03Å; T1627-N1629 PolarHBondContact O-N 3.06Å; T1627-T1630 PolarHBondContact O-N 3.16Å; T1627-T1630 PolarHBondContact O-OG1 3.2Å; T1627-V1631 WeakPolarHBondContact O-CG2 3.12Å; T1627-V1631 PolarHBondContact O-N 2.98Å
1628	I	43.5	Very low	43.3	Very low	31 Å²	31	63.3 Å²	63.3	16%	0.159	35%	0.348	C	S	.	.	H	α-helix	trans	-59	-46.2	179.2	-68.6	167.3	0	0	0	111.1	K1624 Y1625 T1630 I1632 L1675 L1809	K1624-I1628 WeakPolarHBondContact O-CG1 3.23Å; K1624-I1628 PolarHBondContact O-N 3.21Å; Y1625-I1628 PolarHBondContact O-N 3.11Å; I1628-T1630 VanDerWaalsContact C-N 3.34Å; I1628-T1630 PolarHBondContact O-N 2.87Å; I1628-I1632 HydrophobicContact CG2-CD1 3.56Å; I1628-I1632 HydrophobicContact CG2-CG1 4.39Å; I1628-I1632 VanDerWaalsContact O-CB 3.29Å; I1628-I1632 WeakPolarHBondContact O-CB 3.38Å; I1628-I1632 VanDerWaalsContact O-CG1 3.24Å; I1628-I1632 WeakPolarHBondContact O-CG1 3.41Å; I1628-I1632 PolarHBondContact O-N 3.38Å; I1628-L1675 HydrophobicContact CG2-CD1 3.97Å; I1628-L1809 HydrophobicContact CG2-CD1 3.68Å
1629	N	43.8	Very low	42.6	Very low	14 Å²	14	64.9 Å²	64.9	8%	0.075	35%	0.354	C	S	.	.	H	α-helix	trans	-65.3	-33	-179.2	-172.4	-6.4	0	0	0	112.9	Y1625 T1627 K1633	Y1625-N1629 WeakPolarHBondContact CE1-ND2 3.43Å; Y1625-N1629 WeakPolarHBondContact O-CB 3.3Å; Y1625-N1629 PolarHBondContact O-N 2.89Å; Y1625-N1629 PolarHBondContact OH-ND2 2.89Å; Y1625-N1629 VanDerWaalsContact OH-ND2 3.09Å; T1627-N1629 PolarHBondContact O-N 3.06Å; N1629-K1633 WeakPolarHBondContact O-CB 3.43Å; N1629-K1633 WeakPolarHBondContact O-CD 3.47Å; N1629-K1633 VanDerWaalsContact O-CG 3.25Å; N1629-K1633 WeakPolarHBondContact O-CG 3.35Å; N1629-K1633 PolarHBondContact O-N 3.28Å; N1629-K1633 WeakPolarHBondContact OD1-CE 3.4Å; N1629-K1633 PolarHBondContact OD1-NZ 3.32Å
1630	T	43.6	Very low	41.9	Very low	77 Å²	77	70.8 Å²	70.8	47%	0.472	38%	0.376	S	S	.	.	H	α-helix	trans	-76	-46.3	176.6	45.9	0	0	0	0	112.1	Y1626 T1627 I1628 I1632 K1633 C1634	Y1626-T1630 WeakPolarHBondContact O-CB 3.4Å; Y1626-T1630 WeakPolarHBondContact O-CG2 3.46Å; Y1626-T1630 PolarHBondContact O-N 3.06Å; Y1626-T1630 PolarHBondContact O-OG1 3.32Å; T1627-T1630 PolarHBondContact O-N 3.16Å; T1627-T1630 PolarHBondContact O-OG1 3.2Å; I1628-T1630 VanDerWaalsContact C-N 3.34Å; I1628-T1630 PolarHBondContact O-N 2.87Å; T1630-I1632 PolarHBondContact O-N 2.78Å; T1630-K1633 PolarHBondContact O-N 3.09Å; T1630-C1634 PolarHBondContact O-N 2.94Å; T1630-C1634 PolarHBondContact O-SG 3.4Å; T1630-C1634 VanDerWaalsContact O-SG 3.42Å
1631	V	41.8	Very low	41.2	Very low	57 Å²	57	72.8 Å²	72.8	35%	0.345	39%	0.386	S	S	.	.	H	α-helix	trans	-60	-45.7	176.2	179.5	0	0	0	0	111.1	T1627 K1633 C1634 H1635 L1679	T1627-V1631 WeakPolarHBondContact O-CG2 3.12Å; T1627-V1631 PolarHBondContact O-N 2.98Å; V1631-K1633 PolarHBondContact O-N 3.41Å; V1631-C1634 WeakPolarHBondContact O-CB 3.35Å; V1631-C1634 PolarHBondContact O-N 3.03Å; V1631-C1634 VanDerWaalsContact O-N 3.14Å; V1631-H1635 PolarHBondContact O-N 3.22Å; V1631-L1679 HydrophobicContact CG1-CD1 3.76Å; V1631-L1679 HydrophobicContact CG1-CD2 4.09Å; V1631-L1679 HydrophobicContact CG1-CG 4.41Å
1632	I	41	Very low	40.4	Very low	1 Å²	1	79.4 Å²	79.4	1%	0.005	42%	0.415	C	S	.	.	H	α-helix	trans	-60.7	-42.6	176.7	-73.5	173.1	0	0	0	112.2	I1628 T1630 C1634 H1635 I1636 L1675 V1802 I1806 L1809	I1628-I1632 HydrophobicContact CG2-CD1 3.56Å; I1628-I1632 HydrophobicContact CG2-CG1 4.39Å; I1628-I1632 VanDerWaalsContact O-CB 3.29Å; I1628-I1632 WeakPolarHBondContact O-CB 3.38Å; I1628-I1632 VanDerWaalsContact O-CG1 3.24Å; I1628-I1632 WeakPolarHBondContact O-CG1 3.41Å; I1628-I1632 PolarHBondContact O-N 3.38Å; T1630-I1632 PolarHBondContact O-N 2.78Å; I1632-C1634 VanDerWaalsContact C-N 3.27Å; I1632-C1634 PolarHBondContact O-N 3.46Å; I1632-H1635 WeakPolarHBondContact O-CB 3.49Å; I1632-H1635 PolarHBondContact O-N 3.28Å; I1632-H1635 VanDerWaalsContact O-N 3.09Å; I1632-I1636 PolarHBondContact O-N 2.93Å; I1632-L1675 HydrophobicContact CD1-CD2 3.89Å; I1632-L1675 HydrophobicContact CG1-CD2 4.44Å; I1632-V1802 HydrophobicContact CB-CG1 4.32Å; I1632-V1802 HydrophobicContact CG1-CG1 4.28Å; I1632-V1802 HydrophobicContact CG2-CG1 3.4Å; I1632-I1806 HydrophobicContact CB-CG1 4.48Å; I1632-I1806 HydrophobicContact CG2-CD1 3.35Å; I1632-I1806 HydrophobicContact CG2-CG1 3.31Å; I1632-L1809 HydrophobicContact CD1-CD1 4.09Å
1633	K	40.1	Very low	39.8	Very low	121 Å²	121	85.7 Å²	85.7	53%	0.526	44%	0.44	S	S	.	.	H	α-helix	trans	-62.1	-35	175.8	-82.5	168.4	177.2	151.9	0	112.5	N1629 T1630 V1631 H1635 A1637	N1629-K1633 WeakPolarHBondContact O-CB 3.43Å; N1629-K1633 WeakPolarHBondContact O-CD 3.47Å; N1629-K1633 VanDerWaalsContact O-CG 3.25Å; N1629-K1633 WeakPolarHBondContact O-CG 3.35Å; N1629-K1633 PolarHBondContact O-N 3.28Å; N1629-K1633 WeakPolarHBondContact OD1-CE 3.4Å; N1629-K1633 PolarHBondContact OD1-NZ 3.32Å; T1630-K1633 PolarHBondContact O-N 3.09Å; V1631-K1633 PolarHBondContact O-N 3.41Å; K1633-H1635 VanDerWaalsContact C-N 3.34Å; K1633-A1637 WeakPolarHBondContact O-CB 3.24Å; K1633-A1637 PolarHBondContact O-N 3.09Å
1634	C	36.6	Very low	38.9	Very low	77 Å²	77	84.7 Å²	84.7	52%	0.52	43%	0.431	S	S	.	.	H	α-helix	trans	-66.7	-35.4	172.9	-68.9	0	0	0	0	112.1	T1630 V1631 I1632 N1638	T1630-C1634 PolarHBondContact O-N 2.94Å; T1630-C1634 PolarHBondContact O-SG 3.4Å; T1630-C1634 VanDerWaalsContact O-SG 3.42Å; V1631-C1634 WeakPolarHBondContact O-CB 3.35Å; V1631-C1634 PolarHBondContact O-N 3.03Å; V1631-C1634 VanDerWaalsContact O-N 3.14Å; I1632-C1634 VanDerWaalsContact C-N 3.27Å; I1632-C1634 PolarHBondContact O-N 3.46Å; C1634-N1638 PolarHBondContact O-ND2 2.91Å
1635	H	34.4	Very low	38.3	Very low	48 Å²	48	83 Å²	83	22%	0.222	43%	0.431	C	S	.	.	H	α-helix	trans	-68.4	-50.3	176.7	-162.9	103.1	0	0	0	112.1	V1631 I1632 K1633 A1637 N1638 L1679	V1631-H1635 PolarHBondContact O-N 3.22Å; I1632-H1635 WeakPolarHBondContact O-CB 3.49Å; I1632-H1635 PolarHBondContact O-N 3.28Å; I1632-H1635 VanDerWaalsContact O-N 3.09Å; K1633-H1635 VanDerWaalsContact C-N 3.34Å; H1635-A1637 PolarHBondContact O-N 2.83Å; H1635-N1638 PolarHBondContact O-N 2.82Å; H1635-N1638 VanDerWaalsContact O-N 3.1Å; H1635-L1679 HydrophobicContact CB-CD2 4.4Å
1636	I	34.9	Very low	37.6	Very low	35 Å²	35	87.4 Å²	87.4	18%	0.179	46%	0.464	C	S	.	.	H	α-helix	trans	-61.5	-31	179.4	-69.1	-169.8	0	0	0	112.4	I1632 N1638 Q1639 V1802 Q1803 I1806	I1632-I1636 PolarHBondContact O-N 2.93Å; I1636-N1638 PolarHBondContact O-N 3.41Å; I1636-Q1639 PolarHBondContact O-N 3.16Å; I1636-V1802 HydrophobicContact CD1-CG1 4.18Å; I1636-V1802 HydrophobicContact CG1-CG1 4.04Å; I1636-Q1803 HydrophobicContact CD1-CB 3.78Å; I1636-Q1803 HydrophobicContact CD1-CG 4.34Å; I1636-I1806 HydrophobicContact CD1-CD1 3.44Å; I1636-I1806 VanDerWaalsContact CD1-CD1 3.44Å
1637	A	39.1	Very low	37	Very low	78 Å²	78	88.7 Å²	88.7	65%	0.645	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-15.4	177.3	0	0	0	0	0	114.3	K1633 H1635	K1633-A1637 WeakPolarHBondContact O-CB 3.24Å; K1633-A1637 PolarHBondContact O-N 3.09Å; H1635-A1637 PolarHBondContact O-N 2.83Å
1638	N	37.9	Very low	36.6	Very low	127 Å²	127	85.8 Å²	85.8	68%	0.679	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.9	-11.7	-178.9	-65.6	-35.1	0	0	0	114.6	C1634 H1635 I1636	C1634-N1638 PolarHBondContact O-ND2 2.91Å; H1635-N1638 PolarHBondContact O-N 2.82Å; H1635-N1638 VanDerWaalsContact O-N 3.1Å; I1636-N1638 PolarHBondContact O-N 3.41Å
1639	Q	33.3	Very low	36.4	Very low	47 Å²	47	86.4 Å²	86.4	22%	0.22	46%	0.463	C	S	.	.			trans	-135.1	114.4	-167.7	-60.5	-165.4	-0.8	0	0	113.5	I1636 N1795 A1799	I1636-Q1639 PolarHBondContact O-N 3.16Å; Q1639-N1795 PolarHBondContact NE2-OD1 3.07Å; Q1639-N1795 VanDerWaalsContact NE2-OD1 3.07Å; Q1639-N1795 VanDerWaalsContact OE1-C 3.26Å; Q1639-N1795 PolarHBondContact OE1-O 2.91Å; Q1639-A1799 HydrophobicContact CB-CB 4.19Å
1640	Q	31.9	Very low	36.3	Very low	174 Å²	174	88.9 Å²	88.9	81%	0.813	49%	0.485	S	S	*	.			trans	-147.8	113.6	172.3	-65.9	-173.5	-11.1	0	0	110.3
1641	N	32.7	Very low	35.8	Very low	127 Å²	127	89 Å²	89	68%	0.679	48%	0.482	S	S	*	.			trans	175.1	147.5	143	-93.6	-13.4	0	0	0	112.7	V1796	N1641-V1796 WeakPolarHBondContact O-CG1 3.41Å; N1641-V1796 VanDerWaalsContact O-CG2 3.23Å; N1641-V1796 WeakPolarHBondContact O-CG2 3.48Å
1642	E	32.4	Very low	35.6	Very low	172 Å²	172	88 Å²	88	80%	0.804	47%	0.474	S	S	*	.			trans	69.2	177.3	163.3	-66.3	178.3	-167.2	0	0	118.9
1643	K	34.9	Very low	35.5	Very low	194 Å²	194	92.5 Å²	92.5	84%	0.843	50%	0.495	S	S	*	.			trans	-113.3	151.9	-150.8	-68.8	-178.3	178.3	177.8	0	114.5
1644	L	28.7	Very low	35.5	Very low	62 Å²	62	89.6 Å²	89.6	33%	0.325	49%	0.493	S	S	.	.			trans	-85.8	158.7	-177.6	-146.3	82.8	0	0	0	113.8	L1648 E1797 L1800	L1644-L1648 HydrophobicContact CD1-CD2 3.99Å; L1644-L1648 HydrophobicContact CD2-CD2 4.16Å; L1644-L1648 HydrophobicContact CG-CD2 4.12Å; L1644-E1797 HydrophobicContact CD1-CB 3.95Å; L1644-E1797 HydrophobicContact CD1-CG 3.72Å; L1644-L1800 HydrophobicContact CB-CD1 4.38Å; L1644-L1800 HydrophobicContact CD1-CD1 3.78Å
1645	S	34.5	Very low	35.4	Very low	60 Å²	60	90.1 Å²	90.1	42%	0.42	49%	0.485	S	S	.	.			trans	-87.5	161.2	171.1	68.4	0	0	0	0	113.4
1646	C	34.3	Very low	35.8	Very low	113 Å²	113	89.2 Å²	89.2	76%	0.764	48%	0.482	S	S	*	.	H	α-helix	trans	-72.5	-41.2	-173.3	-58.5	0	0	0	0	113.8	L1648 S1649 A1650	C1646-L1648 PolarHBondContact O-N 3.49Å; C1646-S1649 WeakPolarHBondContact O-CB 3.05Å; C1646-S1649 PolarHBondContact O-N 3.06Å; C1646-S1649 VanDerWaalsContact O-N 3.15Å; C1646-A1650 PolarHBondContact O-N 3.49Å
1647	E	32.5	Very low	36.1	Very low	167 Å²	167	94.4 Å²	94.4	78%	0.78	50%	0.503	S	S	*	.	H	α-helix	trans	-67.5	-38.6	-174.3	-64.6	165.5	128.6	0	0	111.7	S1649 A1650 M1651	E1647-S1649 VanDerWaalsContact C-N 3.26Å; E1647-S1649 PolarHBondContact O-N 2.95Å; E1647-A1650 PolarHBondContact O-N 2.94Å; E1647-M1651 PolarHBondContact O-N 3.33Å; E1647-M1651 VanDerWaalsContact O-N 3.12Å
1648	L	36.7	Very low	35.9	Very low	20 Å²	20	95.8 Å²	95.8	11%	0.105	50%	0.503	C	S	.	.	H	α-helix	trans	-63.1	-34.4	174.2	-170	70.1	0	0	0	111.6	L1644 C1646 M1651 L1652 L1793 E1797	L1644-L1648 HydrophobicContact CD1-CD2 3.99Å; L1644-L1648 HydrophobicContact CD2-CD2 4.16Å; L1644-L1648 HydrophobicContact CG-CD2 4.12Å; C1646-L1648 PolarHBondContact O-N 3.49Å; L1648-M1651 HydrophobicContact CD1-CE 3.71Å; L1648-L1652 HydrophobicContact CG-CD1 4.11Å; L1648-L1652 WeakPolarHBondContact O-CB 3.3Å; L1648-L1652 VanDerWaalsContact O-CG 3.27Å; L1648-L1652 WeakPolarHBondContact O-CG 3.42Å; L1648-L1652 PolarHBondContact O-N 2.64Å; L1648-L1793 HydrophobicContact CD1-CD2 3.75Å; L1648-L1793 HydrophobicContact CD2-CD2 4.01Å; L1648-E1797 HydrophobicContact CD2-CB 4.09Å; L1648-E1797 HydrophobicContact CD2-CG 4.26Å; L1648-E1797 WeakPolarHBondContact CD2-OE1 3.23Å
1649	S	40.1	Very low	35.7	Very low	44 Å²	44	92 Å²	92	31%	0.308	48%	0.482	S	S	.	.	H	α-helix	trans	-64.7	-44.1	175.8	-167.4	0	0	0	0	112	C1646 E1647 L1652 E1653	C1646-S1649 WeakPolarHBondContact O-CB 3.05Å; C1646-S1649 PolarHBondContact O-N 3.06Å; C1646-S1649 VanDerWaalsContact O-N 3.15Å; E1647-S1649 VanDerWaalsContact C-N 3.26Å; E1647-S1649 PolarHBondContact O-N 2.95Å; S1649-L1652 PolarHBondContact O-N 3.03Å; S1649-E1653 WeakPolarHBondContact O-CG 3.39Å; S1649-E1653 PolarHBondContact O-N 3.09Å
1650	A	40.7	Very low	35.9	Very low	65 Å²	65	95.2 Å²	95.2	54%	0.537	50%	0.498	S	S	.	.	H	α-helix	trans	-64.6	-41.3	178.4	0	0	0	0	0	112.1	C1646 E1647 E1653 A1654	C1646-A1650 PolarHBondContact O-N 3.49Å; E1647-A1650 PolarHBondContact O-N 2.94Å; A1650-E1653 PolarHBondContact O-N 2.91Å; A1650-A1654 PolarHBondContact O-N 3.37Å; A1650-A1654 VanDerWaalsContact O-N 3.08Å
1651	M	34.5	Very low	36.1	Very low	81 Å²	81	92 Å²	92	40%	0.399	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-39.1	175.8	-169.8	-176.5	75.9	0	0	112.2	E1647 L1648 E1653 A1654 Y1655 L1789	E1647-M1651 PolarHBondContact O-N 3.33Å; E1647-M1651 VanDerWaalsContact O-N 3.12Å; L1648-M1651 HydrophobicContact CD1-CE 3.71Å; M1651-E1653 VanDerWaalsContact C-N 3.34Å; M1651-A1654 PolarHBondContact O-N 3.34Å; M1651-Y1655 PolarHBondContact O-N 3.07Å; M1651-L1789 HydrophobicContact CE-CD2 3.7Å; M1651-L1789 HydrophobicContact CE-CG 4.49Å; M1651-L1789 HydrophobicContact SD-CD2 4.13Å
1652	L	36.9	Very low	36.1	Very low	35 Å²	35	90.6 Å²	90.6	18%	0.183	49%	0.486	C	S	.	.	H	α-helix	trans	-66.5	-33.1	174.6	-76.3	170	0	0	0	112.7	L1648 S1649 Y1655 L1656 I1801	L1648-L1652 HydrophobicContact CG-CD1 4.11Å; L1648-L1652 WeakPolarHBondContact O-CB 3.3Å; L1648-L1652 VanDerWaalsContact O-CG 3.27Å; L1648-L1652 WeakPolarHBondContact O-CG 3.42Å; L1648-L1652 PolarHBondContact O-N 2.64Å; S1649-L1652 PolarHBondContact O-N 3.03Å; L1652-Y1655 PolarHBondContact O-N 3.05Å; L1652-L1656 WeakPolarHBondContact O-CB 3.36Å; L1652-L1656 VanDerWaalsContact O-CG 3.26Å; L1652-L1656 WeakPolarHBondContact O-CG 3.42Å; L1652-L1656 PolarHBondContact O-N 3.47Å; L1652-I1801 HydrophobicContact CD1-CD1 4.34Å; L1652-I1801 HydrophobicContact CD1-CG1 3.89Å; L1652-I1801 HydrophobicContact CD2-CD1 4.02Å; L1652-I1801 HydrophobicContact CD2-CG1 3.82Å
1653	E	39.4	Very low	36.6	Very low	96 Å²	96	86.2 Å²	86.2	45%	0.449	47%	0.474	S	S	.	.	H	α-helix	trans	-72.1	-35.2	174	-70.8	-165	155.3	0	0	113.1	S1649 A1650 M1651 Y1655 K1657 R1804	S1649-E1653 WeakPolarHBondContact O-CG 3.39Å; S1649-E1653 PolarHBondContact O-N 3.09Å; A1650-E1653 PolarHBondContact O-N 2.91Å; M1651-E1653 VanDerWaalsContact C-N 3.34Å; E1653-Y1655 VanDerWaalsContact C-N 3.33Å; E1653-K1657 PolarHBondContact O-N 2.88Å; E1653-R1804 IonicContact OE1-NH2 3.81Å; E1653-R1804 PolarHBondContact OE1-NH2 2.79Å; E1653-R1804 VanDerWaalsContact OE1-NH2 3.08Å
1654	A	39.1	Very low	36.9	Very low	59 Å²	59	80 Å²	80	49%	0.488	45%	0.452	S	S	.	.	H	α-helix	trans	-62.2	-41.4	169.3	0	0	0	0	0	111.8	A1650 M1651 K1657 V1658	A1650-A1654 PolarHBondContact O-N 3.37Å; A1650-A1654 VanDerWaalsContact O-N 3.08Å; M1651-A1654 PolarHBondContact O-N 3.34Å; A1654-K1657 PolarHBondContact O-N 2.81Å; A1654-V1658 PolarHBondContact O-N 2.98Å
1655	Y	35.6	Very low	37.5	Very low	89 Å²	89	85 Å²	85	35%	0.349	47%	0.467	S	S	.	.	H	α-helix	trans	-68.5	-40.8	177.7	-164.1	-105.2	0	0	0	112.8	M1651 L1652 E1653 V1658 L1659 W1786	M1651-Y1655 PolarHBondContact O-N 3.07Å; L1652-Y1655 PolarHBondContact O-N 3.05Å; E1653-Y1655 VanDerWaalsContact C-N 3.33Å; Y1655-V1658 PolarHBondContact O-N 3.34Å; Y1655-L1659 HydrophobicContact CD1-CD1 3.83Å; Y1655-L1659 HydrophobicContact CD1-CG 4.46Å; Y1655-L1659 HydrophobicContact CE1-CD1 3.76Å; Y1655-L1659 HydrophobicContact CE1-CG 4.36Å; Y1655-L1659 PolarHBondContact O-N 3.41Å; Y1655-L1659 VanDerWaalsContact O-N 3.12Å; Y1655-W1786 AromaticContact CD2-CH2 3.64Å; Y1655-W1786 HydrophobicContact CD2-CH2 3.64Å; Y1655-W1786 HydrophobicContact CD2-CZ2 4.38Å; Y1655-W1786 HydrophobicContact CD2-CZ3 4.21Å; Y1655-W1786 AromaticContact CE2-CH2 3.6Å; Y1655-W1786 HydrophobicContact CE2-CH2 3.6Å; Y1655-W1786 HydrophobicContact CE2-CZ2 4.07Å; Y1655-W1786 HydrophobicContact CE2-CZ3 4.03Å
1656	L	41.8	Very low	37.7	Very low	28 Å²	28	87.9 Å²	87.9	15%	0.147	48%	0.476	C	S	.	.	H	α-helix	trans	-63.3	-39.9	174.5	-74.8	167.1	0	0	0	111.8	L1652 V1658 L1659 E1660 R1804 E1808	L1652-L1656 WeakPolarHBondContact O-CB 3.36Å; L1652-L1656 VanDerWaalsContact O-CG 3.26Å; L1652-L1656 WeakPolarHBondContact O-CG 3.42Å; L1652-L1656 PolarHBondContact O-N 3.47Å; L1656-V1658 VanDerWaalsContact C-N 3.27Å; L1656-V1658 PolarHBondContact O-N 2.86Å; L1656-L1659 HydrophobicContact CD2-CD1 4.46Å; L1656-L1659 CarbonylContact O-C 3.51Å; L1656-L1659 WeakPolarHBondContact O-CA 3.47Å; L1656-L1659 WeakPolarHBondContact O-CB 3.27Å; L1656-L1659 PolarHBondContact O-N 3.18Å; L1656-E1660 WeakPolarHBondContact O-CG 3.44Å; L1656-E1660 PolarHBondContact O-N 2.96Å; L1656-R1804 HydrophobicContact CD1-CG 4.21Å; L1656-R1804 VanDerWaalsContact CD1-NE 3.33Å; L1656-E1808 HydrophobicContact CD2-CG 4.35Å
1657	K	40.5	Very low	38.1	Very low	144 Å²	144	84.8 Å²	84.8	63%	0.626	45%	0.452	S	S	*	.	H	α-helix	trans	-58.5	-35.6	173.6	-84.1	178.5	173.6	174.1	0	113.4	E1653 A1654 C1661	E1653-K1657 PolarHBondContact O-N 2.88Å; A1654-K1657 PolarHBondContact O-N 2.81Å; K1657-C1661 PolarHBondContact O-SG 3.48Å; K1657-C1661 VanDerWaalsContact O-SG 3.39Å
1658	V	35	Very low	38.7	Very low	108 Å²	108	78.5 Å²	78.5	66%	0.655	42%	0.423	S	S	*	.	H	α-helix	trans	-69.6	-40.1	173.6	176.9	0	0	0	0	110.9	A1654 Y1655 L1656 E1660 C1661	A1654-V1658 PolarHBondContact O-N 2.98Å; Y1655-V1658 PolarHBondContact O-N 3.34Å; L1656-V1658 VanDerWaalsContact C-N 3.27Å; L1656-V1658 PolarHBondContact O-N 2.86Å; V1658-E1660 VanDerWaalsContact C-N 3.29Å; V1658-E1660 PolarHBondContact O-N 3.33Å; V1658-C1661 PolarHBondContact O-N 3.04Å
1659	L	34.9	Very low	39.1	Very low	46 Å²	46	80.5 Å²	80.5	24%	0.241	43%	0.434	C	S	.	.	H	α-helix	trans	-68.9	-23	177.1	-70.2	171.3	0	0	0	113.9	Y1655 L1656 R1671	Y1655-L1659 HydrophobicContact CD1-CD1 3.83Å; Y1655-L1659 HydrophobicContact CD1-CG 4.46Å; Y1655-L1659 HydrophobicContact CE1-CD1 3.76Å; Y1655-L1659 HydrophobicContact CE1-CG 4.36Å; Y1655-L1659 PolarHBondContact O-N 3.41Å; Y1655-L1659 VanDerWaalsContact O-N 3.12Å; L1656-L1659 HydrophobicContact CD2-CD1 4.46Å; L1656-L1659 CarbonylContact O-C 3.51Å; L1656-L1659 WeakPolarHBondContact O-CA 3.47Å; L1656-L1659 WeakPolarHBondContact O-CB 3.27Å; L1656-L1659 PolarHBondContact O-N 3.18Å; L1659-R1671 HydrophobicContact CD2-CG 4.34Å; L1659-R1671 PolarHBondContact O-NH2 2.99Å
1660	E	37.3	Very low	39.3	Very low	116 Å²	116	83.1 Å²	83.1	54%	0.542	44%	0.441	S	S	.	.	H	α-helix	trans	-74.3	-23.2	176.9	-78.5	-179.5	147.3	0	0	114	L1656 V1658 D1662	L1656-E1660 WeakPolarHBondContact O-CG 3.44Å; L1656-E1660 PolarHBondContact O-N 2.96Å; V1658-E1660 VanDerWaalsContact C-N 3.29Å; V1658-E1660 PolarHBondContact O-N 3.33Å; E1660-D1662 PolarHBondContact O-N 2.67Å
1661	C	35.1	Very low	39.6	Very low	106 Å²	106	82.6 Å²	82.6	72%	0.716	43%	0.425	S	S	*	.	S	Bend	trans	-71.8	-24.7	-162.4	-82.6	0	0	0	0	116.4	K1657 V1658	K1657-C1661 PolarHBondContact O-SG 3.48Å; K1657-C1661 VanDerWaalsContact O-SG 3.39Å; V1658-C1661 PolarHBondContact O-N 3.04Å
1662	D	32.6	Very low	40.2	Very low	98 Å²	98	80 Å²	80	52%	0.524	42%	0.415	S	S	.	.			trans	-153	151.5	177.4	-133.3	-39.7	0	0	0	114.8	E1660 L1667 R1671	E1660-D1662 PolarHBondContact O-N 2.67Å; D1662-L1667 HydrophobicContact CB-CD1 3.74Å; D1662-R1671 PolarHBondContact O-NH2 3.36Å
1663	S	43.3	Very low	40.6	Very low	79 Å²	79	83.1 Å²	83.1	55%	0.552	43%	0.429	S	S	*	.			trans	-124.9	33.6	-170	66.7	0	0	0	0	114.1
1664	T	40.9	Very low	40.8	Very low	64 Å²	64	82.2 Å²	82.2	39%	0.393	43%	0.426	S	S	.	.			trans	-74.2	157.7	175.2	63.7	0	0	0	0	112.6	I1666 L1667 M1668	T1664-I1666 VanDerWaalsContact C-N 3.28Å; T1664-I1666 PolarHBondContact O-N 3.04Å; T1664-L1667 PolarHBondContact O-N 2.86Å; T1664-M1668 PolarHBondContact O-N 2.83Å
1665	R	41.9	Very low	41.2	Very low	168 Å²	168	80 Å²	80	63%	0.634	41%	0.406	S	S	*	.	H	α-helix	trans	-59.3	-35.7	179.4	179.7	174.7	174	144	1.1	113.1	M1668 D1669	R1665-M1668 WeakPolarHBondContact O-CA 3.41Å; R1665-M1668 WeakPolarHBondContact O-CB 3.45Å; R1665-M1668 PolarHBondContact O-N 2.83Å; R1665-D1669 PolarHBondContact O-N 2.95Å
1666	I	39.4	Very low	41.5	Very low	119 Å²	119	79.3 Å²	79.3	61%	0.61	41%	0.408	S	S	*	.	H	α-helix	trans	-60.4	-49.8	-178.8	-59.1	171.2	0	0	0	110.2	T1664 M1668 D1669 E1670	T1664-I1666 VanDerWaalsContact C-N 3.28Å; T1664-I1666 PolarHBondContact O-N 3.04Å; I1666-M1668 PolarHBondContact O-N 2.79Å; I1666-M1668 VanDerWaalsContact O-N 3.17Å; I1666-D1669 PolarHBondContact O-N 3.13Å; I1666-D1669 VanDerWaalsContact O-N 3.1Å; I1666-E1670 PolarHBondContact O-N 2.86Å; I1666-E1670 VanDerWaalsContact O-N 3.08Å
1667	L	41.2	Very low	41.5	Very low	48 Å²	48	81 Å²	81	25%	0.251	42%	0.415	S	S	.	.	H	α-helix	trans	-65	-18.6	176.4	-62.1	172.2	0	0	0	113	D1662 T1664 E1670 R1671	D1662-L1667 HydrophobicContact CB-CD1 3.74Å; T1664-L1667 PolarHBondContact O-N 2.86Å; L1667-E1670 WeakPolarHBondContact CD2-OE2 3.4Å; L1667-R1671 VanDerWaalsContact CB-NH1 3.27Å; L1667-R1671 VanDerWaalsContact O-CB 3.23Å; L1667-R1671 WeakPolarHBondContact O-CB 3.41Å; L1667-R1671 WeakPolarHBondContact O-CD 3.48Å; L1667-R1671 WeakPolarHBondContact O-CG 3.32Å; L1667-R1671 PolarHBondContact O-N 2.7Å; L1667-R1671 VanDerWaalsContact O-N 3.08Å
1668	M	44.8	Very low	41.7	Very low	36 Å²	36	76 Å²	76	18%	0.177	39%	0.394	C	S	.	.	H	α-helix	trans	-75.1	-39.6	173.8	-115.6	-77.8	132.7	0	0	111.2	T1664 R1665 I1666 S1672 L1809 W1812	T1664-M1668 PolarHBondContact O-N 2.83Å; R1665-M1668 WeakPolarHBondContact O-CA 3.41Å; R1665-M1668 WeakPolarHBondContact O-CB 3.45Å; R1665-M1668 PolarHBondContact O-N 2.83Å; I1666-M1668 PolarHBondContact O-N 2.79Å; I1666-M1668 VanDerWaalsContact O-N 3.17Å; M1668-S1672 PolarHBondContact O-N 2.86Å; M1668-S1672 VanDerWaalsContact O-N 3.1Å; M1668-L1809 HydrophobicContact CE-CD2 4.2Å; M1668-W1812 HydrophobicContact CE-CD2 3.78Å; M1668-W1812 HydrophobicContact CE-CE3 3.74Å; M1668-W1812 HydrophobicContact CE-CG 4.44Å; M1668-W1812 HydrophobicContact CE-CH2 4.04Å; M1668-W1812 HydrophobicContact CE-CZ2 4.09Å; M1668-W1812 HydrophobicContact CE-CZ3 3.86Å; M1668-W1812 HydrophobicContact CG-CH2 3.88Å; M1668-W1812 HydrophobicContact CG-CZ2 3.57Å; M1668-W1812 HydrophobicContact SD-CE3 4.47Å; M1668-W1812 HydrophobicContact SD-CH2 3.74Å; M1668-W1812 HydrophobicContact SD-CZ2 4.01Å; M1668-W1812 HydrophobicContact SD-CZ3 4Å
1669	D	45.5	Very low	41.8	Very low	61 Å²	61	72.6 Å²	72.6	33%	0.326	37%	0.372	S	S	.	.	H	α-helix	trans	-69.6	-43.6	175	-69.7	-37.1	0	0	0	110.9	K1624 R1665 I1666 S1672 E1673	K1624-D1669 IonicContact NZ-OD1 2.82Å; K1624-D1669 PolarHBondContact NZ-OD1 2.9Å; R1665-D1669 PolarHBondContact O-N 2.95Å; I1666-D1669 PolarHBondContact O-N 3.13Å; I1666-D1669 VanDerWaalsContact O-N 3.1Å; D1669-S1672 WeakPolarHBondContact O-CA 3.48Å; D1669-S1672 WeakPolarHBondContact O-CB 3.43Å; D1669-S1672 PolarHBondContact O-N 2.81Å; D1669-S1672 PolarHBondContact O-OG 2.89Å; D1669-E1673 PolarHBondContact O-N 2.97Å
1670	E	44.5	Very low	42.1	Very low	100 Å²	100	73.3 Å²	73.3	47%	0.467	37%	0.374	S	S	.	.	H	α-helix	trans	-58	-48.6	172	-69.3	178.4	-173.5	0	0	112.9	I1666 L1667 S1672 E1673 I1674	I1666-E1670 PolarHBondContact O-N 2.86Å; I1666-E1670 VanDerWaalsContact O-N 3.08Å; L1667-E1670 WeakPolarHBondContact CD2-OE2 3.4Å; E1670-S1672 PolarHBondContact O-N 3.02Å; E1670-E1673 PolarHBondContact O-N 3.13Å; E1670-I1674 WeakPolarHBondContact O-CG1 3.33Å; E1670-I1674 PolarHBondContact O-N 2.68Å
1671	R	47.5	Very low	42.1	Very low	53 Å²	53	71.8 Å²	71.8	20%	0.2	37%	0.374	C	S	.	.	H	α-helix	trans	-59	-28.5	175.2	-75.4	167	-174.2	128.3	-8.7	112	L1659 D1662 L1667 L1675	L1659-R1671 HydrophobicContact CD2-CG 4.34Å; L1659-R1671 PolarHBondContact O-NH2 2.99Å; D1662-R1671 PolarHBondContact O-NH2 3.36Å; L1667-R1671 VanDerWaalsContact CB-NH1 3.27Å; L1667-R1671 VanDerWaalsContact O-CB 3.23Å; L1667-R1671 WeakPolarHBondContact O-CB 3.41Å; L1667-R1671 WeakPolarHBondContact O-CD 3.48Å; L1667-R1671 WeakPolarHBondContact O-CG 3.32Å; L1667-R1671 PolarHBondContact O-N 2.7Å; L1667-R1671 VanDerWaalsContact O-N 3.08Å; R1671-L1675 WeakPolarHBondContact O-CB 3.37Å; R1671-L1675 PolarHBondContact O-N 3.47Å
1672	S	46.3	Very low	42.1	Very low	27 Å²	27	69.3 Å²	69.3	19%	0.189	36%	0.358	C	S	.	.	H	α-helix	trans	-77.8	-43.1	175	76.1	0	0	0	0	113.1	M1668 D1669 E1670 I1674 L1675 D1676	M1668-S1672 PolarHBondContact O-N 2.86Å; M1668-S1672 VanDerWaalsContact O-N 3.1Å; D1669-S1672 WeakPolarHBondContact O-CA 3.48Å; D1669-S1672 WeakPolarHBondContact O-CB 3.43Å; D1669-S1672 PolarHBondContact O-N 2.81Å; D1669-S1672 PolarHBondContact O-OG 2.89Å; E1670-S1672 PolarHBondContact O-N 3.02Å; S1672-I1674 VanDerWaalsContact C-N 3.3Å; S1672-I1674 PolarHBondContact O-N 3.03Å; S1672-L1675 PolarHBondContact O-N 3.37Å; S1672-D1676 WeakPolarHBondContact O-CB 3.29Å; S1672-D1676 PolarHBondContact O-N 3.5Å
1673	E	45.8	Very low	42	Very low	100 Å²	100	69 Å²	69	47%	0.467	36%	0.357	S	S	.	.	H	α-helix	trans	-61.7	-37.4	174.2	-69.1	-169.9	164.4	0	0	111.2	D1669 E1670 F1677 K1693	D1669-E1673 PolarHBondContact O-N 2.97Å; E1670-E1673 PolarHBondContact O-N 3.13Å; E1673-F1677 PolarHBondContact O-N 3.32Å; E1673-K1693 IonicContact OE1-NZ 3.25Å; E1673-K1693 PolarHBondContact OE1-NZ 3.43Å; E1673-K1693 IonicContact OE2-NZ 2.99Å; E1673-K1693 PolarHBondContact OE2-NZ 3.14Å
1674	I	44.4	Very low	41.4	Very low	78 Å²	78	70.4 Å²	70.4	40%	0.4	37%	0.367	S	S	.	.	H	α-helix	trans	-65.3	-43.3	174.6	-67.4	166.1	0	0	0	112.2	E1670 S1672 F1677 I1678	E1670-I1674 WeakPolarHBondContact O-CG1 3.33Å; E1670-I1674 PolarHBondContact O-N 2.68Å; S1672-I1674 VanDerWaalsContact C-N 3.3Å; S1672-I1674 PolarHBondContact O-N 3.03Å; I1674-F1677 PolarHBondContact O-N 3.31Å; I1674-I1678 HydrophobicContact CG2-CD1 4.08Å; I1674-I1678 WeakPolarHBondContact O-CG1 3.29Å; I1674-I1678 PolarHBondContact O-N 3.39Å; I1674-I1678 VanDerWaalsContact O-N 3.13Å
1675	L	46.7	Very low	40.8	Very low	13 Å²	13	72.1 Å²	72.1	7%	0.068	38%	0.38	C	S	.	.	H	α-helix	trans	-66.9	-41	178.3	-100.3	163.7	0	0	0	111.9	I1628 I1632 R1671 S1672 F1677 I1678 L1679 L1805 L1809	I1628-L1675 HydrophobicContact CG2-CD1 3.97Å; I1632-L1675 HydrophobicContact CD1-CD2 3.89Å; I1632-L1675 HydrophobicContact CG1-CD2 4.44Å; R1671-L1675 WeakPolarHBondContact O-CB 3.37Å; R1671-L1675 PolarHBondContact O-N 3.47Å; S1672-L1675 PolarHBondContact O-N 3.37Å; L1675-F1677 VanDerWaalsContact C-N 3.34Å; L1675-F1677 PolarHBondContact O-N 2.92Å; L1675-I1678 PolarHBondContact O-N 2.88Å; L1675-L1679 WeakPolarHBondContact O-CD1 3.27Å; L1675-L1679 VanDerWaalsContact O-CG 3.29Å; L1675-L1679 WeakPolarHBondContact O-CG 3.4Å; L1675-L1679 PolarHBondContact O-N 2.86Å; L1675-L1679 VanDerWaalsContact O-N 3.12Å; L1675-L1805 HydrophobicContact CD2-CD1 4.19Å; L1675-L1809 HydrophobicContact CD1-CD1 4.12Å
1676	D	41.5	Very low	40.2	Very low	73 Å²	73	67 Å²	67	39%	0.39	36%	0.363	S	S	.	.	H	α-helix	trans	-61	-43.3	176.6	-155.5	57.3	0	0	0	110.8	S1672 I1678 L1679 H1680	S1672-D1676 WeakPolarHBondContact O-CB 3.29Å; S1672-D1676 PolarHBondContact O-N 3.5Å; D1676-I1678 PolarHBondContact O-N 3.32Å; D1676-L1679 PolarHBondContact O-N 3.34Å; D1676-L1679 VanDerWaalsContact O-N 3.16Å; D1676-H1680 WeakPolarHBondContact O-CB 3.33Å; D1676-H1680 PolarHBondContact O-CD2 2.83Å; D1676-H1680 PolarHBondContact O-N 2.92Å; D1676-H1680 IonicContact OD1-CD2 2.64Å
1677	F	43.3	Very low	39.6	Very low	64 Å²	64	70.8 Å²	70.8	28%	0.281	37%	0.37	S	S	.	.	H	α-helix	trans	-62.5	-40.1	174.7	-177.5	-93.2	0	0	0	113.7	E1673 I1674 L1675 L1679 H1680 P1681 F1787	E1673-F1677 PolarHBondContact O-N 3.32Å; I1674-F1677 PolarHBondContact O-N 3.31Å; L1675-F1677 VanDerWaalsContact C-N 3.34Å; L1675-F1677 PolarHBondContact O-N 2.92Å; F1677-L1679 PolarHBondContact O-N 2.89Å; F1677-H1680 CarbonylContact O-C 3.51Å; F1677-H1680 PolarHBondContact O-N 3.19Å; F1677-P1681 WeakPolarHBondContact O-CA 3.4Å; F1677-F1787 HydrophobicContact CD1-CE1 4.28Å; F1677-F1787 AromaticContact CE1-CD1 3.8Å; F1677-F1787 HydrophobicContact CE1-CD1 3.8Å; F1677-F1787 AromaticContact CE1-CE1 3.6Å; F1677-F1787 HydrophobicContact CE1-CE1 3.6Å; F1677-F1787 AromaticContact CE2-CE1 3.99Å; F1677-F1787 HydrophobicContact CE2-CE1 3.99Å; F1677-F1787 AromaticContact CZ-CD1 3.72Å; F1677-F1787 HydrophobicContact CZ-CD1 3.72Å; F1677-F1787 AromaticContact CZ-CE1 3.44Å; F1677-F1787 HydrophobicContact CZ-CE1 3.44Å; F1677-F1787 VanDerWaalsContact CZ-CE1 3.44Å
1678	I	42.8	Very low	39	Very low	39 Å²	39	75 Å²	75	20%	0.2	39%	0.388	C	S	.	.	H	α-helix	trans	-62.9	-33.3	175.8	-70.6	165.4	0	0	0	111.1	I1674 L1675 D1676 V1802	I1674-I1678 HydrophobicContact CG2-CD1 4.08Å; I1674-I1678 WeakPolarHBondContact O-CG1 3.29Å; I1674-I1678 PolarHBondContact O-N 3.39Å; I1674-I1678 VanDerWaalsContact O-N 3.13Å; L1675-I1678 PolarHBondContact O-N 2.88Å; D1676-I1678 PolarHBondContact O-N 3.32Å; I1678-V1802 HydrophobicContact CG2-CG2 4.49Å
1679	L	38.8	Very low	38.1	Very low	36 Å²	36	82.4 Å²	82.4	19%	0.188	41%	0.414	C	S	.	.	H	α-helix	trans	-84.4	-29.2	-179.2	-66.9	164.1	0	0	0	112.7	V1631 H1635 L1675 D1676 F1677 P1681	V1631-L1679 HydrophobicContact CG1-CD1 3.76Å; V1631-L1679 HydrophobicContact CG1-CD2 4.09Å; V1631-L1679 HydrophobicContact CG1-CG 4.41Å; H1635-L1679 HydrophobicContact CB-CD2 4.4Å; L1675-L1679 WeakPolarHBondContact O-CD1 3.27Å; L1675-L1679 VanDerWaalsContact O-CG 3.29Å; L1675-L1679 WeakPolarHBondContact O-CG 3.4Å; L1675-L1679 PolarHBondContact O-N 2.86Å; L1675-L1679 VanDerWaalsContact O-N 3.12Å; D1676-L1679 PolarHBondContact O-N 3.34Å; D1676-L1679 VanDerWaalsContact O-N 3.16Å; F1677-L1679 PolarHBondContact O-N 2.89Å; L1679-P1681 WeakPolarHBondContact O-CD 3.45Å
1680	H	40.1	Very low	37.3	Very low	61 Å²	61	85.2 Å²	85.2	28%	0.282	43%	0.429	S	S	.	.			trans	-122.8	51	-176.8	-62.5	-94.1	0	0	0	114	D1676 F1677 S1682 D1683	D1676-H1680 WeakPolarHBondContact O-CB 3.33Å; D1676-H1680 PolarHBondContact O-CD2 2.83Å; D1676-H1680 PolarHBondContact O-N 2.92Å; D1676-H1680 IonicContact OD1-CD2 2.64Å; F1677-H1680 CarbonylContact O-C 3.51Å; F1677-H1680 PolarHBondContact O-N 3.19Å; H1680-S1682 PolarHBondContact O-N 3.3Å; H1680-D1683 PolarHBondContact O-N 3.5Å
1681	P	38.6	Very low	36.5	Very low	84 Å²	84	84.3 Å²	84.3	55%	0.545	43%	0.434	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	7.4	-170	31.8	-39.6	0	0	0	115.3	F1677 L1679	F1677-P1681 WeakPolarHBondContact O-CA 3.4Å; L1679-P1681 WeakPolarHBondContact O-CD 3.45Å
1682	S	33.4	Very low	35.3	Very low	54 Å²	54	87.6 Å²	87.6	38%	0.378	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-2	-173.3	69.9	0	0	0	0	114.6	N1184 H1680 S1684	N1184-S1682 WeakPolarHBondContact ND2-CB 3.33Å; N1184-S1682 PolarHBondContact ND2-OG 3.32Å; N1184-S1682 VanDerWaalsContact ND2-OG 3.08Å; N1184-S1682 PolarHBondContact OD1-OG 3.09Å; H1680-S1682 PolarHBondContact O-N 3.3Å; S1682-S1684 PolarHBondContact O-N 2.88Å
1683	D	31.7	Very low	34.3	Very low	93 Å²	93	91.7 Å²	91.7	50%	0.497	47%	0.47	S	S	.	.			trans	-81.3	97.5	176.5	-86.8	-10.9	0	0	0	112	H1680 C1685 Q1686	H1680-D1683 PolarHBondContact O-N 3.5Å; D1683-C1685 PolarHBondContact O-N 3.3Å; D1683-C1685 VanDerWaalsContact O-N 3.07Å; D1683-Q1686 PolarHBondContact O-N 2.9Å
1684	S	30.9	Very low	33.2	Very low	108 Å²	108	95.8 Å²	95.8	76%	0.755	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-28.5	179.1	-58.3	0	0	0	0	113.4	S1682 Q1686	S1682-S1684 PolarHBondContact O-N 2.88Å; S1684-Q1686 VanDerWaalsContact C-N 3.3Å; S1684-Q1686 PolarHBondContact O-N 3.39Å
1685	C	27.6	Very low	32.2	Very low	100 Å²	100	102.2 Å²	102.2	68%	0.676	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-19.6	-174.9	-163.4	0	0	0	0	114.2	D1683 R1687	D1683-C1685 PolarHBondContact O-N 3.3Å; D1683-C1685 VanDerWaalsContact O-N 3.07Å; C1685-R1687 PolarHBondContact O-N 2.84Å
1686	Q	30.1	Very low	30.9	Very low	59 Å²	59	108.8 Å²	108.8	28%	0.276	54%	0.543	S	S	.	.	H	α-helix	trans	-76.3	-20.4	-179	-65.7	-152.5	12.8	0	0	114	D1683 S1684 E1688 R1689 L1690	D1683-Q1686 PolarHBondContact O-N 2.9Å; S1684-Q1686 VanDerWaalsContact C-N 3.3Å; S1684-Q1686 PolarHBondContact O-N 3.39Å; Q1686-E1688 PolarHBondContact O-N 2.79Å; Q1686-R1689 WeakPolarHBondContact O-CB 3.24Å; Q1686-R1689 PolarHBondContact O-N 2.95Å; Q1686-L1690 PolarHBondContact O-N 3.16Å
1687	R	26.3	Very low	30	Very low	200 Å²	200	113.6 Å²	113.6	76%	0.755	56%	0.563	S	S	*	*	H	α-helix	trans	-62.3	-41.9	-179	-76	-174.9	175.9	178.9	-2.3	113	C1685 R1689 L1690 S1691	C1685-R1687 PolarHBondContact O-N 2.84Å; R1687-R1689 VanDerWaalsContact C-N 3.29Å; R1687-R1689 PolarHBondContact O-N 3.03Å; R1687-L1690 PolarHBondContact O-N 3.45Å; R1687-S1691 PolarHBondContact O-N 2.64Å
1688	E	27.7	Very low	29	Very low	135 Å²	135	117.9 Å²	117.9	63%	0.631	59%	0.589	S	S	*	*	H	α-helix	trans	-72.9	-22.9	179	-61.6	179.4	149.8	0	0	112.3	Q1686 L1690 S1691 N1692	Q1686-E1688 PolarHBondContact O-N 2.79Å; E1688-L1690 VanDerWaalsContact C-N 3.31Å; E1688-S1691 WeakPolarHBondContact CA-OG 3.22Å; E1688-S1691 PolarHBondContact O-N 3.18Å; E1688-S1691 PolarHBondContact O-OG 2.96Å; E1688-N1692 WeakPolarHBondContact O-CB 3.35Å; E1688-N1692 PolarHBondContact O-N 3.48Å; E1688-N1692 VanDerWaalsContact O-N 3.12Å
1689	R	27.2	Very low	27.9	Very low	192 Å²	192	123.9 Å²	123.9	73%	0.725	62%	0.62	S	S	*	*	H	α-helix	trans	-71.9	-25.4	174.8	-114.6	-179.3	-176.7	173.9	2.8	113.2	Q1686 R1687	Q1686-R1689 WeakPolarHBondContact O-CB 3.24Å; Q1686-R1689 PolarHBondContact O-N 2.95Å; R1687-R1689 VanDerWaalsContact C-N 3.29Å; R1687-R1689 PolarHBondContact O-N 3.03Å
1690	L	27.6	Very low	27	Very low	120 Å²	120	128 Å²	128	63%	0.628	65%	0.649	S	S	*	*	H	α-helix	trans	-83.5	-25.8	174.3	-75.6	163.1	0	0	0	112.7	Q1686 R1687 E1688	Q1686-L1690 PolarHBondContact O-N 3.16Å; R1687-L1690 PolarHBondContact O-N 3.45Å; E1688-L1690 VanDerWaalsContact C-N 3.31Å
1691	S	27.4	Very low	25.9	Very low	82 Å²	82	130 Å²	130	57%	0.573	68%	0.676	S	S	*	*	H	α-helix	trans	-80.3	-30	173	61.8	0	0	0	0	113.5	R1687 E1688	R1687-S1691 PolarHBondContact O-N 2.64Å; E1688-S1691 WeakPolarHBondContact CA-OG 3.22Å; E1688-S1691 PolarHBondContact O-N 3.18Å; E1688-S1691 PolarHBondContact O-OG 2.96Å
1692	N	24.1	Very low	25	Very low	122 Å²	122	129.4 Å²	129.4	65%	0.652	69%	0.685	S	S	*	*			trans	-104.9	11.4	-166.6	-63.7	5.9	0	0	0	115.2	E1688 Q1694	E1688-N1692 WeakPolarHBondContact O-CB 3.35Å; E1688-N1692 PolarHBondContact O-N 3.48Å; E1688-N1692 VanDerWaalsContact O-N 3.12Å; N1692-Q1694 VanDerWaalsContact C-N 3.27Å; N1692-Q1694 PolarHBondContact O-N 3.46Å
1693	K	25.2	Very low	24.3	Very low	113 Å²	113	133.4 Å²	133.4	49%	0.491	70%	0.7	S	S	.	*			trans	-78.6	73.5	166.6	-80	-178.5	-176	171.3	0	110	E1673 Y1695	E1673-K1693 IonicContact OE1-NZ 3.25Å; E1673-K1693 PolarHBondContact OE1-NZ 3.43Å; E1673-K1693 IonicContact OE2-NZ 2.99Å; E1673-K1693 PolarHBondContact OE2-NZ 3.14Å; K1693-Y1695 PolarHBondContact O-N 3.01Å
1694	Q	22	Very low	23.6	Very low	185 Å²	185	132.6 Å²	132.6	86%	0.864	70%	0.702	S	S	*	*			trans	-65	98.6	164.3	-72.9	-179.5	-72.6	0	0	109.3	N1692	N1692-Q1694 VanDerWaalsContact C-N 3.27Å; N1692-Q1694 PolarHBondContact O-N 3.46Å
1695	Y	22.8	Very low	23.1	Very low	214 Å²	214	135.4 Å²	135.4	84%	0.839	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-91.5	138.8	161.3	-93.8	-90.2	0	0	0	109.5	K1693	K1693-Y1695 PolarHBondContact O-N 3.01Å
1696	I	20.7	Very low	22.6	Very low	150 Å²	150	135.1 Å²	135.1	77%	0.769	70%	0.702	S	S	*	*	P	Polyproline II helix	trans	-79.7	155.5	-162.7	-67.4	170.4	0	0	0	111.6
1697	E	20.8	Very low	22	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-55.3	138.1	178.4	-58.4	143.7	121.3	0	0	112.9
1698	D	24	Very low	21.7	Very low	154 Å²	154	134.2 Å²	134.2	82%	0.824	73%	0.728	S	S	*	*			trans	-167.8	61.8	152.4	-113.5	-23.1	0	0	0	112.3
1699	I	19.2	Very low	21.3	Very low	165 Å²	165	133.3 Å²	133.3	85%	0.846	74%	0.736	S	S	*	*			trans	-133.6	91.7	164.5	-55.9	-178.3	0	0	0	109.4	A1701	I1699-A1701 PolarHBondContact O-N 3.38Å
1700	P	19.7	Very low	20.9	Very low	123 Å²	123	131 Å²	131	80%	0.799	74%	0.738	S	S	*	*			trans	-70.4	121.7	176.3	-19.3	33	0	0	0	111.9
1701	A	17.8	Very low	20.5	Very low	103 Å²	103	131 Å²	131	85%	0.851	74%	0.743	S	S	*	*			trans	-101.4	114.8	172.9	0	0	0	0	0	111.2	I1699	I1699-A1701 PolarHBondContact O-N 3.38Å
1702	G	18.8	Very low	20.2	Very low	71 Å²	71	136.2 Å²	136.2	73%	0.732	76%	0.755	S	S	*	*			trans	102.4	111	158.2	0	0	0	0	0	117.4
1703	I	19.1	Very low	20.7	Very low	138 Å²	138	135.4 Å²	135.4	71%	0.708	76%	0.757	S	S	*	*			trans	-128.4	137.2	141	-66.7	-175.3	0	0	0	108.2	K1948	I1703-K1948 PolarHBondContact O-NZ 3.17Å
1704	S	16.3	Very low	20.4	Very low	75 Å²	75	134.7 Å²	134.7	52%	0.524	76%	0.762	S	S	.	*			trans	-134.1	172.3	170.1	46.2	0	0	0	0	109
1705	H	20	Very low	20.2	Very low	167 Å²	167	133.2 Å²	133.2	77%	0.773	76%	0.755	S	S	*	*			trans	68.5	161.5	179.5	-43	-78.4	0	0	0	113.1
1706	S	18.9	Very low	20.1	Very low	95 Å²	95	128.9 Å²	128.9	66%	0.664	75%	0.746	S	S	*	*			cis	-170.5	163.8	-26	47.4	0	0	0	0	109.2
1707	L	17.4	Very low	20.1	Very low	177 Å²	177	128.4 Å²	128.4	93%	0.927	75%	0.745	S	S	*	*			trans	64.3	156.7	179.4	-94.4	59.6	0	0	0	114.6
1708	G	18.3	Very low	20	Very low	63 Å²	63	124.9 Å²	124.9	65%	0.649	74%	0.739	S	S	*	*			cis	158.5	116.8	-15.9	0	0	0	0	0	115.8
1709	S	19.7	Very low	19.9	Very low	115 Å²	115	124.7 Å²	124.7	80%	0.804	73%	0.734	S	S	*	*			trans	76.1	152.1	154.3	-142.9	0	0	0	0	121
1710	L	18.7	Very low	19.8	Very low	145 Å²	145	122.6 Å²	122.6	76%	0.759	73%	0.731	S	S	*	*			trans	68.1	126.9	160.1	-103.1	70.6	0	0	0	123.2
1711	T	20.2	Very low	19.6	Very low	119 Å²	119	123.3 Å²	123.3	73%	0.73	73%	0.728	S	S	*	*			trans	20.4	153.2	135.1	57.6	0	0	0	0	124.2
1712	K	20.5	Very low	19.5	Very low	191 Å²	191	123.6 Å²	123.6	83%	0.83	72%	0.72	S	S	*	*			trans	-21.3	157.3	143.1	-71.8	-175.7	-179.8	-175.6	0	115.8
1713	P	33.9	Very low	19.5	Very low	106 Å²	106	125.5 Å²	125.5	69%	0.688	72%	0.717	S	S	*	*			cis	-128.5	-157.5	-6.6	32.3	-8	0	0	0	112.3
1714	V	19.4	Very low	19.7	Very low	98 Å²	98	126.5 Å²	126.5	59%	0.594	72%	0.718	S	S	*	*				77.1	155.7	110.6	90.4	0	0	0	0	116.1
1715	E	18.8	Very low	20.2	Very low	154 Å²	154	128.4 Å²	128.4	72%	0.72	72%	0.723	S	S	*	*			trans	62.6	167.6	162.6	-70.1	148.8	-150.5	0	0	115.5
1716	D	20.8	Very low	20.5	Very low	123 Å²	123	126.7 Å²	126.7	66%	0.658	72%	0.715	S	S	*	*			cis	-160.5	179.4	-30.7	-102.3	-2.1	0	0	0	108.9
1717	D	20.1	Very low	20.8	Very low	140 Å²	140	129.3 Å²	129.3	75%	0.749	71%	0.714	S	S	*	*			trans	13.7	152	133.2	-56.6	-6.7	0	0	0	120.2
1718	S	18.8	Very low	20.9	Very low	100 Å²	100	127.8 Å²	127.8	70%	0.699	70%	0.704	S	S	*	*			cis	-170	172.3	-10.3	48.9	0	0	0	0	110.9
1719	E	20.9	Very low	20.9	Very low	150 Å²	150	132.8 Å²	132.8	70%	0.701	71%	0.708	S	S	*	*			trans	-26.5	163.4	166.3	-60.6	165	127.1	0	0	121.1	N1721	E1719-N1721 PolarHBondContact O-N 3.4Å
1720	P	17	Very low	20.9	Very low	122 Å²	122	132.8 Å²	132.8	79%	0.792	70%	0.704	S	S	*	*	S	Bend	trans	-73.2	119.6	152.6	32.6	-30	0	0	0	110.1
1721	N	15.9	Very low	21.2	Very low	137 Å²	137	130.8 Å²	130.8	73%	0.733	70%	0.699	S	S	*	*	S	Bend	trans	65.4	138.3	173.2	-64.6	-31.2	0	0	0	117.3	E1719	E1719-N1721 PolarHBondContact O-N 3.4Å
1722	T	16	Very low	21.1	Very low	110 Å²	110	130.5 Å²	130.5	68%	0.675	69%	0.693	S	S	*	*			trans	62.1	95.5	146.5	50.1	0	0	0	0	116.2
1723	V	18.9	Very low	21.1	Very low	111 Å²	111	128 Å²	128	67%	0.673	68%	0.682	S	S	*	*				73.6	108.8	83.3	165.5	0	0	0	0	109.7
1724	E	22.6	Very low	20.4	Very low	159 Å²	159	130.1 Å²	130.1	74%	0.743	68%	0.683	S	S	*	*			trans	74.3	138.8	155.3	-63.7	173.8	-148.8	0	0	116.4
1725	N	28.1	Very low	20.3	Very low	115 Å²	115	131.5 Å²	131.5	62%	0.615	69%	0.686	S	S	*	*			cis	-160.3	147.2	-1.2	-114.9	-22.5	0	0	0	112.1
1726	E	26.2	Very low	20.2	Very low	130 Å²	130	131.6 Å²	131.6	61%	0.607	69%	0.691	S	S	*	*			trans	57.9	139.4	136.4	-68.5	-168.7	137	0	0	123.8
1727	K	24.1	Very low	20.1	Very low	150 Å²	150	130.2 Å²	130.2	65%	0.652	69%	0.687	S	S	*	*			trans	78.4	102	133.4	-75.7	165.5	-166.4	153.7	0	121.4
1728	M	19.2	Very low	20	Very low	146 Å²	146	128.8 Å²	128.8	72%	0.719	68%	0.683	S	S	*	*				91.4	156.9	102.4	-149.8	173.3	-170.9	0	0	119
1729	F	19.5	Very low	19.9	Very low	168 Å²	168	129.8 Å²	129.8	74%	0.737	68%	0.681	S	S	*	*			trans	74.1	95.2	163.6	-73.9	-57.1	0	0	0	120.7
1730	T	18.8	Very low	19.7	Very low	114 Å²	114	129.7 Å²	129.7	70%	0.699	68%	0.68	S	S	*	*				-40.9	166.2	117.2	56.8	0	0	0	0	113.3
1731	P	25.8	Very low	19.7	Very low	103 Å²	103	131.3 Å²	131.3	67%	0.669	68%	0.675	S	S	*	*			cis	-129.3	-140.6	3.4	32.4	-9.1	0	0	0	109.5
1732	D	18	Very low	19.8	Very low	113 Å²	113	131.7 Å²	131.7	60%	0.604	68%	0.675	S	S	*	*			trans	69.9	150.9	146.7	-81.7	20.5	0	0	0	118.7
1733	K	20.3	Very low	19.9	Very low	138 Å²	138	131.2 Å²	131.2	60%	0.6	68%	0.677	S	S	*	*			cis	-174.9	162.2	-24.5	-121.9	-172.3	-158.3	81.1	0	105.2
1734	Q	18.7	Very low	19.8	Very low	151 Å²	151	129.1 Å²	129.1	71%	0.706	67%	0.666	S	S	*	*			trans	63.9	165.6	143.9	-76.2	173.3	-32.1	0	0	120.2
1735	I	17.5	Very low	19.6	Very low	127 Å²	127	125 Å²	125	65%	0.651	66%	0.66	S	S	*	*			trans	58.4	104.4	147.4	-71.6	158.1	0	0	0	115.2
1736	L	17.4	Very low	19.1	Very low	157 Å²	157	124.8 Å²	124.8	82%	0.822	66%	0.662	S	S	*	*				66.6	164.8	68.1	-160.7	81	0	0	0	111.4
1737	T	17.9	Very low	18.8	Very low	93 Å²	93	124.2 Å²	124.2	57%	0.571	67%	0.668	S	S	*	*			trans	64	94.4	167.4	36.4	0	0	0	0	117.1
1738	T	17.3	Very low	18.5	Very low	110 Å²	110	123 Å²	123	68%	0.675	67%	0.668	S	S	*	*				63.9	171.7	118.2	56.2	0	0	0	0	120.5
1739	D	16.9	Very low	18.5	Very low	122 Å²	122	124.4 Å²	124.4	65%	0.652	67%	0.672	S	S	*	*			trans	79.2	122.8	156.7	-51.6	-48.6	0	0	0	118.8
1740	E	16.6	Very low	18.6	Very low	147 Å²	147	121.6 Å²	121.6	69%	0.687	67%	0.673	S	S	*	*			trans	37	115.6	131.5	-54.2	-178.4	160.8	0	0	118.7
1741	K	17.5	Very low	18.5	Very low	156 Å²	156	127.4 Å²	127.4	68%	0.678	68%	0.682	S	S	*	*				-173.5	166.4	98.8	-100.6	146.3	-152.6	81	0	114.3
1742	I	17.8	Very low	18.2	Very low	145 Å²	145	126.5 Å²	126.5	74%	0.744	68%	0.684	S	S	*	*			trans	53	76.5	156.6	-61.6	153.9	0	0	0	113.1
1743	S	17.7	Very low	18.2	Very low	101 Å²	101	131.9 Å²	131.9	71%	0.706	70%	0.696	S	S	*	*				61.6	122.6	82.5	81.9	0	0	0	0	114.1	A1745	S1743-A1745 PolarHBondContact O-N 2.86Å
1744	C	17.2	Very low	18.2	Very low	66 Å²	66	131.2 Å²	131.2	45%	0.446	70%	0.703	S	S	.	*			trans	-65.3	103.8	162	-75.7	0	0	0	0	109	N476	N476-C1744 HydrophobicContact CB-CB 3.79Å; N476-C1744 PolarHBondContact ND2-O 3.34Å
1745	A	18.8	Very low	18.3	Very low	74 Å²	74	132.1 Å²	132.1	61%	0.612	71%	0.707	S	S	*	*			trans	-71.7	124.5	148.9	0	0	0	0	0	108.4	S1743	S1743-A1745 PolarHBondContact O-N 2.86Å
1746	T	18.2	Very low	18.3	Very low	110 Å²	110	131.3 Å²	131.3	68%	0.675	71%	0.712	S	S	*	*				14.7	-179.1	120.4	-10.4	0	0	0	0	120
1747	T	20.2	Very low	18.5	Very low	118 Å²	118	130 Å²	130	72%	0.724	71%	0.706	S	S	*	*			trans	90.3	90.1	177.4	-37.9	0	0	0	0	111.5
1748	I	18.3	Very low	18.5	Very low	125 Å²	125	129.3 Å²	129.3	64%	0.641	71%	0.705	S	S	*	*				79.3	108.1	68.9	-65.8	165.1	0	0	0	111.4
1749	Q	19.2	Very low	18.6	Very low	175 Å²	175	131.2 Å²	131.2	82%	0.818	71%	0.71	S	S	*	*			trans	62.7	147.4	149.9	-61.1	171.1	-3.2	0	0	119.8
1750	S	20.3	Very low	18.6	Very low	108 Å²	108	129.9 Å²	129.9	76%	0.755	71%	0.71	S	S	*	*	S	Bend	trans	-62.4	-178.3	148.8	51	0	0	0	0	111.3
1751	R	17.2	Very low	18.7	Very low	236 Å²	236	128 Å²	128	89%	0.891	71%	0.713	S	S	*	*			trans	76.9	131.2	166.8	-166	-167.5	-164	142.7	2.5	115.4
1752	A	18.5	Very low	18.7	Very low	85 Å²	85	126.3 Å²	126.3	70%	0.702	72%	0.716	S	S	*	*			trans	69.9	154.2	166.3	0	0	0	0	0	114.7
1753	R	17.9	Very low	18.7	Very low	226 Å²	226	126.7 Å²	126.7	85%	0.853	71%	0.714	S	S	*	*			cis	-158	178.4	2.3	-137.3	165.8	-161.6	166.7	1.1	110.6
1754	T	21.3	Very low	18.7	Very low	124 Å²	124	129 Å²	129	76%	0.761	72%	0.718	S	S	*	*			trans	68	132.4	173.2	69.5	0	0	0	0	115.2
1755	H	20.4	Very low	18.7	Very low	170 Å²	170	129 Å²	129	79%	0.787	73%	0.729	S	S	*	*			cis	55.1	103.9	-2.3	-78.1	-57	0	0	0	119.1
1756	S	18.6	Very low	18.6	Very low	109 Å²	109	130.8 Å²	130.8	76%	0.762	74%	0.738	S	S	*	*				-82.4	148.9	98.9	53.6	0	0	0	0	108.2
1757	N	20.2	Very low	18.7	Very low	130 Å²	130	130.5 Å²	130.5	70%	0.695	74%	0.74	S	S	*	*			cis	-141.1	170.1	31.6	-152.7	0.3	0	0	0	112.2
1758	S	19.1	Very low	18.6	Very low	78 Å²	78	132.3 Å²	132.3	55%	0.545	74%	0.74	S	S	.	*			trans	36.6	133.7	142.7	65	0	0	0	0	122.6
1759	I	18.5	Very low	18.7	Very low	150 Å²	150	132 Å²	132	77%	0.769	74%	0.744	S	S	*	*			trans	68	99.5	130.6	-60.8	170.9	0	0	0	117.6
1760	S	17.4	Very low	18.7	Very low	94 Å²	94	129.2 Å²	129.2	66%	0.657	74%	0.739	S	S	*	*			trans	5.3	133.9	136.5	57.2	0	0	0	0	121.7
1761	S	18.6	Very low	18.6	Very low	108 Å²	108	132.9 Å²	132.9	76%	0.755	75%	0.745	S	S	*	*				89.6	155.6	127.7	80.5	0	0	0	0	122.1
1762	V	17.1	Very low	18.8	Very low	121 Å²	121	130.2 Å²	130.2	73%	0.733	74%	0.742	S	S	*	*			trans	75.9	103.9	155.8	178.3	0	0	0	0	119.5
1763	H	18.6	Very low	18.8	Very low	153 Å²	153	137.2 Å²	137.2	71%	0.708	75%	0.751	S	S	*	*				37.4	134.2	127.4	-75.7	-68.2	0	0	0	124.6
1764	N	17.5	Very low	19	Very low	149 Å²	149	137 Å²	137	80%	0.797	75%	0.751	S	S	*	*			trans	67.6	164.9	130.4	-57	4.7	0	0	0	120.3
1765	G	17	Very low	18.9	Very low	65 Å²	65	137.9 Å²	137.9	67%	0.67	75%	0.751	S	S	*	*			trans	99.3	113.1	-175.6	0	0	0	0	0	111.5
1766	S	17.4	Very low	19.2	Very low	113 Å²	113	135 Å²	135	79%	0.79	75%	0.745	S	S	*	*			cis	65.1	129.2	8	79.8	0	0	0	0	117.5
1767	S	18.8	Very low	19.7	Very low	103 Å²	103	132.8 Å²	132.8	72%	0.72	73%	0.73	S	S	*	*			trans	70	151.6	-171.7	-96.7	0	0	0	0	114.4
1768	E	19	Very low	19.9	Very low	156 Å²	156	133.4 Å²	133.4	73%	0.729	73%	0.728	S	S	*	*			cis	-154.7	179	8.4	-147.1	137.9	-103.9	0	0	113.4
1769	T	21	Very low	20.3	Very low	118 Å²	118	134.5 Å²	134.5	72%	0.724	73%	0.728	S	S	*	*			trans	67	130.6	169.3	62.2	0	0	0	0	117.7
1770	T	18.9	Very low	20.6	Very low	118 Å²	118	134.2 Å²	134.2	72%	0.724	72%	0.724	S	S	*	*			cis	109.4	123.2	11.9	63.4	0	0	0	0	114.8
1771	E	18.7	Very low	21.2	Very low	185 Å²	185	133.5 Å²	133.5	86%	0.864	72%	0.716	S	S	*	*			trans	68.6	137.2	167.7	-57	-177.3	173.8	0	0	115.7
1772	Q	21.3	Very low	21.6	Very low	179 Å²	179	133.6 Å²	133.6	84%	0.836	70%	0.702	S	S	*	*			cis	-132.7	168.5	31.7	-67	175.2	-10.4	0	0	114.3
1773	R	18.1	Very low	22.2	Very low	233 Å²	233	131.2 Å²	131.2	88%	0.879	69%	0.69	S	S	*	*			trans	-97.9	146	178	-64.3	175.9	178.2	154.8	-0.7	112
1774	Y	20.8	Very low	22.8	Very low	221 Å²	221	129.6 Å²	129.6	87%	0.867	68%	0.683	S	S	*	*			trans	-130.8	141.4	150.3	-92.6	-88.5	0	0	0	108.9	V1776	Y1774-V1776 PolarHBondContact O-N 3.34Å
1775	D	20.5	Very low	23.5	Very low	143 Å²	143	127.6 Å²	127.6	77%	0.765	67%	0.672	S	S	*	*			trans	-75.7	122.2	-164.8	-87.7	-58.1	0	0	0	114.6	S1777	D1775-S1777 PolarHBondContact O-N 3.13Å
1776	V	26.3	Very low	24.2	Very low	109 Å²	109	130 Å²	130	66%	0.661	66%	0.661	S	S	*	*			trans	-85.6	3.8	174.5	-179.8	0	0	0	0	112.2	Y1774 Q1778 N1779	Y1774-V1776 PolarHBondContact O-N 3.34Å; V1776-Q1778 PolarHBondContact O-N 3.1Å; V1776-N1779 PolarHBondContact O-N 3.03Å
1777	S	29.3	Very low	25.1	Very low	62 Å²	62	128.6 Å²	128.6	43%	0.434	64%	0.641	S	S	.	*	H	α-helix	trans	-58.3	-21.4	-165.9	59	0	0	0	0	116.2	D1775 T1781	D1775-S1777 PolarHBondContact O-N 3.13Å; S1777-T1781 WeakPolarHBondContact O-CG2 3.04Å; S1777-T1781 PolarHBondContact O-N 3.39Å; S1777-T1781 PolarHBondContact O-OG1 2.79Å; S1777-T1781 VanDerWaalsContact O-OG1 3.05Å
1778	Q	24.3	Very low	26.2	Very low	143 Å²	143	130.1 Å²	130.1	67%	0.668	63%	0.634	S	S	*	*	H	α-helix	trans	-74.8	-26.5	-178.1	-67.4	-161.4	9	0	0	115.2	V1776 T1781 K1782	V1776-Q1778 PolarHBondContact O-N 3.1Å; Q1778-T1781 PolarHBondContact O-OG1 3.09Å; Q1778-K1782 WeakPolarHBondContact O-CG 3.45Å
1779	N	26.8	Very low	27.1	Very low	101 Å²	101	125.7 Å²	125.7	54%	0.54	62%	0.615	S	S	.	*	H	α-helix	trans	-86.9	-36.9	-179	-82	-10.2	0	0	0	112.2	V1776 T1781 K1782 C1783	V1776-N1779 PolarHBondContact O-N 3.03Å; N1779-T1781 VanDerWaalsContact C-N 3.33Å; N1779-T1781 PolarHBondContact O-N 3.04Å; N1779-K1782 PolarHBondContact O-N 2.95Å; N1779-K1782 VanDerWaalsContact O-N 3.16Å; N1779-K1782 PolarHBondContact OD1-NZ 2.68Å; N1779-C1783 PolarHBondContact O-N 3.29Å
1780	E	25.7	Very low	28.2	Very low	144 Å²	144	122.8 Å²	122.8	67%	0.673	60%	0.595	S	S	*	*	H	α-helix	trans	-61	-41.9	173.4	-63	-167.1	134.9	0	0	111.7	K1782 C1783 H1784	E1780-K1782 VanDerWaalsContact C-N 3.28Å; E1780-K1782 PolarHBondContact O-N 3.36Å; E1780-C1783 PolarHBondContact O-N 3.46Å; E1780-H1784 WeakPolarHBondContact O-CB 3.42Å; E1780-H1784 PolarHBondContact O-N 3.43Å
1781	T	29.4	Very low	29.4	Very low	80 Å²	80	121.9 Å²	121.9	49%	0.491	59%	0.593	S	S	.	*	H	α-helix	trans	-61.6	-33.3	175.6	46	0	0	0	0	113.2	S1777 Q1778 N1779 N1785	S1777-T1781 WeakPolarHBondContact O-CG2 3.04Å; S1777-T1781 PolarHBondContact O-N 3.39Å; S1777-T1781 PolarHBondContact O-OG1 2.79Å; S1777-T1781 VanDerWaalsContact O-OG1 3.05Å; Q1778-T1781 PolarHBondContact O-OG1 3.09Å; N1779-T1781 VanDerWaalsContact C-N 3.33Å; N1779-T1781 PolarHBondContact O-N 3.04Å; T1781-N1785 WeakPolarHBondContact O-CB 3.26Å; T1781-N1785 PolarHBondContact O-N 2.99Å; T1781-N1785 VanDerWaalsContact O-N 3.09Å; T1781-N1785 PolarHBondContact O-ND2 3.05Å
1782	K	27.4	Very low	30.7	Very low	109 Å²	109	117.2 Å²	117.2	47%	0.474	58%	0.581	S	S	.	*	H	α-helix	trans	-66.6	-53.6	175.4	-71.9	169.1	-170.9	164.3	0	110.4	Q1778 N1779 E1780 H1784 N1785 W1786	Q1778-K1782 WeakPolarHBondContact O-CG 3.45Å; N1779-K1782 PolarHBondContact O-N 2.95Å; N1779-K1782 VanDerWaalsContact O-N 3.16Å; N1779-K1782 PolarHBondContact OD1-NZ 2.68Å; E1780-K1782 VanDerWaalsContact C-N 3.28Å; E1780-K1782 PolarHBondContact O-N 3.36Å; K1782-H1784 VanDerWaalsContact C-N 3.33Å; K1782-H1784 PolarHBondContact O-N 2.81Å; K1782-N1785 PolarHBondContact O-N 3.34Å; K1782-W1786 PolarHBondContact O-N 2.76Å
1783	C	29	Very low	31.8	Very low	71 Å²	71	110 Å²	110	48%	0.48	55%	0.548	S	S	.	.	H	α-helix	trans	-60.7	-40.4	178.3	-73.2	0	0	0	0	112.5	N1779 E1780 N1785 W1786 F1787	N1779-C1783 PolarHBondContact O-N 3.29Å; E1780-C1783 PolarHBondContact O-N 3.46Å; C1783-N1785 VanDerWaalsContact C-N 3.32Å; C1783-N1785 PolarHBondContact O-N 3.35Å; C1783-W1786 PolarHBondContact O-N 2.96Å; C1783-F1787 HydrophobicContact CB-CE2 4.19Å; C1783-F1787 WeakPolarHBondContact O-CD2 3.42Å; C1783-F1787 PolarHBondContact O-N 3.43Å
1784	H	31.9	Very low	33.4	Very low	120 Å²	120	103.4 Å²	103.4	56%	0.556	53%	0.531	S	S	*	.	H	α-helix	trans	-64.1	-36.8	177.7	-159.5	96.6	0	0	0	112.6	E1780 K1782 K1788	E1780-H1784 WeakPolarHBondContact O-CB 3.42Å; E1780-H1784 PolarHBondContact O-N 3.43Å; K1782-H1784 VanDerWaalsContact C-N 3.33Å; K1782-H1784 PolarHBondContact O-N 2.81Å; H1784-K1788 PolarHBondContact O-N 3.21Å; H1784-K1788 VanDerWaalsContact O-N 3.12Å
1785	N	31.9	Very low	34.7	Very low	106 Å²	106	96 Å²	96	57%	0.567	51%	0.506	S	S	*	.	H	α-helix	trans	-67.1	-41.2	172.4	-73.3	-17.8	0	0	0	112	T1781 K1782 C1783 F1787 K1788 L1789	T1781-N1785 WeakPolarHBondContact O-CB 3.26Å; T1781-N1785 PolarHBondContact O-N 2.99Å; T1781-N1785 VanDerWaalsContact O-N 3.09Å; T1781-N1785 PolarHBondContact O-ND2 3.05Å; K1782-N1785 PolarHBondContact O-N 3.34Å; C1783-N1785 VanDerWaalsContact C-N 3.32Å; C1783-N1785 PolarHBondContact O-N 3.35Å; N1785-F1787 PolarHBondContact O-N 2.92Å; N1785-K1788 PolarHBondContact O-N 3.31Å; N1785-L1789 WeakPolarHBondContact O-CB 3.28Å; N1785-L1789 PolarHBondContact O-N 3.27Å
1786	W	32.8	Very low	35.8	Very low	116 Å²	116	91.3 Å²	91.3	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-60.5	-43	173.6	-73.6	115.4	0	0	0	112.8	Y1655 K1782 C1783 L1789 I1790	Y1655-W1786 AromaticContact CD2-CH2 3.64Å; Y1655-W1786 HydrophobicContact CD2-CH2 3.64Å; Y1655-W1786 HydrophobicContact CD2-CZ2 4.38Å; Y1655-W1786 HydrophobicContact CD2-CZ3 4.21Å; Y1655-W1786 AromaticContact CE2-CH2 3.6Å; Y1655-W1786 HydrophobicContact CE2-CH2 3.6Å; Y1655-W1786 HydrophobicContact CE2-CZ2 4.07Å; Y1655-W1786 HydrophobicContact CE2-CZ3 4.03Å; K1782-W1786 PolarHBondContact O-N 2.76Å; C1783-W1786 PolarHBondContact O-N 2.96Å; W1786-L1789 HydrophobicContact CE3-CD2 3.98Å; W1786-L1789 HydrophobicContact CZ3-CD2 3.95Å; W1786-L1789 WeakPolarHBondContact O-CB 3.48Å; W1786-L1789 PolarHBondContact O-N 3.4Å; W1786-I1790 PolarHBondContact O-N 3.17Å
1787	F	34.9	Very low	36.7	Very low	83 Å²	83	88.1 Å²	88.1	36%	0.364	46%	0.46	S	S	.	.	H	α-helix	trans	-62.8	-42.4	176.6	-70.1	-56.1	0	0	0	112	F1677 C1783 N1785 S1791	F1677-F1787 HydrophobicContact CD1-CE1 4.28Å; F1677-F1787 AromaticContact CE1-CD1 3.8Å; F1677-F1787 HydrophobicContact CE1-CD1 3.8Å; F1677-F1787 AromaticContact CE1-CE1 3.6Å; F1677-F1787 HydrophobicContact CE1-CE1 3.6Å; F1677-F1787 AromaticContact CE2-CE1 3.99Å; F1677-F1787 HydrophobicContact CE2-CE1 3.99Å; F1677-F1787 AromaticContact CZ-CD1 3.72Å; F1677-F1787 HydrophobicContact CZ-CD1 3.72Å; F1677-F1787 AromaticContact CZ-CE1 3.44Å; F1677-F1787 HydrophobicContact CZ-CE1 3.44Å; F1677-F1787 VanDerWaalsContact CZ-CE1 3.44Å; C1783-F1787 HydrophobicContact CB-CE2 4.19Å; C1783-F1787 WeakPolarHBondContact O-CD2 3.42Å; C1783-F1787 PolarHBondContact O-N 3.43Å; N1785-F1787 PolarHBondContact O-N 2.92Å; F1787-S1791 WeakPolarHBondContact O-CB 3.45Å; F1787-S1791 PolarHBondContact O-N 3.15Å; F1787-S1791 VanDerWaalsContact O-N 3.09Å; F1787-S1791 PolarHBondContact O-OG 2.54Å; F1787-S1791 VanDerWaalsContact O-OG 3.07Å
1788	K	42.2	Very low	37.6	Very low	135 Å²	135	87.6 Å²	87.6	59%	0.587	45%	0.451	S	S	*	.	H	α-helix	trans	-57.8	-49.1	170.9	-90.4	-173.8	174	-179.1	0	111.3	H1784 N1785 S1791 S1792	H1784-K1788 PolarHBondContact O-N 3.21Å; H1784-K1788 VanDerWaalsContact O-N 3.12Å; N1785-K1788 PolarHBondContact O-N 3.31Å; K1788-S1791 WeakPolarHBondContact CA-OG 3.29Å; K1788-S1791 PolarHBondContact O-N 3.48Å; K1788-S1791 PolarHBondContact O-OG 3.12Å; K1788-S1792 PolarHBondContact O-N 2.86Å
1789	L	38.5	Very low	38.6	Very low	63 Å²	63	81.5 Å²	81.5	33%	0.33	43%	0.425	S	S	.	.	H	α-helix	trans	-58	-53.7	-177	-156.8	75.6	0	0	0	111.5	M1651 N1785 W1786 S1791 S1792 L1793	M1651-L1789 HydrophobicContact CE-CD2 3.7Å; M1651-L1789 HydrophobicContact CE-CG 4.49Å; M1651-L1789 HydrophobicContact SD-CD2 4.13Å; N1785-L1789 WeakPolarHBondContact O-CB 3.28Å; N1785-L1789 PolarHBondContact O-N 3.27Å; W1786-L1789 HydrophobicContact CE3-CD2 3.98Å; W1786-L1789 HydrophobicContact CZ3-CD2 3.95Å; W1786-L1789 WeakPolarHBondContact O-CB 3.48Å; W1786-L1789 PolarHBondContact O-N 3.4Å; L1789-S1791 VanDerWaalsContact C-N 3.3Å; L1789-S1791 PolarHBondContact O-N 2.91Å; L1789-S1792 PolarHBondContact O-N 2.87Å; L1789-S1792 PolarHBondContact O-OG 3.05Å; L1789-L1793 PolarHBondContact O-N 2.98Å
1790	I	43.8	Very low	39.5	Very low	58 Å²	58	80.6 Å²	80.6	30%	0.297	42%	0.419	S	S	.	.	H	α-helix	trans	-63.4	-37.1	180	-63.4	172.2	0	0	0	111.2	W1786 S1792 L1793	W1786-I1790 PolarHBondContact O-N 3.17Å; I1790-S1792 PolarHBondContact O-N 2.91Å; I1790-L1793 PolarHBondContact O-N 2.89Å
1791	S	44.8	Very low	40.6	Very low	98 Å²	98	75.4 Å²	75.4	69%	0.685	40%	0.396	S	S	*	.	H	α-helix	trans	-70.5	-13	175.3	72	0	0	0	0	114.8	F1787 K1788 L1789	F1787-S1791 WeakPolarHBondContact O-CB 3.45Å; F1787-S1791 PolarHBondContact O-N 3.15Å; F1787-S1791 VanDerWaalsContact O-N 3.09Å; F1787-S1791 PolarHBondContact O-OG 2.54Å; F1787-S1791 VanDerWaalsContact O-OG 3.07Å; K1788-S1791 WeakPolarHBondContact CA-OG 3.29Å; K1788-S1791 PolarHBondContact O-N 3.48Å; K1788-S1791 PolarHBondContact O-OG 3.12Å; L1789-S1791 VanDerWaalsContact C-N 3.3Å; L1789-S1791 PolarHBondContact O-N 2.91Å
1792	S	46	Very low	41.7	Very low	88 Å²	88	71.7 Å²	71.7	62%	0.615	37%	0.373	S	S	*	.	H	α-helix	trans	-93.5	-12.9	174.2	69.3	0	0	0	0	114	K1788 L1789 I1790	K1788-S1792 PolarHBondContact O-N 2.86Å; L1789-S1792 PolarHBondContact O-N 2.87Å; L1789-S1792 PolarHBondContact O-OG 3.05Å; I1790-S1792 PolarHBondContact O-N 2.91Å
1793	L	43.6	Very low	42.5	Very low	27 Å²	27	70 Å²	70	14%	0.141	37%	0.367	C	S	.	.	S	Bend	trans	-74	133.3	177.6	-63.7	176.3	0	0	0	111.2	L1648 L1789 I1790 E1797 Q1798 I1801	L1648-L1793 HydrophobicContact CD1-CD2 3.75Å; L1648-L1793 HydrophobicContact CD2-CD2 4.01Å; L1789-L1793 PolarHBondContact O-N 2.98Å; I1790-L1793 PolarHBondContact O-N 2.89Å; L1793-E1797 WeakPolarHBondContact CA-OE2 3.35Å; L1793-E1797 HydrophobicContact CB-CB 4.43Å; L1793-Q1798 HydrophobicContact CB-CG 4.05Å; L1793-Q1798 PolarHBondContact O-NE2 3.3Å; L1793-I1801 HydrophobicContact CD1-CD1 3.66Å
1794	N	51.3	Low	43.3	Very low	95 Å²	95	71.5 Å²	71.5	51%	0.508	36%	0.362	S	S	.	.			trans	-72.4	154.3	174.3	-169.3	2.8	0	0	0	110.8	V1796 E1797 Q1798	N1794-V1796 VanDerWaalsContact C-N 3.25Å; N1794-V1796 PolarHBondContact O-N 2.76Å; N1794-V1796 VanDerWaalsContact O-N 3.14Å; N1794-E1797 HydrophobicContact CB-CG 4.19Å; N1794-E1797 PolarHBondContact N-OE2 3.17Å; N1794-E1797 WeakPolarHBondContact O-CA 3.45Å; N1794-E1797 WeakPolarHBondContact O-CB 3.21Å; N1794-E1797 PolarHBondContact O-N 2.82Å; N1794-Q1798 PolarHBondContact O-N 2.85Å; N1794-Q1798 VanDerWaalsContact O-N 3.07Å
1795	N	47.7	Very low	44.1	Very low	66 Å²	66	67.5 Å²	67.5	35%	0.353	35%	0.345	S	S	.	.	H	α-helix	trans	-43.5	-48.3	178	-73.7	-75.7	0	0	0	113	Q1639 E1797 Q1798 A1799	Q1639-N1795 PolarHBondContact NE2-OD1 3.07Å; Q1639-N1795 VanDerWaalsContact NE2-OD1 3.07Å; Q1639-N1795 VanDerWaalsContact OE1-C 3.26Å; Q1639-N1795 PolarHBondContact OE1-O 2.91Å; N1795-E1797 VanDerWaalsContact C-N 3.27Å; N1795-E1797 PolarHBondContact O-N 3.07Å; N1795-Q1798 WeakPolarHBondContact O-CB 3.32Å; N1795-Q1798 PolarHBondContact O-N 2.69Å; N1795-A1799 WeakPolarHBondContact O-CB 3.49Å; N1795-A1799 PolarHBondContact O-N 2.92Å
1796	V	45	Very low	44.9	Very low	44 Å²	44	63 Å²	63	27%	0.267	32%	0.321	S	S	.	.	H	α-helix	trans	-59.8	-37	-179.7	-175.1	0	0	0	0	112.4	N1641 N1794 A1799 L1800	N1641-V1796 WeakPolarHBondContact O-CG1 3.41Å; N1641-V1796 VanDerWaalsContact O-CG2 3.23Å; N1641-V1796 WeakPolarHBondContact O-CG2 3.48Å; N1794-V1796 VanDerWaalsContact C-N 3.25Å; N1794-V1796 PolarHBondContact O-N 2.76Å; N1794-V1796 VanDerWaalsContact O-N 3.14Å; V1796-A1799 PolarHBondContact O-N 2.85Å; V1796-L1800 HydrophobicContact CG1-CD1 4.46Å; V1796-L1800 PolarHBondContact O-N 3.17Å
1797	E	44.4	Very low	45.6	Very low	41 Å²	41	60.5 Å²	60.5	19%	0.192	32%	0.316	C	S	.	.	H	α-helix	trans	-73.4	-42.4	179.9	-47	-176.2	118	0	0	110.1	L1644 L1648 L1793 N1794 N1795 A1799 L1800 I1801	L1644-E1797 HydrophobicContact CD1-CB 3.95Å; L1644-E1797 HydrophobicContact CD1-CG 3.72Å; L1648-E1797 HydrophobicContact CD2-CB 4.09Å; L1648-E1797 HydrophobicContact CD2-CG 4.26Å; L1648-E1797 WeakPolarHBondContact CD2-OE1 3.23Å; L1793-E1797 WeakPolarHBondContact CA-OE2 3.35Å; L1793-E1797 HydrophobicContact CB-CB 4.43Å; N1794-E1797 HydrophobicContact CB-CG 4.19Å; N1794-E1797 PolarHBondContact N-OE2 3.17Å; N1794-E1797 WeakPolarHBondContact O-CA 3.45Å; N1794-E1797 WeakPolarHBondContact O-CB 3.21Å; N1794-E1797 PolarHBondContact O-N 2.82Å; N1795-E1797 VanDerWaalsContact C-N 3.27Å; N1795-E1797 PolarHBondContact O-N 3.07Å; E1797-A1799 PolarHBondContact O-N 2.86Å; E1797-L1800 PolarHBondContact O-N 3.03Å; E1797-I1801 VanDerWaalsContact O-CG1 3.28Å; E1797-I1801 WeakPolarHBondContact O-CG1 3.32Å; E1797-I1801 PolarHBondContact O-N 3.17Å
1798	Q	48	Very low	46.2	Very low	52 Å²	52	59.2 Å²	59.2	24%	0.243	31%	0.311	C	S	.	.	H	α-helix	trans	-58.9	-45.4	171.6	-60.4	177.5	5	0	0	111	L1793 N1794 N1795 L1800 I1801 V1802	L1793-Q1798 HydrophobicContact CB-CG 4.05Å; L1793-Q1798 PolarHBondContact O-NE2 3.3Å; N1794-Q1798 PolarHBondContact O-N 2.85Å; N1794-Q1798 VanDerWaalsContact O-N 3.07Å; N1795-Q1798 WeakPolarHBondContact O-CB 3.32Å; N1795-Q1798 PolarHBondContact O-N 2.69Å; Q1798-L1800 VanDerWaalsContact C-N 3.35Å; Q1798-L1800 PolarHBondContact O-N 2.95Å; Q1798-I1801 PolarHBondContact O-N 2.63Å; Q1798-V1802 WeakPolarHBondContact O-CB 3.35Å; Q1798-V1802 VanDerWaalsContact O-CG2 3.25Å; Q1798-V1802 WeakPolarHBondContact O-CG2 3.27Å; Q1798-V1802 PolarHBondContact O-N 3.26Å
1799	A	46.2	Very low	46.5	Very low	14 Å²	14	53.9 Å²	53.9	12%	0.116	29%	0.289	C	S	.	.	H	α-helix	trans	-62.4	-37.1	176.3	0	0	0	0	0	113	Q1639 N1795 V1796 E1797 Q1803	Q1639-A1799 HydrophobicContact CB-CB 4.19Å; N1795-A1799 WeakPolarHBondContact O-CB 3.49Å; N1795-A1799 PolarHBondContact O-N 2.92Å; V1796-A1799 PolarHBondContact O-N 2.85Å; E1797-A1799 PolarHBondContact O-N 2.86Å; A1799-Q1803 VanDerWaalsContact O-CB 3.3Å; A1799-Q1803 WeakPolarHBondContact O-CB 3.44Å; A1799-Q1803 PolarHBondContact O-N 3.12Å
1800	L	45.4	Very low	46.9	Very low	82 Å²	82	54.7 Å²	54.7	43%	0.429	29%	0.29	S	S	.	.	H	α-helix	trans	-69.9	-40.3	174.5	-87.5	163.8	0	0	0	112.7	L1644 V1796 E1797 Q1798 Q1803 R1804	L1644-L1800 HydrophobicContact CB-CD1 4.38Å; L1644-L1800 HydrophobicContact CD1-CD1 3.78Å; V1796-L1800 HydrophobicContact CG1-CD1 4.46Å; V1796-L1800 PolarHBondContact O-N 3.17Å; E1797-L1800 PolarHBondContact O-N 3.03Å; Q1798-L1800 VanDerWaalsContact C-N 3.35Å; Q1798-L1800 PolarHBondContact O-N 2.95Å; L1800-Q1803 PolarHBondContact O-N 2.68Å; L1800-R1804 PolarHBondContact O-N 3.41Å
1801	I	49.1	Very low	47	Very low	35 Å²	35	58.3 Å²	58.3	18%	0.179	30%	0.3	C	S	.	.	H	α-helix	trans	-60.4	-49	172.6	-70.4	164.9	0	0	0	110	L1652 L1793 E1797 Q1798 Q1803 R1804 L1805	L1652-I1801 HydrophobicContact CD1-CD1 4.34Å; L1652-I1801 HydrophobicContact CD1-CG1 3.89Å; L1652-I1801 HydrophobicContact CD2-CD1 4.02Å; L1652-I1801 HydrophobicContact CD2-CG1 3.82Å; L1793-I1801 HydrophobicContact CD1-CD1 3.66Å; E1797-I1801 VanDerWaalsContact O-CG1 3.28Å; E1797-I1801 WeakPolarHBondContact O-CG1 3.32Å; E1797-I1801 PolarHBondContact O-N 3.17Å; Q1798-I1801 PolarHBondContact O-N 2.63Å; I1801-Q1803 VanDerWaalsContact C-N 3.35Å; I1801-Q1803 PolarHBondContact O-N 2.79Å; I1801-R1804 PolarHBondContact O-N 2.73Å; I1801-R1804 VanDerWaalsContact O-N 3.17Å; I1801-L1805 HydrophobicContact CG2-CD1 3.98Å; I1801-L1805 WeakPolarHBondContact O-CG 3.44Å; I1801-L1805 PolarHBondContact O-N 2.87Å
1802	V	51.3	Low	47.3	Very low	2 Å²	2	55.9 Å²	55.9	1%	0.012	28%	0.276	C	S	.	.	H	α-helix	trans	-59.1	-43.4	175.7	169.6	0	0	0	0	111.1	I1632 I1636 I1678 Q1798 R1804 L1805 I1806	I1632-V1802 HydrophobicContact CB-CG1 4.32Å; I1632-V1802 HydrophobicContact CG1-CG1 4.28Å; I1632-V1802 HydrophobicContact CG2-CG1 3.4Å; I1636-V1802 HydrophobicContact CD1-CG1 4.18Å; I1636-V1802 HydrophobicContact CG1-CG1 4.04Å; I1678-V1802 HydrophobicContact CG2-CG2 4.49Å; Q1798-V1802 WeakPolarHBondContact O-CB 3.35Å; Q1798-V1802 VanDerWaalsContact O-CG2 3.25Å; Q1798-V1802 WeakPolarHBondContact O-CG2 3.27Å; Q1798-V1802 PolarHBondContact O-N 3.26Å; V1802-R1804 VanDerWaalsContact C-N 3.35Å; V1802-R1804 PolarHBondContact O-N 3Å; V1802-L1805 PolarHBondContact O-N 3.42Å; V1802-I1806 WeakPolarHBondContact O-CG1 3.28Å; V1802-I1806 PolarHBondContact O-N 3.03Å
1803	Q	44.3	Very low	47.5	Very low	73 Å²	73	53.5 Å²	53.5	34%	0.341	26%	0.255	S	S	.	.	H	α-helix	trans	-65.2	-33.4	176.7	-177.1	54.9	90.8	0	0	113	I1636 A1799 L1800 I1801 N1807	I1636-Q1803 HydrophobicContact CD1-CB 3.78Å; I1636-Q1803 HydrophobicContact CD1-CG 4.34Å; A1799-Q1803 VanDerWaalsContact O-CB 3.3Å; A1799-Q1803 WeakPolarHBondContact O-CB 3.44Å; A1799-Q1803 PolarHBondContact O-N 3.12Å; L1800-Q1803 PolarHBondContact O-N 2.68Å; I1801-Q1803 VanDerWaalsContact C-N 3.35Å; I1801-Q1803 PolarHBondContact O-N 2.79Å; Q1803-N1807 PolarHBondContact O-ND2 3.48Å
1804	R	47.4	Very low	47.6	Very low	103 Å²	103	60.3 Å²	60.3	39%	0.389	28%	0.28	S	S	.	.	H	α-helix	trans	-74.6	-39.2	174.5	-156.9	157.7	177.8	170.9	-7.6	110.9	E1653 L1656 L1800 I1801 V1802 I1806 N1807 E1808	E1653-R1804 IonicContact OE1-NH2 3.81Å; E1653-R1804 PolarHBondContact OE1-NH2 2.79Å; E1653-R1804 VanDerWaalsContact OE1-NH2 3.08Å; L1656-R1804 HydrophobicContact CD1-CG 4.21Å; L1656-R1804 VanDerWaalsContact CD1-NE 3.33Å; L1800-R1804 PolarHBondContact O-N 3.41Å; I1801-R1804 PolarHBondContact O-N 2.73Å; I1801-R1804 VanDerWaalsContact O-N 3.17Å; V1802-R1804 VanDerWaalsContact C-N 3.35Å; V1802-R1804 PolarHBondContact O-N 3Å; R1804-I1806 PolarHBondContact O-N 3.14Å; R1804-N1807 PolarHBondContact O-N 3.15Å; R1804-E1808 PolarHBondContact O-N 3.26Å; R1804-E1808 VanDerWaalsContact O-N 3.16Å
1805	L	48.4	Very low	47.5	Very low	36 Å²	36	64 Å²	64	19%	0.188	29%	0.287	C	S	.	.	H	α-helix	trans	-58.4	-38.9	172.2	-75.2	168.2	0	0	0	113.2	L1675 I1801 V1802 N1807 E1808 L1809	L1675-L1805 HydrophobicContact CD2-CD1 4.19Å; I1801-L1805 HydrophobicContact CG2-CD1 3.98Å; I1801-L1805 WeakPolarHBondContact O-CG 3.44Å; I1801-L1805 PolarHBondContact O-N 2.87Å; V1802-L1805 PolarHBondContact O-N 3.42Å; L1805-N1807 VanDerWaalsContact C-N 3.26Å; L1805-N1807 PolarHBondContact O-N 3.5Å; L1805-E1808 PolarHBondContact O-N 3.01Å; L1805-L1809 WeakPolarHBondContact O-CB 3.26Å; L1805-L1809 WeakPolarHBondContact O-CG 3.22Å; L1805-L1809 PolarHBondContact O-N 2.85Å
1806	I	48.7	Very low	47.8	Very low	13 Å²	13	62.1 Å²	62.1	7%	0.067	28%	0.276	C	S	.	.	H	α-helix	trans	-55.4	-44.1	172.1	-67	168.8	0	0	0	111.4	I1632 I1636 V1802 R1804 L1809 K1810	I1632-I1806 HydrophobicContact CB-CG1 4.48Å; I1632-I1806 HydrophobicContact CG2-CD1 3.35Å; I1632-I1806 HydrophobicContact CG2-CG1 3.31Å; I1636-I1806 HydrophobicContact CD1-CD1 3.44Å; I1636-I1806 VanDerWaalsContact CD1-CD1 3.44Å; V1802-I1806 WeakPolarHBondContact O-CG1 3.28Å; V1802-I1806 PolarHBondContact O-N 3.03Å; R1804-I1806 PolarHBondContact O-N 3.14Å; I1806-L1809 PolarHBondContact O-N 3.08Å; I1806-K1810 HydrophobicContact CG2-CD 4.27Å; I1806-K1810 VanDerWaalsContact CG2-CE 3.5Å; I1806-K1810 WeakPolarHBondContact O-CG 3.18Å; I1806-K1810 PolarHBondContact O-N 3.34Å
1807	N	47.7	Very low	48.1	Very low	62 Å²	62	63 Å²	63	33%	0.332	28%	0.281	S	S	.	.	H	α-helix	trans	-74.3	-33.4	-172.3	-69.4	-24.1	0	0	0	111.3	Q1803 R1804 L1805 K1810 R1811	Q1803-N1807 PolarHBondContact O-ND2 3.48Å; R1804-N1807 PolarHBondContact O-N 3.15Å; L1805-N1807 VanDerWaalsContact C-N 3.26Å; L1805-N1807 PolarHBondContact O-N 3.5Å; N1807-K1810 PolarHBondContact O-N 3.03Å; N1807-K1810 PolarHBondContact OD1-NZ 2.91Å; N1807-R1811 VanDerWaalsContact O-CG 3.32Å; N1807-R1811 WeakPolarHBondContact O-CG 3.5Å; N1807-R1811 PolarHBondContact O-N 2.64Å
1808	E	46.8	Very low	48.3	Very low	57 Å²	57	64.9 Å²	64.9	27%	0.266	30%	0.299	S	S	.	.	H	α-helix	trans	-73.7	-35.1	170.3	-60.2	-46.1	134.4	0	0	113	L1656 R1804 L1805 K1810 R1811 W1812	L1656-E1808 HydrophobicContact CD2-CG 4.35Å; R1804-E1808 PolarHBondContact O-N 3.26Å; R1804-E1808 VanDerWaalsContact O-N 3.16Å; L1805-E1808 PolarHBondContact O-N 3.01Å; E1808-K1810 VanDerWaalsContact C-N 3.33Å; E1808-K1810 PolarHBondContact O-N 3.32Å; E1808-R1811 PolarHBondContact O-N 3.12Å; E1808-R1811 WeakPolarHBondContact OE1-CD 3.27Å; E1808-R1811 IonicContact OE1-CZ 3.27Å; E1808-R1811 IonicContact OE1-NE 3.16Å; E1808-R1811 IonicContact OE1-NH1 2.82Å; E1808-R1811 PolarHBondContact OE1-NH1 3.47Å; E1808-R1811 WeakPolarHBondContact OE2-CD 3.43Å; E1808-R1811 IonicContact OE2-NH1 2.68Å; E1808-R1811 PolarHBondContact OE2-NH1 3.15Å; E1808-W1812 WeakPolarHBondContact O-CB 3.36Å; E1808-W1812 PolarHBondContact O-N 3.44Å
1809	L	48.9	Very low	48.4	Very low	22 Å²	22	65.8 Å²	65.8	12%	0.115	31%	0.305	C	S	.	.	H	α-helix	trans	-59.7	-40.9	169.7	-80.2	166.1	0	0	0	112.2	Y1625 I1628 I1632 M1668 L1675 L1805 I1806 M1813	Y1625-L1809 HydrophobicContact CE2-CB 4.24Å; I1628-L1809 HydrophobicContact CG2-CD1 3.68Å; I1632-L1809 HydrophobicContact CD1-CD1 4.09Å; M1668-L1809 HydrophobicContact CE-CD2 4.2Å; L1675-L1809 HydrophobicContact CD1-CD1 4.12Å; L1805-L1809 WeakPolarHBondContact O-CB 3.26Å; L1805-L1809 WeakPolarHBondContact O-CG 3.22Å; L1805-L1809 PolarHBondContact O-N 2.85Å; I1806-L1809 PolarHBondContact O-N 3.08Å; L1809-M1813 WeakPolarHBondContact O-CB 3.29Å; L1809-M1813 PolarHBondContact O-N 3.11Å
1810	K	46	Very low	48.7	Very low	80 Å²	80	68.1 Å²	68.1	35%	0.348	31%	0.311	S	S	.	.	H	α-helix	trans	-62.6	-46.9	172.1	-70.7	168.4	-171.9	158.7	0	111.6	I1806 N1807 E1808 M1813 Y1814	I1806-K1810 HydrophobicContact CG2-CD 4.27Å; I1806-K1810 VanDerWaalsContact CG2-CE 3.5Å; I1806-K1810 WeakPolarHBondContact O-CG 3.18Å; I1806-K1810 PolarHBondContact O-N 3.34Å; N1807-K1810 PolarHBondContact O-N 3.03Å; N1807-K1810 PolarHBondContact OD1-NZ 2.91Å; E1808-K1810 VanDerWaalsContact C-N 3.33Å; E1808-K1810 PolarHBondContact O-N 3.32Å; K1810-M1813 WeakPolarHBondContact O-CB 3.49Å; K1810-M1813 PolarHBondContact O-N 3.36Å; K1810-Y1814 WeakPolarHBondContact O-CD2 3.46Å; K1810-Y1814 PolarHBondContact O-N 3.24Å
1811	R	47.2	Very low	48.7	Very low	134 Å²	134	67.7 Å²	67.7	51%	0.506	31%	0.309	S	S	.	.	H	α-helix	trans	-62.4	-42	-180	-76.8	166.6	158.1	-159.2	-11	112	N1807 E1808 Y1814 R1815	N1807-R1811 VanDerWaalsContact O-CG 3.32Å; N1807-R1811 WeakPolarHBondContact O-CG 3.5Å; N1807-R1811 PolarHBondContact O-N 2.64Å; E1808-R1811 PolarHBondContact O-N 3.12Å; E1808-R1811 WeakPolarHBondContact OE1-CD 3.27Å; E1808-R1811 IonicContact OE1-CZ 3.27Å; E1808-R1811 IonicContact OE1-NE 3.16Å; E1808-R1811 IonicContact OE1-NH1 2.82Å; E1808-R1811 PolarHBondContact OE1-NH1 3.47Å; E1808-R1811 WeakPolarHBondContact OE2-CD 3.43Å; E1808-R1811 IonicContact OE2-NH1 2.68Å; E1808-R1811 PolarHBondContact OE2-NH1 3.15Å; R1811-Y1814 PolarHBondContact O-N 2.69Å; R1811-R1815 PolarHBondContact O-N 2.97Å; R1811-R1815 VanDerWaalsContact O-N 3.09Å
1812	W	50.7	Low	49.1	Very low	48 Å²	48	71.8 Å²	71.8	18%	0.182	33%	0.326	C	S	.	.	H	α-helix	trans	-62	-43.3	172.6	-177.8	84.7	0	0	0	111.6	V1621 M1668 E1808 Y1814 R1815 F1816	V1621-W1812 HydrophobicContact CG1-CH2 3.51Å; V1621-W1812 HydrophobicContact CG1-CZ3 3.64Å; V1621-W1812 HydrophobicContact CG2-CH2 4.33Å; M1668-W1812 HydrophobicContact CE-CD2 3.78Å; M1668-W1812 HydrophobicContact CE-CE3 3.74Å; M1668-W1812 HydrophobicContact CE-CG 4.44Å; M1668-W1812 HydrophobicContact CE-CH2 4.04Å; M1668-W1812 HydrophobicContact CE-CZ2 4.09Å; M1668-W1812 HydrophobicContact CE-CZ3 3.86Å; M1668-W1812 HydrophobicContact CG-CH2 3.88Å; M1668-W1812 HydrophobicContact CG-CZ2 3.57Å; M1668-W1812 HydrophobicContact SD-CE3 4.47Å; M1668-W1812 HydrophobicContact SD-CH2 3.74Å; M1668-W1812 HydrophobicContact SD-CZ2 4.01Å; M1668-W1812 HydrophobicContact SD-CZ3 4Å; E1808-W1812 WeakPolarHBondContact O-CB 3.36Å; E1808-W1812 PolarHBondContact O-N 3.44Å; W1812-Y1814 PolarHBondContact O-N 2.68Å; W1812-R1815 PolarHBondContact O-N 3.41Å; W1812-R1815 VanDerWaalsContact O-N 3.14Å; W1812-F1816 HydrophobicContact CH2-CB 4.44Å; W1812-F1816 HydrophobicContact CH2-CD2 4.26Å; W1812-F1816 HydrophobicContact CH2-CG 4.39Å; W1812-F1816 HydrophobicContact CZ2-CD2 4.4Å; W1812-F1816 HydrophobicContact CZ3-CB 4.48Å; W1812-F1816 PolarHBondContact O-N 3.16Å
1813	M	49.1	Very low	49.2	Very low	37 Å²	37	76.1 Å²	76.1	18%	0.182	34%	0.342	C	S	.	.	H	α-helix	trans	-60.3	-40.7	174.8	-174.1	-175.1	65.8	0	0	112.5	Y1625 L1809 K1810 R1815 F1816 V1817	Y1625-M1813 HydrophobicContact CD1-SD 3.73Å; Y1625-M1813 HydrophobicContact CE1-CE 4.09Å; Y1625-M1813 HydrophobicContact CE1-SD 3.29Å; Y1625-M1813 WeakPolarHBondContact CE1-SD 3.44Å; Y1625-M1813 HydrophobicContact CE2-CB 4.45Å; Y1625-M1813 HydrophobicContact CE2-SD 4.15Å; Y1625-M1813 HydrophobicContact CG-SD 4.3Å; Y1625-M1813 VanDerWaalsContact CZ-SD 3.51Å; L1809-M1813 WeakPolarHBondContact O-CB 3.29Å; L1809-M1813 PolarHBondContact O-N 3.11Å; K1810-M1813 WeakPolarHBondContact O-CB 3.49Å; K1810-M1813 PolarHBondContact O-N 3.36Å; M1813-R1815 PolarHBondContact O-N 3.34Å; M1813-F1816 PolarHBondContact O-N 2.95Å; M1813-V1817 WeakPolarHBondContact O-CG2 3.29Å; M1813-V1817 PolarHBondContact O-N 3.47Å
1814	Y	47.1	Very low	49.7	Very low	171 Å²	171	76.1 Å²	76.1	67%	0.671	34%	0.341	S	S	*	.	H	α-helix	trans	-62	-40.8	173.7	-77	-68.9	0	0	0	112.3	K1810 R1811 W1812 S1818	K1810-Y1814 WeakPolarHBondContact O-CD2 3.46Å; K1810-Y1814 PolarHBondContact O-N 3.24Å; R1811-Y1814 PolarHBondContact O-N 2.69Å; W1812-Y1814 PolarHBondContact O-N 2.68Å; Y1814-S1818 WeakPolarHBondContact O-CB 3.13Å; Y1814-S1818 PolarHBondContact O-N 3.46Å
1815	R	47.9	Very low	50	Low	171 Å²	171	75.6 Å²	75.6	65%	0.645	35%	0.346	S	S	*	.	H	α-helix	trans	-64.9	-44.2	173.4	-74.3	-169.2	176.4	-168.2	3.3	112.2	R1811 W1812 M1813 V1817 S1818 D1819	R1811-R1815 PolarHBondContact O-N 2.97Å; R1811-R1815 VanDerWaalsContact O-N 3.09Å; W1812-R1815 PolarHBondContact O-N 3.41Å; W1812-R1815 VanDerWaalsContact O-N 3.14Å; M1813-R1815 PolarHBondContact O-N 3.34Å; R1815-V1817 PolarHBondContact O-N 3.05Å; R1815-S1818 WeakPolarHBondContact O-CB 3.46Å; R1815-S1818 PolarHBondContact O-N 2.95Å; R1815-S1818 VanDerWaalsContact O-N 3.16Å; R1815-D1819 PolarHBondContact O-N 3.44Å
1816	F	54.7	Low	50.3	Low	27 Å²	27	79.4 Å²	79.4	12%	0.118	36%	0.363	C	S	.	.	H	α-helix	trans	-59.7	-46.1	177.5	178.1	-97.6	0	0	0	111.9	A1618 V1621 W1812 M1813 S1818 D1819 W1820	A1618-F1816 HydrophobicContact CB-CE1 4.32Å; A1618-F1816 HydrophobicContact CB-CZ 4.36Å; V1621-F1816 HydrophobicContact CB-CE1 4.2Å; V1621-F1816 HydrophobicContact CB-CE2 4.41Å; V1621-F1816 HydrophobicContact CB-CZ 3.99Å; V1621-F1816 HydrophobicContact CG1-CD1 3.92Å; V1621-F1816 HydrophobicContact CG1-CD2 4.31Å; V1621-F1816 HydrophobicContact CG1-CE1 3.78Å; V1621-F1816 HydrophobicContact CG1-CE2 4.18Å; V1621-F1816 HydrophobicContact CG1-CG 4.19Å; V1621-F1816 HydrophobicContact CG1-CZ 3.92Å; V1621-F1816 HydrophobicContact CG2-CE2 4.1Å; V1621-F1816 HydrophobicContact CG2-CZ 4.09Å; W1812-F1816 HydrophobicContact CH2-CB 4.44Å; W1812-F1816 HydrophobicContact CH2-CD2 4.26Å; W1812-F1816 HydrophobicContact CH2-CG 4.39Å; W1812-F1816 HydrophobicContact CZ2-CD2 4.4Å; W1812-F1816 HydrophobicContact CZ3-CB 4.48Å; W1812-F1816 PolarHBondContact O-N 3.16Å; M1813-F1816 PolarHBondContact O-N 2.95Å; F1816-S1818 VanDerWaalsContact C-N 3.3Å; F1816-S1818 PolarHBondContact O-N 3.05Å; F1816-D1819 PolarHBondContact O-N 2.89Å; F1816-W1820 VanDerWaalsContact O-CB 3.27Å; F1816-W1820 WeakPolarHBondContact O-CB 3.46Å; F1816-W1820 PolarHBondContact O-N 2.96Å
1817	V	50.3	Low	50.6	Low	64 Å²	64	81.7 Å²	81.7	39%	0.388	37%	0.371	S	S	.	.	H	α-helix	trans	-63.4	-36.5	175.7	171.6	0	0	0	0	111.4	M1813 R1815 N1821	M1813-V1817 WeakPolarHBondContact O-CG2 3.29Å; M1813-V1817 PolarHBondContact O-N 3.47Å; R1815-V1817 PolarHBondContact O-N 3.05Å; V1817-N1821 VanDerWaalsContact O-CB 3.32Å; V1817-N1821 WeakPolarHBondContact O-CB 3.09Å; V1817-N1821 PolarHBondContact O-N 3.42Å; V1817-N1821 PolarHBondContact O-ND2 3.12Å
1818	S	49.6	Very low	50.6	Low	80 Å²	80	82.3 Å²	82.3	56%	0.559	37%	0.372	S	S	*	.	H	α-helix	trans	-66.1	-44.7	175.2	-167.6	0	0	0	0	112.8	Y1814 R1815 F1816 N1821 F1822	Y1814-S1818 WeakPolarHBondContact O-CB 3.13Å; Y1814-S1818 PolarHBondContact O-N 3.46Å; R1815-S1818 WeakPolarHBondContact O-CB 3.46Å; R1815-S1818 PolarHBondContact O-N 2.95Å; R1815-S1818 VanDerWaalsContact O-N 3.16Å; F1816-S1818 VanDerWaalsContact C-N 3.3Å; F1816-S1818 PolarHBondContact O-N 3.05Å; S1818-N1821 PolarHBondContact O-N 3.07Å; S1818-F1822 PolarHBondContact O-N 2.95Å
1819	D	49.8	Very low	51.1	Low	71 Å²	71	83.5 Å²	83.5	38%	0.38	38%	0.38	S	S	.	.	H	α-helix	trans	-69.5	-39.6	178.4	-166.6	61.1	0	0	0	111.5	R1815 F1816 N1821 F1822 R1823	R1815-D1819 PolarHBondContact O-N 3.44Å; F1816-D1819 PolarHBondContact O-N 2.89Å; D1819-N1821 PolarHBondContact O-N 2.68Å; D1819-F1822 WeakPolarHBondContact O-CB 3.36Å; D1819-F1822 PolarHBondContact O-N 3Å; D1819-F1822 VanDerWaalsContact O-N 3.14Å; D1819-R1823 WeakPolarHBondContact O-CG 3.19Å; D1819-R1823 PolarHBondContact O-N 2.87Å; D1819-R1823 IonicContact OD2-CZ 2.68Å; D1819-R1823 IonicContact OD2-NE 3.36Å; D1819-R1823 PolarHBondContact OD2-NE 3.43Å; D1819-R1823 IonicContact OD2-NH2 3.74Å; D1819-R1823 PolarHBondContact OD2-NH2 3.1Å
1820	W	51.8	Low	51.6	Low	62 Å²	62	86.9 Å²	86.9	24%	0.235	40%	0.397	C	S	.	.	H	α-helix	trans	-61.4	-43.5	173.6	-172.2	92.2	0	0	0	111.9	L1610 L1614 F1816 F1822 R1823 F1824	L1610-W1820 HydrophobicContact CD2-CH2 4.38Å; L1610-W1820 HydrophobicContact CD2-CZ2 3.9Å; L1614-W1820 PolarHBondContact O-NE1 3.4Å; F1816-W1820 VanDerWaalsContact O-CB 3.27Å; F1816-W1820 WeakPolarHBondContact O-CB 3.46Å; F1816-W1820 PolarHBondContact O-N 2.96Å; W1820-F1822 VanDerWaalsContact C-N 3.31Å; W1820-F1822 PolarHBondContact O-N 2.86Å; W1820-R1823 PolarHBondContact O-N 3.1Å; W1820-F1824 HydrophobicContact CE3-CB 4.46Å; W1820-F1824 AromaticContact CH2-CD2 3.77Å; W1820-F1824 HydrophobicContact CH2-CD2 3.77Å; W1820-F1824 HydrophobicContact CH2-CE2 4.36Å; W1820-F1824 HydrophobicContact CH2-CG 4.48Å; W1820-F1824 HydrophobicContact CZ2-CD2 4.35Å; W1820-F1824 HydrophobicContact CZ3-CB 4.34Å; W1820-F1824 HydrophobicContact CZ3-CD2 4.1Å; W1820-F1824 HydrophobicContact CZ3-CG 4.37Å; W1820-F1824 VanDerWaalsContact O-CB 3.3Å; W1820-F1824 WeakPolarHBondContact O-CB 3.41Å; W1820-F1824 PolarHBondContact O-N 2.97Å
1821	N	46.7	Very low	51.7	Low	73 Å²	73	85.9 Å²	85.9	39%	0.39	40%	0.395	S	S	.	.	H	α-helix	trans	-62.2	-36.6	173.4	-76.9	-26	0	0	0	112.1	V1817 S1818 D1819 N1825	V1817-N1821 VanDerWaalsContact O-CB 3.32Å; V1817-N1821 WeakPolarHBondContact O-CB 3.09Å; V1817-N1821 PolarHBondContact O-N 3.42Å; V1817-N1821 PolarHBondContact O-ND2 3.12Å; S1818-N1821 PolarHBondContact O-N 3.07Å; D1819-N1821 PolarHBondContact O-N 2.68Å; N1821-N1825 WeakPolarHBondContact O-CB 3.34Å; N1821-N1825 PolarHBondContact O-N 2.97Å; N1821-N1825 PolarHBondContact O-ND2 2.86Å
1822	F	57.4	Low	52.3	Low	121 Å²	121	83.6 Å²	83.6	53%	0.531	39%	0.389	S	S	.	.	H	α-helix	trans	-65.1	-50.6	174.5	-178.2	-94.5	0	0	0	111.7	S1818 D1819 W1820 F1824 N1825 E1826	S1818-F1822 PolarHBondContact O-N 2.95Å; D1819-F1822 WeakPolarHBondContact O-CB 3.36Å; D1819-F1822 PolarHBondContact O-N 3Å; D1819-F1822 VanDerWaalsContact O-N 3.14Å; W1820-F1822 VanDerWaalsContact C-N 3.31Å; W1820-F1822 PolarHBondContact O-N 2.86Å; F1822-F1824 VanDerWaalsContact C-N 3.3Å; F1822-F1824 PolarHBondContact O-N 3.46Å; F1822-N1825 PolarHBondContact O-N 3.34Å; F1822-N1825 VanDerWaalsContact O-N 3.13Å; F1822-E1826 HydrophobicContact CD1-CG 4.36Å; F1822-E1826 HydrophobicContact CE1-CG 3.84Å; F1822-E1826 HydrophobicContact CZ-CG 4.01Å; F1822-E1826 PolarHBondContact O-N 3.39Å
1823	R	53.4	Low	52.7	Low	94 Å²	94	89 Å²	89	36%	0.355	41%	0.409	S	S	.	.	H	α-helix	trans	-59	-39	175.6	-64.6	-179.4	-160.6	-176.7	6.3	112.3	L1614 E1617 D1819 W1820 E1826 Y1827	L1614-R1823 HydrophobicContact CD2-CB 4.47Å; E1617-R1823 VanDerWaalsContact CD-NH1 3.33Å; E1617-R1823 IonicContact OE1-CZ 2.69Å; E1617-R1823 IonicContact OE1-NH1 2.64Å; E1617-R1823 PolarHBondContact OE1-NH1 3.08Å; E1617-R1823 IonicContact OE2-NH1 2.67Å; E1617-R1823 PolarHBondContact OE2-NH1 3.49Å; E1617-R1823 VanDerWaalsContact OE2-NH1 3.08Å; D1819-R1823 WeakPolarHBondContact O-CG 3.19Å; D1819-R1823 PolarHBondContact O-N 2.87Å; D1819-R1823 IonicContact OD2-CZ 2.68Å; D1819-R1823 IonicContact OD2-NE 3.36Å; D1819-R1823 PolarHBondContact OD2-NE 3.43Å; D1819-R1823 IonicContact OD2-NH2 3.74Å; D1819-R1823 PolarHBondContact OD2-NH2 3.1Å; W1820-R1823 PolarHBondContact O-N 3.1Å; R1823-E1826 PolarHBondContact O-N 3.24Å; R1823-Y1827 PolarHBondContact O-N 3.38Å
1824	F	54.7	Low	52.6	Low	72 Å²	72	91.2 Å²	91.2	32%	0.316	42%	0.421	S	S	.	.	H	α-helix	trans	-61	-46.4	174.5	-178.4	-81.9	0	0	0	111.5	L1610 W1820 F1822 Y1827 E1828	L1610-F1824 HydrophobicContact CD1-CD2 3.53Å; L1610-F1824 HydrophobicContact CD1-CE2 3.77Å; L1610-F1824 HydrophobicContact CD1-CG 4.48Å; L1610-F1824 HydrophobicContact CD2-CD2 4Å; L1610-F1824 HydrophobicContact CD2-CE2 4.12Å; L1610-F1824 HydrophobicContact CG-CD2 4.42Å; L1610-F1824 HydrophobicContact CG-CE2 4.48Å; W1820-F1824 HydrophobicContact CE3-CB 4.46Å; W1820-F1824 AromaticContact CH2-CD2 3.77Å; W1820-F1824 HydrophobicContact CH2-CD2 3.77Å; W1820-F1824 HydrophobicContact CH2-CE2 4.36Å; W1820-F1824 HydrophobicContact CH2-CG 4.48Å; W1820-F1824 HydrophobicContact CZ2-CD2 4.35Å; W1820-F1824 HydrophobicContact CZ3-CB 4.34Å; W1820-F1824 HydrophobicContact CZ3-CD2 4.1Å; W1820-F1824 HydrophobicContact CZ3-CG 4.37Å; W1820-F1824 VanDerWaalsContact O-CB 3.3Å; W1820-F1824 WeakPolarHBondContact O-CB 3.41Å; W1820-F1824 PolarHBondContact O-N 2.97Å; F1822-F1824 VanDerWaalsContact C-N 3.3Å; F1822-F1824 PolarHBondContact O-N 3.46Å; F1824-Y1827 PolarHBondContact O-N 2.92Å; F1824-E1828 PolarHBondContact O-N 3.15Å
1825	N	52.8	Low	52.4	Low	93 Å²	93	86.3 Å²	86.3	50%	0.497	40%	0.404	S	S	.	.	H	α-helix	trans	-65.6	-39.2	178.7	-72.1	-25.5	0	0	0	112.4	N1821 F1822 E1828 L1829	N1821-N1825 WeakPolarHBondContact O-CB 3.34Å; N1821-N1825 PolarHBondContact O-N 2.97Å; N1821-N1825 PolarHBondContact O-ND2 2.86Å; F1822-N1825 PolarHBondContact O-N 3.34Å; F1822-N1825 VanDerWaalsContact O-N 3.13Å; N1825-E1828 PolarHBondContact O-N 3.23Å; N1825-L1829 WeakPolarHBondContact O-CB 3.27Å; N1825-L1829 PolarHBondContact O-N 3.43Å
1826	E	55.6	Low	53.1	Low	116 Å²	116	84.5 Å²	84.5	54%	0.542	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-44.3	172.8	-73.3	-134.5	115.9	0	0	111.9	F1822 R1823 L1829 L1830	F1822-E1826 HydrophobicContact CD1-CG 4.36Å; F1822-E1826 HydrophobicContact CE1-CG 3.84Å; F1822-E1826 HydrophobicContact CZ-CG 4.01Å; F1822-E1826 PolarHBondContact O-N 3.39Å; R1823-E1826 PolarHBondContact O-N 3.24Å; E1826-L1829 PolarHBondContact O-N 2.66Å; E1826-L1830 WeakPolarHBondContact O-CB 3.24Å; E1826-L1830 PolarHBondContact O-N 3.19Å
1827	Y	53.3	Low	53	Low	60 Å²	60	88 Å²	88	24%	0.235	42%	0.421	C	S	.	.	H	α-helix	trans	-62.2	-44.7	175.8	178.3	-99.6	0	0	0	112.1	H1609 L1610 P1611 R1823 F1824 L1829 L1830 M1831	H1609-Y1827 VanDerWaalsContact O-CE1 3.29Å; H1609-Y1827 WeakPolarHBondContact O-CE1 3.36Å; H1609-Y1827 PolarHBondContact O-OH 3.2Å; L1610-Y1827 HydrophobicContact CD1-CD1 3.88Å; L1610-Y1827 HydrophobicContact CD1-CE1 4.36Å; P1611-Y1827 HydrophobicContact CG-CD1 4.44Å; P1611-Y1827 HydrophobicContact CG-CD2 3.61Å; P1611-Y1827 HydrophobicContact CG-CE1 4.23Å; P1611-Y1827 HydrophobicContact CG-CE2 3.36Å; P1611-Y1827 HydrophobicContact CG-CG 4.14Å; R1823-Y1827 PolarHBondContact O-N 3.38Å; F1824-Y1827 PolarHBondContact O-N 2.92Å; Y1827-L1829 VanDerWaalsContact C-N 3.29Å; Y1827-L1829 PolarHBondContact O-N 3.4Å; Y1827-L1830 PolarHBondContact O-N 3.35Å; Y1827-M1831 HydrophobicContact CD1-CG 4.13Å; Y1827-M1831 HydrophobicContact CD2-CG 4.41Å; Y1827-M1831 HydrophobicContact CE1-CG 3.56Å; Y1827-M1831 HydrophobicContact CE1-SD 4.45Å; Y1827-M1831 HydrophobicContact CE2-CG 3.87Å; Y1827-M1831 HydrophobicContact CE2-SD 4.09Å; Y1827-M1831 VanDerWaalsContact CZ-CG 3.43Å; Y1827-M1831 WeakPolarHBondContact O-CG 3.48Å; Y1827-M1831 PolarHBondContact O-N 2.87Å
1828	E	49	Very low	52.5	Low	75 Å²	75	89.5 Å²	89.5	35%	0.35	43%	0.426	S	S	.	.	H	α-helix	trans	-62.7	-37.8	178	-154.7	-138.9	169.7	0	0	111.5	F1824 N1825 K1832	F1824-E1828 PolarHBondContact O-N 3.15Å; N1825-E1828 PolarHBondContact O-N 3.23Å; E1828-K1832 WeakPolarHBondContact O-CD 3.42Å; E1828-K1832 VanDerWaalsContact O-CG 3.26Å; E1828-K1832 WeakPolarHBondContact O-CG 3.31Å; E1828-K1832 PolarHBondContact O-N 3.49Å; E1828-K1832 WeakPolarHBondContact OE1-CE 3.4Å; E1828-K1832 IonicContact OE1-NZ 2.63Å; E1828-K1832 PolarHBondContact OE1-NZ 3.37Å; E1828-K1832 IonicContact OE2-NZ 3.27Å; E1828-K1832 PolarHBondContact OE2-NZ 2.89Å
1829	L	57.7	Low	52.3	Low	83 Å²	83	92.2 Å²	92.2	44%	0.435	42%	0.424	S	S	.	.	H	α-helix	trans	-66.9	-39.8	174	-169.9	70.4	0	0	0	112.3	N1825 E1826 Y1827 K1832 R1833	N1825-L1829 WeakPolarHBondContact O-CB 3.27Å; N1825-L1829 PolarHBondContact O-N 3.43Å; E1826-L1829 PolarHBondContact O-N 2.66Å; Y1827-L1829 VanDerWaalsContact C-N 3.29Å; Y1827-L1829 PolarHBondContact O-N 3.4Å; L1829-K1832 PolarHBondContact O-N 3.06Å; L1829-R1833 WeakPolarHBondContact O-CB 3.43Å; L1829-R1833 PolarHBondContact O-N 3.19Å
1830	L	58.8	Low	52.1	Low	92 Å²	92	91.6 Å²	91.6	48%	0.482	42%	0.421	S	S	.	.	H	α-helix	trans	-65.4	-43.4	176.6	-165.8	159.3	0	0	0	110.8	E1826 Y1827 K1832 R1833 L1834	E1826-L1830 WeakPolarHBondContact O-CB 3.24Å; E1826-L1830 PolarHBondContact O-N 3.19Å; Y1827-L1830 PolarHBondContact O-N 3.35Å; L1830-K1832 PolarHBondContact O-N 2.93Å; L1830-R1833 CarbonylContact O-C 3.57Å; L1830-R1833 WeakPolarHBondContact O-CA 3.27Å; L1830-R1833 WeakPolarHBondContact O-CB 3.41Å; L1830-R1833 PolarHBondContact O-N 3.14Å; L1830-R1833 VanDerWaalsContact O-N 3.09Å; L1830-L1834 HydrophobicContact CD2-CD1 3.65Å; L1830-L1834 HydrophobicContact CD2-CG 4.12Å; L1830-L1834 PolarHBondContact O-N 3.06Å
1831	M	48.7	Very low	51.5	Low	59 Å²	59	97.2 Å²	97.2	29%	0.291	45%	0.447	S	S	.	.	H	α-helix	trans	-62.7	-41.4	174.7	-71.2	-60.9	-76.1	0	0	112.3	Y1827 R1833 L1834 E1835	Y1827-M1831 HydrophobicContact CD1-CG 4.13Å; Y1827-M1831 HydrophobicContact CD2-CG 4.41Å; Y1827-M1831 HydrophobicContact CE1-CG 3.56Å; Y1827-M1831 HydrophobicContact CE1-SD 4.45Å; Y1827-M1831 HydrophobicContact CE2-CG 3.87Å; Y1827-M1831 HydrophobicContact CE2-SD 4.09Å; Y1827-M1831 VanDerWaalsContact CZ-CG 3.43Å; Y1827-M1831 WeakPolarHBondContact O-CG 3.48Å; Y1827-M1831 PolarHBondContact O-N 2.87Å; M1831-R1833 VanDerWaalsContact C-N 3.28Å; M1831-R1833 PolarHBondContact O-N 2.72Å; M1831-L1834 PolarHBondContact O-N 2.92Å; M1831-L1834 HydrophobicContact SD-CD1 4.2Å; M1831-E1835 PolarHBondContact O-N 3.36Å
1832	K	59.6	Low	50.7	Low	87 Å²	87	101.1 Å²	101.1	38%	0.378	46%	0.456	S	S	.	.	H	α-helix	trans	-59.7	-37.7	171.2	-72.3	162.7	-177	170.1	0	112.1	E1828 L1829 L1830 K1836	E1828-K1832 WeakPolarHBondContact O-CD 3.42Å; E1828-K1832 VanDerWaalsContact O-CG 3.26Å; E1828-K1832 WeakPolarHBondContact O-CG 3.31Å; E1828-K1832 PolarHBondContact O-N 3.49Å; E1828-K1832 WeakPolarHBondContact OE1-CE 3.4Å; E1828-K1832 IonicContact OE1-NZ 2.63Å; E1828-K1832 PolarHBondContact OE1-NZ 3.37Å; E1828-K1832 IonicContact OE2-NZ 3.27Å; E1828-K1832 PolarHBondContact OE2-NZ 2.89Å; L1829-K1832 PolarHBondContact O-N 3.06Å; L1830-K1832 PolarHBondContact O-N 2.93Å; K1832-K1836 PolarHBondContact O-N 2.82Å; K1832-K1836 VanDerWaalsContact O-N 3.12Å
1833	R	57.9	Low	49.8	Very low	160 Å²	160	102 Å²	102	60%	0.604	46%	0.46	S	S	*	.	H	α-helix	trans	-70.2	-39.1	178	-150.8	179.7	-64.2	177.6	1.5	112.1	L1829 L1830 M1831 K1836 N1837	L1829-R1833 WeakPolarHBondContact O-CB 3.43Å; L1829-R1833 PolarHBondContact O-N 3.19Å; L1830-R1833 CarbonylContact O-C 3.57Å; L1830-R1833 WeakPolarHBondContact O-CA 3.27Å; L1830-R1833 WeakPolarHBondContact O-CB 3.41Å; L1830-R1833 PolarHBondContact O-N 3.14Å; L1830-R1833 VanDerWaalsContact O-N 3.09Å; M1831-R1833 VanDerWaalsContact C-N 3.28Å; M1831-R1833 PolarHBondContact O-N 2.72Å; R1833-K1836 PolarHBondContact O-N 3.04Å; R1833-N1837 PolarHBondContact O-N 2.76Å; R1833-N1837 VanDerWaalsContact O-N 3.12Å
1834	L	47	Very low	48.5	Very low	84 Å²	84	106.1 Å²	106.1	44%	0.44	48%	0.48	S	S	.	.	H	α-helix	trans	-65.8	-45.3	171.9	-78.9	172.1	0	0	0	112.1	L1830 M1831 K1836 N1837 I1838	L1830-L1834 HydrophobicContact CD2-CD1 3.65Å; L1830-L1834 HydrophobicContact CD2-CG 4.12Å; L1830-L1834 PolarHBondContact O-N 3.06Å; M1831-L1834 PolarHBondContact O-N 2.92Å; M1831-L1834 HydrophobicContact SD-CD1 4.2Å; L1834-K1836 PolarHBondContact O-N 2.87Å; L1834-N1837 PolarHBondContact O-N 3.29Å; L1834-N1837 VanDerWaalsContact O-N 3.16Å; L1834-I1838 WeakPolarHBondContact O-CG1 3.17Å; L1834-I1838 PolarHBondContact O-N 3.48Å
1835	E	44.4	Very low	47.3	Very low	68 Å²	68	108.6 Å²	108.6	32%	0.318	50%	0.503	S	S	.	.	H	α-helix	trans	-54.5	-42.3	174.3	-105.7	-142.2	-158	0	0	111.8	K1606 M1831 R1839	K1606-E1835 WeakPolarHBondContact CD-OE1 3.48Å; K1606-E1835 VanDerWaalsContact CE-OE1 3.28Å; K1606-E1835 WeakPolarHBondContact CE-OE1 3.42Å; K1606-E1835 IonicContact NZ-OE1 3.35Å; K1606-E1835 PolarHBondContact NZ-OE1 3.02Å; K1606-E1835 IonicContact NZ-OE2 2.74Å; K1606-E1835 PolarHBondContact NZ-OE2 3.36Å; M1831-E1835 PolarHBondContact O-N 3.36Å; E1835-R1839 WeakPolarHBondContact O-CB 3.22Å; E1835-R1839 PolarHBondContact O-N 3.11Å; E1835-R1839 IonicContact OE2-CZ 3.55Å; E1835-R1839 IonicContact OE2-NH2 3.32Å; E1835-R1839 PolarHBondContact OE2-NH2 2.97Å
1836	K	62.1	Low	45.8	Very low	133 Å²	133	110.5 Å²	110.5	58%	0.578	52%	0.519	S	S	*	.	H	α-helix	trans	-62.2	-51.7	175.3	-175.5	178.8	177.5	-175.4	0	111.5	K1832 R1833 L1834 I1838 R1839 D1840	K1832-K1836 PolarHBondContact O-N 2.82Å; K1832-K1836 VanDerWaalsContact O-N 3.12Å; R1833-K1836 PolarHBondContact O-N 3.04Å; L1834-K1836 PolarHBondContact O-N 2.87Å; K1836-I1838 VanDerWaalsContact C-N 3.33Å; K1836-I1838 PolarHBondContact O-N 3.28Å; K1836-R1839 CarbonylContact O-C 3.22Å; K1836-R1839 WeakPolarHBondContact O-CB 3.29Å; K1836-R1839 PolarHBondContact O-N 3.1Å; K1836-R1839 VanDerWaalsContact O-N 3.08Å; K1836-D1840 WeakPolarHBondContact CE-OD2 3.41Å; K1836-D1840 WeakPolarHBondContact CG-OD2 3.39Å; K1836-D1840 PolarHBondContact O-N 2.8Å
1837	N	52.9	Low	44.2	Very low	100 Å²	100	112.8 Å²	112.8	54%	0.535	53%	0.533	S	S	.	.	H	α-helix	trans	-59.5	-39	-180	-86.8	-12.6	0	0	0	113.3	R1833 L1834 K1841	R1833-N1837 PolarHBondContact O-N 2.76Å; R1833-N1837 VanDerWaalsContact O-N 3.12Å; L1834-N1837 PolarHBondContact O-N 3.29Å; L1834-N1837 VanDerWaalsContact O-N 3.16Å; N1837-K1841 WeakPolarHBondContact O-CB 3.39Å; N1837-K1841 WeakPolarHBondContact O-CG 3.4Å; N1837-K1841 PolarHBondContact O-N 3.3Å
1838	I	39.7	Very low	42.6	Very low	96 Å²	96	114.4 Å²	114.4	49%	0.492	55%	0.554	S	S	.	*	H	α-helix	trans	-66.2	-42.6	174.9	-66.1	166.5	0	0	0	110.5	L1834 K1836 D1840 R1842	L1834-I1838 WeakPolarHBondContact O-CG1 3.17Å; L1834-I1838 PolarHBondContact O-N 3.48Å; K1836-I1838 VanDerWaalsContact C-N 3.33Å; K1836-I1838 PolarHBondContact O-N 3.28Å; I1838-D1840 VanDerWaalsContact C-N 3.33Å; I1838-D1840 PolarHBondContact O-N 3.03Å; I1838-R1842 WeakPolarHBondContact O-CG 3.41Å; I1838-R1842 PolarHBondContact O-N 3.22Å; I1838-R1842 VanDerWaalsContact O-N 3.15Å
1839	R	45.2	Very low	41.3	Very low	137 Å²	137	118.4 Å²	118.4	52%	0.517	57%	0.572	S	S	.	*	H	α-helix	trans	-66.9	-31.9	178.9	-161	-175	-53.9	-171.6	6.3	112.9	E1835 K1836	E1835-R1839 WeakPolarHBondContact O-CB 3.22Å; E1835-R1839 PolarHBondContact O-N 3.11Å; E1835-R1839 IonicContact OE2-CZ 3.55Å; E1835-R1839 IonicContact OE2-NH2 3.32Å; E1835-R1839 PolarHBondContact OE2-NH2 2.97Å; K1836-R1839 CarbonylContact O-C 3.22Å; K1836-R1839 WeakPolarHBondContact O-CB 3.29Å; K1836-R1839 PolarHBondContact O-N 3.1Å; K1836-R1839 VanDerWaalsContact O-N 3.08Å
1840	D	46.5	Very low	39.5	Very low	59 Å²	59	121.2 Å²	121.2	32%	0.316	59%	0.586	S	S	.	*	H	α-helix	trans	-83.5	-34.9	177.7	-70.5	-30.7	0	0	0	112.5	K1836 I1838 R1842 K1843	K1836-D1840 WeakPolarHBondContact CE-OD2 3.41Å; K1836-D1840 WeakPolarHBondContact CG-OD2 3.39Å; K1836-D1840 PolarHBondContact O-N 2.8Å; I1838-D1840 VanDerWaalsContact C-N 3.33Å; I1838-D1840 PolarHBondContact O-N 3.03Å; D1840-R1842 VanDerWaalsContact C-N 3.26Å; D1840-R1842 PolarHBondContact O-N 2.84Å; D1840-K1843 WeakPolarHBondContact O-CB 3.17Å; D1840-K1843 PolarHBondContact O-N 3.12Å; D1840-K1843 VanDerWaalsContact O-N 3.11Å; D1840-K1843 WeakPolarHBondContact OD1-CE 3.15Å; D1840-K1843 IonicContact OD1-NZ 3.17Å; D1840-K1843 PolarHBondContact OD1-NZ 3.02Å
1841	K	38.6	Very low	37.6	Very low	180 Å²	180	121.4 Å²	121.4	78%	0.783	60%	0.595	S	S	*	*	H	α-helix	trans	-59.3	-36.7	168.2	-79.9	-172	175.7	-174	0	112.2	N1837 K1843 K1844	N1837-K1841 WeakPolarHBondContact O-CB 3.39Å; N1837-K1841 WeakPolarHBondContact O-CG 3.4Å; N1837-K1841 PolarHBondContact O-N 3.3Å; K1841-K1843 PolarHBondContact O-N 2.74Å; K1841-K1843 VanDerWaalsContact O-N 3.16Å; K1841-K1844 PolarHBondContact O-N 2.85Å
1842	R	29.3	Very low	36.2	Very low	155 Å²	155	124 Å²	124	59%	0.585	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.4	-12.6	175.2	-79.5	177.2	169.1	-178.5	-5	115.1	I1838 D1840	I1838-R1842 WeakPolarHBondContact O-CG 3.41Å; I1838-R1842 PolarHBondContact O-N 3.22Å; I1838-R1842 VanDerWaalsContact O-N 3.15Å; D1840-R1842 VanDerWaalsContact C-N 3.26Å; D1840-R1842 PolarHBondContact O-N 2.84Å
1843	K	37.9	Very low	34.2	Very low	140 Å²	140	125.6 Å²	125.6	61%	0.609	63%	0.632	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-1.8	-179.2	-65.7	172.4	-176	166.4	0	114.5	D1840 K1841 P1845	D1840-K1843 WeakPolarHBondContact O-CB 3.17Å; D1840-K1843 PolarHBondContact O-N 3.12Å; D1840-K1843 VanDerWaalsContact O-N 3.11Å; D1840-K1843 WeakPolarHBondContact OD1-CE 3.15Å; D1840-K1843 IonicContact OD1-NZ 3.17Å; D1840-K1843 PolarHBondContact OD1-NZ 3.02Å; K1841-K1843 PolarHBondContact O-N 2.74Å; K1841-K1843 VanDerWaalsContact O-N 3.16Å; K1843-P1845 VanDerWaalsContact O-CD 3.32Å; K1843-P1845 WeakPolarHBondContact O-CD 3.14Å
1844	K	27.9	Very low	32.4	Very low	180 Å²	180	123.9 Å²	123.9	78%	0.783	64%	0.639	S	S	*	*			trans	-113.4	89.6	179.1	-72.2	-167.9	174.6	-172.2	0	111.8	K1841 T1846	K1841-K1844 PolarHBondContact O-N 2.85Å; K1844-T1846 PolarHBondContact O-N 2.8Å
1845	P	28.9	Very low	31	Very low	123 Å²	123	123.9 Å²	123.9	80%	0.799	65%	0.651	S	S	*	*			trans	-73	107.4	167.6	30	-32.1	0	0	0	109.8	K1843	K1843-P1845 VanDerWaalsContact O-CD 3.32Å; K1843-P1845 WeakPolarHBondContact O-CD 3.14Å
1846	T	21.3	Very low	29.8	Very low	134 Å²	134	127.9 Å²	127.9	82%	0.822	67%	0.674	S	S	*	*			trans	-75.1	118.4	163.3	40.7	0	0	0	0	109.7	K1844	K1844-T1846 PolarHBondContact O-N 2.8Å
1847	L	21.6	Very low	27.7	Very low	163 Å²	163	125.8 Å²	125.8	85%	0.853	68%	0.676	S	S	*	*			trans	-139.9	137	153.8	-156.7	74.1	0	0	0	110.2
1848	S	20.3	Very low	26.1	Very low	94 Å²	94	126 Å²	126	66%	0.657	69%	0.685	S	S	*	*			trans	-97.9	133.6	-174.4	51.7	0	0	0	0	112.4
1849	H	20.9	Very low	25	Very low	159 Å²	159	129.4 Å²	129.4	74%	0.736	70%	0.704	S	S	*	*			trans	-139.2	126.2	146.5	-82.8	-77.5	0	0	0	106.5
1850	I	19.4	Very low	23.9	Very low	142 Å²	142	131.4 Å²	131.4	73%	0.728	72%	0.719	S	S	*	*				64.9	115.6	71.8	-64.2	177.1	0	0	0	109.2
1851	S	19.1	Very low	22.8	Very low	96 Å²	96	133.9 Å²	133.9	67%	0.671	74%	0.738	S	S	*	*			cis	-153	-176.1	9.7	-143.8	0	0	0	0	114
1852	T	19	Very low	21.8	Very low	114 Å²	114	130 Å²	130	70%	0.699	73%	0.734	S	S	*	*			trans	-6.9	142.1	154.2	57.1	0	0	0	0	117.3
1853	T	19.3	Very low	21.8	Very low	121 Å²	121	127 Å²	127	74%	0.742	73%	0.734	S	S	*	*				-162.7	164.6	64.5	36	0	0	0	0	114.9
1854	V	18.7	Very low	20.9	Very low	124 Å²	124	127.1 Å²	127.1	75%	0.752	74%	0.742	S	S	*	*			trans	42	95.8	143.3	178.4	0	0	0	0	116.2
1855	A	18.8	Very low	20.5	Very low	83 Å²	83	125.3 Å²	125.3	69%	0.686	74%	0.74	S	S	*	*				60.2	103.4	74.4	0	0	0	0	0	114.6
1856	N	18.4	Very low	19.9	Very low	152 Å²	152	126 Å²	126	81%	0.813	74%	0.736	S	S	*	*			trans	-166.6	105.6	146.7	-93.9	-19	0	0	0	105.5
1857	S	18.3	Very low	19.8	Very low	89 Å²	89	125 Å²	125	62%	0.622	73%	0.734	S	S	*	*				72.7	118	78.9	74.3	0	0	0	0	112.8
1858	S	18.3	Very low	19.8	Very low	104 Å²	104	122 Å²	122	73%	0.727	73%	0.725	S	S	*	*			trans	34.6	119.9	145.9	58.9	0	0	0	0	119.4
1859	L	18.2	Very low	19.7	Very low	169 Å²	169	123.3 Å²	123.3	89%	0.885	73%	0.734	S	S	*	*				-168	102.5	122.7	-97.1	151.6	0	0	0	110.5
1860	H	21.4	Very low	19.6	Very low	179 Å²	179	122.2 Å²	122.2	83%	0.829	74%	0.738	S	S	*	*			trans	-59.3	149	132.7	-79.8	-76.9	0	0	0	107.1
1861	P	23	Very low	20.1	Very low	110 Å²	110	120.7 Å²	120.7	71%	0.714	74%	0.738	S	S	*	*			cis	-149.6	-177.9	45.1	41.2	-20.3	0	0	0	117.2
1862	S	17.4	Very low	20	Very low	99 Å²	99	121.6 Å²	121.6	69%	0.692	74%	0.744	S	S	*	*			trans	-61.7	173.5	151.1	54.6	0	0	0	0	113.2
1863	P	30.3	Very low	20.1	Very low	93 Å²	93	125.2 Å²	125.2	60%	0.604	75%	0.753	S	S	*	*			cis	-131.5	-160	-13.5	28.8	-5.1	0	0	0	112.2
1864	N	18.5	Very low	20	Very low	142 Å²	142	125.8 Å²	125.8	76%	0.759	76%	0.756	S	S	*	*			trans	74.1	168.2	168.4	-41.9	-41.4	0	0	0	113.5
1865	L	18.4	Very low	20.1	Very low	141 Å²	141	126.2 Å²	126.2	74%	0.738	76%	0.759	S	S	*	*			cis	-147.6	160.2	23.1	-98.1	104.6	0	0	0	113.1
1866	L	18.3	Very low	20	Very low	137 Å²	137	127.6 Å²	127.6	72%	0.717	76%	0.758	S	S	*	*			trans	62.6	110.1	147	-61.5	159.9	0	0	0	121.7
1867	S	17.2	Very low	20	Very low	114 Å²	114	126.1 Å²	126.1	80%	0.797	76%	0.755	S	S	*	*				-80.3	141.3	107.9	60.4	0	0	0	0	108.6
1868	P	22.7	Very low	20	Very low	101 Å²	101	128 Å²	128	66%	0.656	76%	0.763	S	S	*	*				-146.6	163.1	73.9	42.4	-28.1	0	0	0	115.9
1869	S	18.8	Very low	20.1	Very low	120 Å²	120	129 Å²	129	84%	0.839	77%	0.77	S	S	*	*			trans	-159.4	144.6	145.9	49.9	0	0	0	0	111.7
1870	V	18	Very low	20.1	Very low	137 Å²	137	127.4 Å²	127.4	83%	0.83	77%	0.767	S	S	*	*			trans	-158.6	148.3	-173.2	175	0	0	0	0	106.1
1871	P	29.8	Very low	20	Very low	110 Å²	110	123.9 Å²	123.9	71%	0.714	76%	0.762	S	S	*	*			cis	-121	178.9	-26.5	37.9	-23.5	0	0	0	111.7
1872	S	17.7	Very low	20.3	Very low	114 Å²	114	124.4 Å²	124.4	80%	0.797	77%	0.766	S	S	*	*			trans	173.1	103	132.3	39.4	0	0	0	0	112.9
1873	Q	20.7	Very low	20.7	Very low	190 Å²	190	125.2 Å²	125.2	89%	0.888	77%	0.769	S	S	*	*			trans	-139	135	150.5	-76.7	-163.5	-22.9	0	0	109.3
1874	V	17.1	Very low	21.3	Very low	134 Å²	134	126.1 Å²	126.1	81%	0.812	77%	0.774	S	S	*	*			trans	-108.6	129	174.9	173.6	0	0	0	0	107.2	V1876	V1874-V1876 HydrophobicContact CG1-CG2 4.39Å
1875	T	21.5	Very low	21.4	Very low	132 Å²	132	124.5 Å²	124.5	81%	0.81	77%	0.772	S	S	*	*			trans	-144.8	144.1	167.5	-50.2	0	0	0	0	108.5
1876	V	15.8	Very low	21.3	Very low	112 Å²	112	123.3 Å²	123.3	68%	0.679	77%	0.771	S	S	*	*			trans	-117.9	168.7	-167.3	-170.5	0	0	0	0	109.1	V1874	V1874-V1876 HydrophobicContact CG1-CG2 4.39Å
1877	T	18.5	Very low	21.3	Very low	121 Å²	121	122 Å²	122	74%	0.742	77%	0.769	S	S	*	*			trans	89.9	121.9	166.1	66.8	0	0	0	0	119.1
1878	T	18.8	Very low	21.4	Very low	128 Å²	128	122.5 Å²	122.5	79%	0.785	77%	0.767	S	S	*	*			trans	56.8	96.1	143.1	55.5	0	0	0	0	120.3
1879	S	19.3	Very low	21.2	Very low	126 Å²	126	122.1 Å²	122.1	88%	0.881	77%	0.767	S	S	*	*				-170.1	149.1	96.1	32.8	0	0	0	0	113.6
1880	V	19.2	Very low	21.2	Very low	136 Å²	136	123.8 Å²	123.8	82%	0.824	77%	0.765	S	S	*	*			trans	-74.8	156	-161.2	174.1	0	0	0	0	115.1
1881	S	19.3	Very low	21.2	Very low	104 Å²	104	122.2 Å²	122.2	73%	0.727	76%	0.758	S	S	*	*			trans	71.7	121.3	175	71.9	0	0	0	0	115.2
1882	P	29.1	Very low	20.6	Very low	122 Å²	122	122.8 Å²	122.8	79%	0.792	76%	0.759	S	S	*	*				-104.1	-173.5	70.8	38.8	-41	0	0	0	113.2
1883	P	26.6	Very low	20.6	Very low	116 Å²	116	121.6 Å²	121.6	75%	0.753	75%	0.751	S	S	*	*			cis	-124.8	-143.6	3.6	32	-6.9	0	0	0	112.3
1884	P	41.6	Very low	20.4	Very low	111 Å²	111	117.5 Å²	117.5	72%	0.721	74%	0.743	S	S	*	*				-110.6	-171.3	-87.3	40.1	-25.7	0	0	0	111.4
1885	P	20.4	Very low	20.4	Very low	108 Å²	108	118.6 Å²	118.6	70%	0.701	74%	0.743	S	S	*	*				-149.4	173	90.1	42.4	-25.4	0	0	0	115.1
1886	T	17.9	Very low	20.2	Very low	117 Å²	117	118.9 Å²	118.9	72%	0.718	74%	0.738	S	S	*	*			trans	31.4	145.4	139.5	61.2	0	0	0	0	122.1
1887	T	18.4	Very low	20.4	Very low	110 Å²	110	119.5 Å²	119.5	68%	0.675	74%	0.742	S	S	*	*			cis	-173.1	-169.9	-3.1	28.5	0	0	0	0	106.5
1888	T	18.8	Very low	20.5	Very low	123 Å²	123	118.9 Å²	118.9	76%	0.755	74%	0.743	S	S	*	*			trans	44.9	117.3	139.6	48.9	0	0	0	0	118.9
1889	S	18	Very low	20.5	Very low	94 Å²	94	117.4 Å²	117.4	66%	0.657	74%	0.738	S	S	*	*			cis	-171.1	147.6	13.8	58	0	0	0	0	114
1890	L	18.2	Very low	20.6	Very low	155 Å²	155	120.7 Å²	120.7	81%	0.812	74%	0.736	S	S	*	*				41.7	146.7	123.3	-57.3	169.4	0	0	0	120.8
1891	P	19.4	Very low	20.6	Very low	103 Å²	103	119.8 Å²	119.8	67%	0.669	74%	0.736	S	S	*	*				-145.7	-154.8	-54.3	35.4	-12.8	0	0	0	111.5
1892	V	16	Very low	20.6	Very low	122 Å²	122	119.4 Å²	119.4	74%	0.739	74%	0.739	S	S	*	*			trans	76.6	112.1	136.5	157.1	0	0	0	0	120.6
1893	S	17.9	Very low	20.2	Very low	90 Å²	90	120.6 Å²	120.6	63%	0.629	74%	0.739	S	S	*	*			trans	68.3	102.4	137.1	75.9	0	0	0	0	122.8
1894	S	17.3	Very low	19.9	Very low	104 Å²	104	121.5 Å²	121.5	73%	0.727	74%	0.737	S	S	*	*				20	116.4	111.7	61.7	0	0	0	0	120.3
1895	I	16.5	Very low	18.7	Very low	156 Å²	156	122.8 Å²	122.8	80%	0.8	74%	0.738	S	S	*	*			trans	-173	121.8	141.7	-94.7	148.5	0	0	0	104.1
1896	I	18.1	Very low	18.6	Very low	138 Å²	138	124 Å²	124	71%	0.708	74%	0.738	S	S	*	*				77.6	124.6	60.1	-63.7	177.2	0	0	0	113.4
1897	T	19.8	Very low	18.7	Very low	125 Å²	125	124.8 Å²	124.8	77%	0.767	74%	0.737	S	S	*	*			trans	70.2	127.1	166.2	46.1	0	0	0	0	123.3
1898	S	19.3	Very low	18.8	Very low	108 Å²	108	123.8 Å²	123.8	76%	0.755	73%	0.734	S	S	*	*			trans	104.8	127.8	131.4	75.5	0	0	0	0	123.3
1899	S	20.1	Very low	18.9	Very low	98 Å²	98	123.5 Å²	123.5	69%	0.685	73%	0.733	S	S	*	*			trans	55.9	123	141.1	58.4	0	0	0	0	125.2
1900	K	20.2	Very low	18.9	Very low	194 Å²	194	128.1 Å²	128.1	84%	0.843	74%	0.741	S	S	*	*			trans	66.3	119.1	131.1	-66.1	-177.2	177.3	-179.9	0	122.3
1901	S	20.2	Very low	19	Very low	118 Å²	118	125.6 Å²	125.6	83%	0.825	74%	0.737	S	S	*	*			trans	64.1	106.9	134.2	64.1	0	0	0	0	123.3
1902	A	19.8	Very low	19	Very low	96 Å²	96	125.7 Å²	125.7	79%	0.793	74%	0.739	S	S	*	*			trans	-154.6	155.1	135.8	0	0	0	0	0	107
1903	N	19.2	Very low	19	Very low	146 Å²	146	128.2 Å²	128.2	78%	0.781	74%	0.743	S	S	*	*			cis	78.6	126.3	29.1	-98.2	11.9	0	0	0	117.6
1904	N	20.4	Very low	19.1	Very low	135 Å²	135	131 Å²	131	72%	0.722	75%	0.746	S	S	*	*			trans	86.9	136.3	151.9	-71.3	-2	0	0	0	123.6
1905	L	16.8	Very low	19.1	Very low	139 Å²	139	132.3 Å²	132.3	73%	0.728	75%	0.745	S	S	*	*			trans	75.3	110.2	147.8	-95.1	79	0	0	0	122.7
1906	L	18.7	Very low	19.2	Very low	134 Å²	134	132.6 Å²	132.6	70%	0.702	75%	0.748	S	S	*	*				66	132.9	119.4	-106.9	66.9	0	0	0	122.3
1907	D	19.5	Very low	19.2	Very low	133 Å²	133	132.8 Å²	132.8	71%	0.711	75%	0.75	S	S	*	*			trans	62.5	150.7	139.8	-65.9	-10.5	0	0	0	121.4
1908	S	20.8	Very low	19.1	Very low	88 Å²	88	136.3 Å²	136.3	62%	0.615	76%	0.76	S	S	*	*			cis	-166.1	-173	-24.1	61.2	0	0	0	0	109.9
1909	T	19.9	Very low	19.1	Very low	117 Å²	117	137.4 Å²	137.4	72%	0.718	76%	0.756	S	S	*	*			trans	68	103.1	163.4	55.2	0	0	0	0	121.2
1910	K	19.1	Very low	19	Very low	192 Å²	192	138.2 Å²	138.2	84%	0.835	76%	0.758	S	S	*	*				66.5	132.5	117.3	-68.8	-178.8	177.2	177.1	0	123.1
1911	S	19.4	Very low	18.9	Very low	102 Å²	102	136.6 Å²	136.6	71%	0.713	76%	0.758	S	S	*	*			trans	74.1	108.2	134.8	61.5	0	0	0	0	121.6
1912	S	19.1	Very low	18.9	Very low	104 Å²	104	139.7 Å²	139.7	73%	0.727	76%	0.764	S	S	*	*				70.3	126.7	127	62	0	0	0	0	121.8
1913	E	17.5	Very low	18.8	Very low	175 Å²	175	139.7 Å²	139.7	82%	0.818	76%	0.759	S	S	*	*			trans	88.9	119.3	144.5	-75.6	177.4	-159.5	0	0	121.1
1914	H	19.1	Very low	18.7	Very low	150 Å²	150	138.1 Å²	138.1	69%	0.694	76%	0.759	S	S	*	*			trans	62	113.3	150.6	-77.7	-62	0	0	0	121.7
1915	N	18.2	Very low	18.7	Very low	130 Å²	130	137 Å²	137	70%	0.695	76%	0.762	S	S	*	*			trans	64	107.7	136.2	-52.1	-4.6	0	0	0	116.8
1916	N	18	Very low	18.8	Very low	163 Å²	163	136.7 Å²	136.7	87%	0.872	76%	0.761	S	S	*	*				-154	142.2	107.6	-95.8	-48.4	0	0	0	111.2
1917	D	18.1	Very low	18.8	Very low	142 Å²	142	137 Å²	137	76%	0.759	76%	0.762	S	S	*	*			trans	-63.4	134.4	161.7	-62.1	-85.8	0	0	0	109.6	I1919	D1917-I1919 HydrophobicContact CB-CD1 4.45Å; D1917-I1919 HydrophobicContact CB-CG1 4.05Å
1918	M	17.7	Very low	18.9	Very low	198 Å²	198	135.5 Å²	135.5	98%	0.975	76%	0.759	S	S	*	*			trans	-110.2	80.9	159.9	-136.2	178.5	-171.1	0	0	109.9
1919	I	18.5	Very low	18.7	Very low	131 Å²	131	138.7 Å²	138.7	67%	0.672	77%	0.768	S	S	*	*			trans	-66.9	160.1	167.5	-54.4	176.4	0	0	0	108.5	D1917	D1917-I1919 HydrophobicContact CB-CD1 4.45Å; D1917-I1919 HydrophobicContact CB-CG1 4.05Å
1920	T	18.7	Very low	18.6	Very low	116 Å²	116	141.8 Å²	141.8	71%	0.712	77%	0.774	S	S	*	*			trans	82.4	94.7	174.7	71.8	0	0	0	0	116.4
1921	N	18.6	Very low	18.5	Very low	160 Å²	160	139.5 Å²	139.5	86%	0.856	78%	0.776	S	S	*	*				-177.5	89.9	119.2	-94	-41.6	0	0	0	111.5
1922	L	19.9	Very low	18.4	Very low	182 Å²	182	138.8 Å²	138.8	95%	0.953	77%	0.771	S	S	*	*			trans	-165.8	136	155.7	-114.3	161.9	0	0	0	110.4
1923	S	17.7	Very low	18.3	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	78%	0.776	S	S	*	*			trans	-129.7	136.1	-173.8	48.9	0	0	0	0	112.9
1924	S	17.6	Very low	18.3	Very low	112 Å²	112	137.4 Å²	137.4	78%	0.783	78%	0.775	S	S	*	*			trans	35.2	100.6	147.7	60	0	0	0	0	120.4
1925	S	20.1	Very low	18.2	Very low	111 Å²	111	138.8 Å²	138.8	78%	0.776	78%	0.782	S	S	*	*			trans	-178.6	149.7	140.6	49.9	0	0	0	0	110.7
1926	N	18.5	Very low	18.2	Very low	134 Å²	134	138.5 Å²	138.5	72%	0.717	79%	0.785	S	S	*	*			cis	-165.9	136.6	-32.4	-119.6	-6.9	0	0	0	108.6
1927	I	17.9	Very low	18.1	Very low	141 Å²	141	136.8 Å²	136.8	72%	0.723	78%	0.78	S	S	*	*			trans	61.6	137	139.5	-63	168.4	0	0	0	118.9
1928	P	22.9	Very low	18.2	Very low	101 Å²	101	139.6 Å²	139.6	66%	0.656	78%	0.781	S	S	*	*			cis	-146.6	-155.2	-27.1	42.7	-20.9	0	0	0	113.9
1929	I	16.9	Very low	18.1	Very low	154 Å²	154	139.5 Å²	139.5	79%	0.79	78%	0.776	S	S	*	*			trans	75.6	105.7	154	-71.8	168.5	0	0	0	118.3
1930	E	16	Very low	18.1	Very low	183 Å²	183	139.6 Å²	139.6	86%	0.855	78%	0.778	S	S	*	*			trans	-75.1	153.6	145.3	-52.6	167.5	108.3	0	0	110
1931	V	17.3	Very low	18.1	Very low	143 Å²	143	139 Å²	139	87%	0.867	78%	0.779	S	S	*	*			trans	-162.4	153.1	132.2	129.5	0	0	0	0	110.4
1932	S	17.2	Very low	18.1	Very low	88 Å²	88	137.5 Å²	137.5	62%	0.615	78%	0.775	S	S	*	*			trans	-97.5	154.4	-169.5	50.9	0	0	0	0	114.7
1933	T	17.1	Very low	18.1	Very low	134 Å²	134	135.8 Å²	135.8	82%	0.822	77%	0.767	S	S	*	*			trans	38.5	107.3	145.5	56.8	0	0	0	0	119.7
1934	S	17.9	Very low	18.2	Very low	115 Å²	115	139.3 Å²	139.3	80%	0.804	77%	0.772	S	S	*	*			trans	-144.6	100.9	157.9	34.3	0	0	0	0	113.7
1935	Q	18.1	Very low	18.3	Very low	179 Å²	179	141.7 Å²	141.7	84%	0.836	78%	0.776	S	S	*	*				38.9	112.3	123.6	-94.1	-179.8	-10.8	0	0	121.9
1936	T	17.2	Very low	18.2	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	78%	0.782	S	S	*	*				68.9	149.6	127.6	27.3	0	0	0	0	124.3
1937	V	16.9	Very low	18.3	Very low	127 Å²	127	144.2 Å²	144.2	77%	0.77	78%	0.778	S	S	*	*			trans	85	142	158.8	169.5	0	0	0	0	117.9
1938	Y	18.8	Very low	18.3	Very low	201 Å²	201	144.4 Å²	144.4	79%	0.788	77%	0.773	S	S	*	*			trans	-48	154.8	176.7	-63.3	-101.8	0	0	0	114.7
1939	F	16.8	Very low	18.2	Very low	197 Å²	197	149.6 Å²	149.6	86%	0.864	79%	0.786	S	S	*	*				-154.9	173.1	121.7	-109.6	-69.2	0	0	0	112
1940	N	18.2	Very low	18.3	Very low	132 Å²	132	149.9 Å²	149.9	71%	0.706	79%	0.788	S	S	*	*			trans	-97.7	169	-170.9	-68.9	-41.2	0	0	0	113.4
1941	S	18.9	Very low	18.4	Very low	105 Å²	105	146.5 Å²	146.5	73%	0.734	78%	0.78	S	S	*	*			trans	76.6	159.7	139.8	72.2	0	0	0	0	120.3
1942	V	18.4	Very low	18.4	Very low	128 Å²	128	147 Å²	147	78%	0.776	78%	0.776	S	S	*	*			trans	68.3	121.3	171.6	-170.7	0	0	0	0	112.6
1943	D	20	Very low	18.4	Very low	146 Å²	146	150 Å²	150	78%	0.781	78%	0.784	S	S	*	*			cis	-142.4	158.4	46.6	-143.1	-20.3	0	0	0	115.4
1944	Q	19.9	Very low	18.5	Very low	170 Å²	170	151.3 Å²	151.3	79%	0.794	79%	0.786	S	S	*	*			trans	-91.4	138.2	172.9	-61.3	176.2	-1.3	0	0	109.8
1945	N	20.1	Very low	18.5	Very low	162 Å²	162	153.2 Å²	153.2	87%	0.866	79%	0.786	S	S	*	*			trans	-174.2	82	143	-106	-63.8	0	0	0	111.9
1946	M	17.6	Very low	18.5	Very low	183 Å²	183	149.4 Å²	149.4	90%	0.901	78%	0.779	S	S	*	*			trans	-108.4	100.2	159.9	-113.4	-67.7	-167.5	0	0	107.6
1947	N	19.3	Very low	18.6	Very low	116 Å²	116	150.4 Å²	150.4	62%	0.62	78%	0.78	S	S	*	*			trans	-165.7	125.9	159.1	-110.7	-52.3	0	0	0	113.4
1948	K	19.7	Very low	18.8	Very low	145 Å²	145	150.5 Å²	150.5	63%	0.63	78%	0.776	S	S	*	*			trans	48.7	81.5	146.1	-64.2	171.5	-179	-176.3	0	118.1	I1703	I1703-K1948 PolarHBondContact O-NZ 3.17Å
1949	F	19.8	Very low	18.8	Very low	210 Å²	210	147.3 Å²	147.3	92%	0.921	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-92.6	136.5	133.3	-105.1	-92.1	0	0	0	109.6
1950	L	19	Very low	19	Very low	160 Å²	160	143.3 Å²	143.3	84%	0.838	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-55.7	156.5	-154.8	-79	149.8	0	0	0	119.1
1951	T	18.3	Very low	19	Very low	111 Å²	111	143.2 Å²	143.2	68%	0.681	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-69	149.1	167.7	46.9	0	0	0	0	113.9
1952	I	17.6	Very low	19.1	Very low	154 Å²	154	146 Å²	146	79%	0.79	78%	0.778	S	S	*	*			trans	66.1	108.3	159	-55	152.1	0	0	0	115.4
1953	I	17.7	Very low	19.1	Very low	151 Å²	151	144.6 Å²	144.6	77%	0.774	77%	0.774	S	S	*	*				-162.2	124.5	104.5	-92.6	173.8	0	0	0	107.2
1954	D	18.3	Very low	19	Very low	162 Å²	162	146.8 Å²	146.8	87%	0.866	78%	0.776	S	S	*	*			trans	-82.8	118.2	157.9	-121.2	-35.4	0	0	0	107.1
1955	L	17.3	Very low	19	Very low	155 Å²	155	145 Å²	145	81%	0.812	78%	0.778	S	S	*	*			trans	-179	133	142.9	-102.8	162.8	0	0	0	111.8	N1957	L1955-N1957 PolarHBondContact O-N 3.32Å
1956	S	18.8	Very low	19	Very low	98 Å²	98	143.4 Å²	143.4	69%	0.685	78%	0.779	S	S	*	*			trans	-69	118.5	170.6	53	0	0	0	0	111.5
1957	N	18.8	Very low	18.9	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	77%	0.773	S	S	*	*			trans	-175.8	153.4	131.3	-100.9	-26.9	0	0	0	116	L1955	L1955-N1957 PolarHBondContact O-N 3.32Å
1958	N	20.9	Very low	18.9	Very low	128 Å²	128	142.4 Å²	142.4	68%	0.684	78%	0.777	S	S	*	*			trans	86.4	113.5	143.3	-74.6	-12	0	0	0	124.2
1959	I	19.2	Very low	18.9	Very low	135 Å²	135	142.6 Å²	142.6	69%	0.692	79%	0.785	S	S	*	*				84.2	111.2	123.1	-61.7	167.7	0	0	0	120	V1961	I1959-V1961 HydrophobicContact CG2-CG2 3.81Å
1960	S	21.1	Very low	18.8	Very low	112 Å²	112	138.4 Å²	138.4	78%	0.783	78%	0.776	S	S	*	*				-141.8	101.4	119.9	65.1	0	0	0	0	108.9
1961	V	19.1	Very low	18.6	Very low	130 Å²	130	137.9 Å²	137.9	79%	0.788	77%	0.773	S	S	*	*				71.3	101.6	98.4	175.1	0	0	0	0	113.8	I1959	I1959-V1961 HydrophobicContact CG2-CG2 3.81Å
1962	N	19.7	Very low	18.6	Very low	164 Å²	164	138.2 Å²	138.2	88%	0.877	78%	0.775	S	S	*	*			trans	-137.9	162.9	156.6	-157	-9.1	0	0	0	107.9
1963	S	19.5	Very low	18.6	Very low	98 Å²	98	136.9 Å²	136.9	69%	0.685	77%	0.774	S	S	*	*			trans	-117.8	127.3	-155.5	64.8	0	0	0	0	116.7
1964	K	18.5	Very low	18.5	Very low	192 Å²	192	134.1 Å²	134.1	84%	0.835	77%	0.768	S	S	*	*			trans	178.2	128.3	134	-99.7	161.8	-175.7	176.3	0	114.2
1965	T	19.1	Very low	18.7	Very low	134 Å²	134	135.3 Å²	135.3	82%	0.822	77%	0.768	S	S	*	*			trans	52.8	123	150.6	51.4	0	0	0	0	122.8
1966	S	19.2	Very low	19.5	Very low	128 Å²	128	132.6 Å²	132.6	90%	0.895	76%	0.76	S	S	*	*			trans	84.6	147.6	154.9	-145.2	0	0	0	0	119.5
1967	L	16.8	Very low	19.5	Very low	146 Å²	146	135 Å²	135	76%	0.764	76%	0.76	S	S	*	*			trans	-127.8	169.8	-166.2	-98.5	154.5	0	0	0	110.6
1968	N	18.2	Very low	19.7	Very low	132 Å²	132	131.5 Å²	131.5	71%	0.706	74%	0.741	S	S	*	*			trans	68	104	160.6	-57	-17.9	0	0	0	118.6
1969	N	19.5	Very low	19.6	Very low	149 Å²	149	130 Å²	130	80%	0.797	73%	0.733	S	S	*	*				-171.6	122	103.7	-89	-19.4	0	0	0	110
1970	V	17.5	Very low	19.6	Very low	121 Å²	121	127.6 Å²	127.6	73%	0.733	72%	0.724	S	S	*	*				76.4	100.7	92.9	176.2	0	0	0	0	114.5
1971	L	16.4	Very low	19.6	Very low	149 Å²	149	126.6 Å²	126.6	78%	0.78	71%	0.707	S	S	*	*			trans	45.6	140.8	138	-68.1	167.3	0	0	0	123.8
1972	T	17.8	Very low	19.6	Very low	118 Å²	118	123.7 Å²	123.7	72%	0.724	69%	0.692	S	S	*	*			trans	80.1	116.2	139.8	46.4	0	0	0	0	124.1
1973	V	16.4	Very low	19.5	Very low	127 Å²	127	121.2 Å²	121.2	77%	0.77	68%	0.678	S	S	*	*				81.8	109.8	122.3	176.5	0	0	0	0	122.1
1974	S	17.6	Very low	19.5	Very low	93 Å²	93	123.8 Å²	123.8	65%	0.65	68%	0.677	S	S	*	*			trans	35.6	132.6	145.1	70.3	0	0	0	0	125.8
1975	Q	21.3	Very low	19.6	Very low	186 Å²	186	122.5 Å²	122.5	87%	0.869	67%	0.667	S	S	*	*			trans	51.6	170.7	137.4	-74.8	-173.9	-25.7	0	0	120.3
1976	P	35.2	Very low	19.6	Very low	98 Å²	98	120.9 Å²	120.9	64%	0.636	65%	0.653	S	S	*	*			cis	-130	-150.9	-12.2	37.2	-14.6	0	0	0	112.9
1977	E	18.9	Very low	19.7	Very low	148 Å²	148	119.2 Å²	119.2	69%	0.692	64%	0.642	S	S	*	*			trans	48.3	140.3	145.1	-72.7	157.2	-147.5	0	0	123.3
1978	L	21	Very low	19.8	Very low	73 Å²	73	119.8 Å²	119.8	38%	0.382	64%	0.64	S	S	.	*			cis	99.6	105.6	22.9	-59.1	179.9	0	0	0	116	S2018 Q2019 H2020	L1978-S2018 VanDerWaalsContact CA-OG 3.27Å; L1978-S2018 WeakPolarHBondContact CA-OG 3.46Å; L1978-Q2019 VanDerWaalsContact C-CG 3.43Å; L1978-Q2019 HydrophobicContact CB-CB 4.42Å; L1978-Q2019 HydrophobicContact CB-CG 3.71Å; L1978-Q2019 VanDerWaalsContact CD2-N 3.31Å; L1978-Q2019 PolarHBondContact O-NE2 3.43Å; L1978-H2020 HydrophobicContact CD1-CB 4.44Å; L1978-H2020 WeakPolarHBondContact CD1-ND1 3.2Å
1979	L	19	Very low	19.8	Very low	98 Å²	98	121.4 Å²	121.4	51%	0.513	65%	0.646	S	S	.	*			trans	138.5	155.8	149.1	-132.3	-162.9	0	0	0	120.6	S2018 Q2019	L1979-S2018 PolarHBondContact N-OG 2.91Å; L1979-Q2019 VanDerWaalsContact CA-CG 3.4Å; L1979-Q2019 HydrophobicContact CB-CG 3.43Å; L1979-Q2019 VanDerWaalsContact CB-CG 3.43Å; L1979-Q2019 HydrophobicContact CD2-CG 4.01Å; L1979-Q2019 VanDerWaalsContact CG-CD 3.44Å; L1979-Q2019 HydrophobicContact CG-CG 3.43Å; L1979-Q2019 VanDerWaalsContact CG-CG 3.43Å
1980	V	19.1	Very low	19.7	Very low	83 Å²	83	122.6 Å²	122.6	50%	0.503	65%	0.646	S	S	.	*			trans	103.3	165.7	148.7	176.3	0	0	0	0	123.6	F2002	V1980-F2002 VanDerWaalsContact C-CE2 3.48Å; V1980-F2002 HydrophobicContact CB-CE2 4.44Å; V1980-F2002 HydrophobicContact CG1-CE2 3.89Å; V1980-F2002 HydrophobicContact CG1-CZ 4.34Å; V1980-F2002 WeakPolarHBondContact O-CD2 3.36Å
1981	Q	21.1	Very low	19.8	Very low	92 Å²	92	125.8 Å²	125.8	43%	0.43	65%	0.65	S	S	.	*			trans	-158.6	124.7	-141.4	-73.7	-176.6	22.8	0	0	121.6	F2002 K2003	Q1981-F2002 VanDerWaalsContact CA-CG 3.47Å; Q1981-K2003 HydrophobicContact CB-CB 4.41Å; Q1981-K2003 HydrophobicContact CB-CG 3.47Å; Q1981-K2003 VanDerWaalsContact CB-CG 3.47Å; Q1981-K2003 HydrophobicContact CG-CG 3.93Å
1982	S	20.2	Very low	20	Very low	68 Å²	68	123.6 Å²	123.6	48%	0.476	65%	0.647	S	S	.	*			trans	-169.5	-160.5	162.2	-163.9	0	0	0	0	115.9	F2002 K2003	S1982-F2002 VanDerWaalsContact CB-CD1 3.5Å; S1982-F2002 WeakPolarHBondContact O-CB 3.4Å; S1982-K2003 WeakPolarHBondContact O-CB 3.31Å
1983	I	18.5	Very low	20	Very low	112 Å²	112	124.7 Å²	124.7	57%	0.574	65%	0.647	S	S	*	*			trans	81.8	171.7	161.4	-60.5	176.4	0	0	0	120.3	F2002	I1983-F2002 HydrophobicContact CD1-CD1 4.08Å; I1983-F2002 HydrophobicContact CD1-CE1 4.36Å; I1983-F2002 HydrophobicContact CG1-CD1 4.25Å
1984	K	19.1	Very low	20.1	Very low	153 Å²	153	124.5 Å²	124.5	67%	0.665	64%	0.638	S	S	*	*			trans	-161.4	145.4	-152.8	-58.2	159.2	-168.7	157.3	0	119.2
1985	R	19.6	Very low	20.2	Very low	164 Å²	164	126.3 Å²	126.3	62%	0.619	64%	0.64	S	S	*	*			trans	44.3	141.9	135.6	-52.1	175.5	-156.5	144.3	-1.2	126.9	D2011	R1985-D2011 CarbonylContact C-O 3.55Å; R1985-D2011 WeakPolarHBondContact CA-O 3.49Å
1986	D	18.9	Very low	20.1	Very low	101 Å²	101	123.5 Å²	123.5	54%	0.54	64%	0.636	S	S	.	*				152.6	136.9	102.7	-93.9	-30.9	0	0	0	117.7	D2011	D1986-D2011 PolarHBondContact N-O 3.01Å; D1986-D2011 VanDerWaalsContact N-O 3.09Å
1987	S	21.1	Very low	19.4	Very low	93 Å²	93	123.9 Å²	123.9	65%	0.65	64%	0.641	S	S	*	*			trans	86.8	150.7	153	76.3	0	0	0	0	124.4	D2011	S1987-D2011 PolarHBondContact N-OD2 2.69Å
1988	E	19.4	Very low	19.4	Very low	157 Å²	157	127.5 Å²	127.5	73%	0.734	65%	0.648	S	S	*	*			trans	-99.2	170.2	-167.4	-55.1	176.3	107.9	0	0	116.2
1989	M	17.9	Very low	19.4	Very low	167 Å²	167	129.9 Å²	129.9	82%	0.823	66%	0.661	S	S	*	*			trans	50.3	99.4	161.4	-84.3	-149.3	174.6	0	0	119
1990	H	18.6	Very low	19.6	Very low	174 Å²	174	131.3 Å²	131.3	81%	0.806	67%	0.669	S	S	*	*				-174.6	-168.2	96.8	-108.5	-12.3	0	0	0	113
1991	K	19.9	Very low	19.8	Very low	187 Å²	187	129.6 Å²	129.6	81%	0.813	66%	0.66	S	S	*	*			trans	-85.8	155.1	-171.6	-61.8	173.7	-179.7	173	0	113.4
1992	S	19.4	Very low	19.8	Very low	103 Å²	103	129.4 Å²	129.4	72%	0.72	66%	0.658	S	S	*	*			trans	74.8	135.9	142.5	58.9	0	0	0	0	122
1993	I	18.2	Very low	19.9	Very low	142 Å²	142	132 Å²	132	73%	0.728	66%	0.661	S	S	*	*			trans	90.3	113.6	146.8	-70.8	157	0	0	0	119.6
1994	E	18.4	Very low	20.2	Very low	123 Å²	123	130.2 Å²	130.2	58%	0.575	66%	0.658	S	S	*	*			trans	66.7	128.3	142.3	-73.3	174.7	-148.2	0	0	125.4	Q2061	E1994-Q2061 PolarHBondContact OE1-NE2 3.34Å
1995	N	19.7	Very low	20.3	Very low	131 Å²	131	126.3 Å²	126.3	70%	0.701	66%	0.662	S	S	*	*			trans	78.3	139.5	135.1	-65.4	-30.8	0	0	0	124.7
1996	T	20	Very low	20.2	Very low	127 Å²	127	128.4 Å²	128.4	78%	0.779	68%	0.676	S	S	*	*			trans	77.6	107.2	147.9	43	0	0	0	0	125.5
1997	S	19.6	Very low	20.3	Very low	106 Å²	106	130.1 Å²	130.1	74%	0.741	69%	0.685	S	S	*	*				72.3	125.4	127.9	65.6	0	0	0	0	127
1998	R	18.4	Very low	20.2	Very low	224 Å²	224	130.7 Å²	130.7	85%	0.845	69%	0.689	S	S	*	*			trans	81.2	112	137.7	-77.4	-178.7	169.6	178.4	-4	124.4
1999	L	22	Very low	20.1	Very low	123 Å²	123	132 Å²	132	64%	0.644	69%	0.693	S	S	*	*				66	152.7	128.6	-128.7	71.1	0	0	0	124.7
2000	D	22.1	Very low	20.3	Very low	128 Å²	128	128.5 Å²	128.5	68%	0.684	67%	0.674	S	S	*	*			trans	83.7	84.2	164.9	-63.6	-7.4	0	0	0	122.3
2001	S	24.3	Very low	20.5	Very low	46 Å²	46	123.5 Å²	123.5	32%	0.322	65%	0.654	S	S	.	*			trans	94.4	115.8	131.1	78.9	0	0	0	0	124
2002	F	20.9	Very low	20.5	Very low	88 Å²	88	118.8 Å²	118.8	39%	0.386	64%	0.644	S	S	.	*			trans	98.3	175.4	141.1	-43.4	138	0	0	0	123.8	V1980 Q1981 S1982 I1983	V1980-F2002 VanDerWaalsContact C-CE2 3.48Å; V1980-F2002 HydrophobicContact CB-CE2 4.44Å; V1980-F2002 HydrophobicContact CG1-CE2 3.89Å; V1980-F2002 HydrophobicContact CG1-CZ 4.34Å; V1980-F2002 WeakPolarHBondContact O-CD2 3.36Å; Q1981-F2002 VanDerWaalsContact CA-CG 3.47Å; S1982-F2002 VanDerWaalsContact CB-CD1 3.5Å; S1982-F2002 WeakPolarHBondContact O-CB 3.4Å; I1983-F2002 HydrophobicContact CD1-CD1 4.08Å; I1983-F2002 HydrophobicContact CD1-CE1 4.36Å; I1983-F2002 HydrophobicContact CG1-CD1 4.25Å
2003	K	22.9	Very low	20.6	Very low	123 Å²	123	119.9 Å²	119.9	54%	0.535	64%	0.64	S	S	.	*			cis	-158.4	-164.8	3	-160	-126.6	153.3	61	0	115.5	Q1981 S1982	Q1981-K2003 HydrophobicContact CB-CB 4.41Å; Q1981-K2003 HydrophobicContact CB-CG 3.47Å; Q1981-K2003 VanDerWaalsContact CB-CG 3.47Å; Q1981-K2003 HydrophobicContact CG-CG 3.93Å; S1982-K2003 WeakPolarHBondContact O-CB 3.31Å
2004	S	23.6	Very low	20.7	Very low	74 Å²	74	118.3 Å²	118.3	52%	0.517	63%	0.633	S	S	.	*			trans	-140.3	146.1	178.4	64.8	0	0	0	0	118.5
2005	G	21.2	Very low	20.8	Very low	72 Å²	72	117 Å²	117	74%	0.742	63%	0.627	S	S	*	*			trans	124.5	135.3	158.8	0	0	0	0	0	119.2
2006	F	17.6	Very low	20.9	Very low	207 Å²	207	117 Å²	117	91%	0.908	63%	0.627	S	S	*	*			trans	63.3	165.6	168.4	-92.6	-90.1	0	0	0	120.5
2007	N	20.3	Very low	20.9	Very low	137 Å²	137	115.6 Å²	115.6	73%	0.733	62%	0.622	S	S	*	*	S	Bend	trans	-37.6	144.4	-174.4	-54.9	-16.4	0	0	0	119.6
2008	S	20.2	Very low	21	Very low	105 Å²	105	113 Å²	113	73%	0.734	60%	0.604	S	S	*	*			trans	9.4	115.6	152.4	60.3	0	0	0	0	120.5
2009	F	17.3	Very low	21.1	Very low	185 Å²	185	106.4 Å²	106.4	81%	0.811	58%	0.583	S	S	*	*				176.2	133.9	124.4	-115.2	-101.5	0	0	0	112
2010	H	22.5	Very low	21	Very low	93 Å²	93	105.7 Å²	105.7	43%	0.431	58%	0.576	S	S	.	*			trans	36.6	127.9	163.5	-81.4	-92.5	0	0	0	124.9
2011	D	21.3	Very low	20.9	Very low	70 Å²	70	104.6 Å²	104.6	37%	0.374	57%	0.574	S	S	.	*			trans	47.9	120.1	143.6	-58.8	-46.8	0	0	0	124.9	R1985 D1986 S1987	R1985-D2011 CarbonylContact C-O 3.55Å; R1985-D2011 WeakPolarHBondContact CA-O 3.49Å; D1986-D2011 PolarHBondContact N-O 3.01Å; D1986-D2011 VanDerWaalsContact N-O 3.09Å; S1987-D2011 PolarHBondContact N-OD2 2.69Å
2012	S	21.2	Very low	20.6	Very low	88 Å²	88	111.1 Å²	111.1	62%	0.615	60%	0.6	S	S	*	*			trans	82.2	159	138.1	77.7	0	0	0	0	122.6
2013	I	21	Very low	20.6	Very low	125 Å²	125	113.9 Å²	113.9	64%	0.641	62%	0.619	S	S	*	*			trans	98.6	115.9	165.2	-56.3	177.3	0	0	0	120.4
2014	N	20.6	Very low	20.6	Very low	109 Å²	109	115.7 Å²	115.7	58%	0.583	63%	0.634	S	S	*	*			trans	22.2	145.3	142.8	-61.5	-13.7	0	0	0	128
2015	H	20.8	Very low	20.4	Very low	97 Å²	97	123 Å²	123	45%	0.449	65%	0.652	S	S	.	*			trans	61.1	113.3	137.4	-78.7	-70.8	0	0	0	124.5
2016	D	20.4	Very low	20.5	Very low	130 Å²	130	124.3 Å²	124.3	70%	0.695	66%	0.656	S	S	*	*			trans	59.6	123.2	136.2	-62.8	-49.2	0	0	0	124.3
2017	S	21.3	Very low	20.7	Very low	97 Å²	97	120 Å²	120	68%	0.678	65%	0.651	S	S	*	*			trans	86.4	162.2	153.3	105.8	0	0	0	0	118
2018	S	22.3	Very low	20.7	Very low	51 Å²	51	121 Å²	121	36%	0.357	66%	0.657	S	S	.	*			cis	-179.5	-172.8	-17.4	48.5	0	0	0	0	114	L1978 L1979	L1978-S2018 VanDerWaalsContact CA-OG 3.27Å; L1978-S2018 WeakPolarHBondContact CA-OG 3.46Å; L1979-S2018 PolarHBondContact N-OG 2.91Å
2019	Q	19.6	Very low	20.7	Very low	87 Å²	87	123.7 Å²	123.7	41%	0.407	66%	0.662	S	S	.	*			trans	85.7	146	-169.7	-60.6	-113.1	-44.4	0	0	115.7	L1978 L1979	L1978-Q2019 VanDerWaalsContact C-CG 3.43Å; L1978-Q2019 HydrophobicContact CB-CB 4.42Å; L1978-Q2019 HydrophobicContact CB-CG 3.71Å; L1978-Q2019 VanDerWaalsContact CD2-N 3.31Å; L1978-Q2019 PolarHBondContact O-NE2 3.43Å; L1979-Q2019 VanDerWaalsContact CA-CG 3.4Å; L1979-Q2019 HydrophobicContact CB-CG 3.43Å; L1979-Q2019 VanDerWaalsContact CB-CG 3.43Å; L1979-Q2019 HydrophobicContact CD2-CG 4.01Å; L1979-Q2019 VanDerWaalsContact CG-CD 3.44Å; L1979-Q2019 HydrophobicContact CG-CG 3.43Å; L1979-Q2019 VanDerWaalsContact CG-CG 3.43Å
2020	H	19.9	Very low	20.9	Very low	107 Å²	107	119.8 Å²	119.8	50%	0.495	66%	0.658	S	S	.	*			cis	-153.3	170.3	-19.3	-141.6	-45.5	0	0	0	107.9	L1978	L1978-H2020 HydrophobicContact CD1-CB 4.44Å; L1978-H2020 WeakPolarHBondContact CD1-ND1 3.2Å
2021	T	19.4	Very low	20.9	Very low	106 Å²	106	124.7 Å²	124.7	65%	0.65	68%	0.678	S	S	*	*			trans	59.7	115.4	157.6	50.9	0	0	0	0	120.6
2022	E	18.8	Very low	21	Very low	182 Å²	182	129 Å²	129	85%	0.85	70%	0.701	S	S	*	*			trans	71.9	155.7	138.1	-59.8	-176.6	147.2	0	0	120.3
2023	D	20.7	Very low	21	Very low	147 Å²	147	133.1 Å²	133.1	79%	0.786	72%	0.715	S	S	*	*			trans	43.7	95.8	177.5	-66.5	-12	0	0	0	119.2
2024	N	22.4	Very low	21.3	Very low	161 Å²	161	132.5 Å²	132.5	86%	0.861	72%	0.719	S	S	*	*				-165.2	144.9	99.5	-107.5	-77.3	0	0	0	115.5
2025	Y	19.8	Very low	21.5	Very low	227 Å²	227	133 Å²	133	89%	0.89	72%	0.721	S	S	*	*			trans	-81.1	122.5	164	-93	-112.4	0	0	0	110.2
2026	A	22.8	Very low	21.7	Very low	100 Å²	100	134.8 Å²	134.8	83%	0.826	73%	0.733	S	S	*	*			trans	-166.4	66.2	155	0	0	0	0	0	111.1	D2028	A2026-D2028 PolarHBondContact O-N 3.22Å
2027	S	22.5	Very low	22.3	Very low	116 Å²	116	132.1 Å²	132.1	81%	0.811	72%	0.718	S	S	*	*			trans	-70.9	117.2	172.8	57.4	0	0	0	0	110.7
2028	D	20.8	Very low	23	Very low	158 Å²	158	132.9 Å²	132.9	85%	0.845	72%	0.721	S	S	*	*			trans	-57.2	168.8	157.7	-102.1	-52.1	0	0	0	111.6	A2026	A2026-D2028 PolarHBondContact O-N 3.22Å
2029	L	20.4	Very low	23.9	Very low	161 Å²	161	133.4 Å²	133.4	84%	0.843	72%	0.719	S	S	*	*			trans	85	112.5	171	-129.6	75.5	0	0	0	118.6
2030	S	20.8	Very low	25.2	Very low	103 Å²	103	131.2 Å²	131.2	72%	0.72	71%	0.711	S	S	*	*	S	Bend	trans	85.5	141.3	157.8	86.2	0	0	0	0	120
2031	K	22.2	Very low	26.3	Very low	196 Å²	196	126.3 Å²	126.3	85%	0.852	69%	0.688	S	S	*	*			trans	63.9	72.7	164.9	-57.8	-180	-175.7	176	0	118
2032	N	24.3	Very low	27.1	Very low	161 Å²	161	125.4 Å²	125.4	86%	0.861	68%	0.675	S	S	*	*			trans	-140.8	109.5	149.1	-94.3	-50.2	0	0	0	110.8
2033	L	20.9	Very low	28.1	Very low	174 Å²	174	118.6 Å²	118.6	91%	0.911	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-90.8	117.1	167.1	-118.9	75.1	0	0	0	108
2034	P	27.1	Very low	29	Very low	112 Å²	112	115.3 Å²	115.3	73%	0.727	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-77.6	140.5	-173.4	29.8	-34.4	0	0	0	112.7	L2036	P2034-L2036 PolarHBondContact O-N 3.43Å
2035	I	24.1	Very low	30	Very low	120 Å²	120	111.2 Å²	111.2	62%	0.615	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-64.1	129.5	175.3	-62	166.4	0	0	0	109.7	D2037	I2035-D2037 PolarHBondContact O-N 2.9Å
2036	L	24.3	Very low	30.6	Very low	134 Å²	134	104.8 Å²	104.8	70%	0.702	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-73.7	118.8	175.1	-77.2	84.4	0	0	0	111.2	P2034 A2043	P2034-L2036 PolarHBondContact O-N 3.43Å; L2036-A2043 HydrophobicContact CD2-CB 4.2Å; L2036-A2043 HydrophobicContact CG-CB 4.05Å
2037	D	34.7	Very low	30.6	Very low	74 Å²	74	110.1 Å²	110.1	40%	0.396	59%	0.585	S	S	.	*	P	Polyproline II helix	trans	-103.1	125.9	162.8	164.8	23.6	0	0	0	108.4	I2035 L2039 N2040	I2035-D2037 PolarHBondContact O-N 2.9Å; D2037-L2039 PolarHBondContact O-N 2.72Å; D2037-L2039 WeakPolarHBondContact OD1-CB 3.3Å; D2037-L2039 PolarHBondContact OD1-N 3.45Å; D2037-N2040 HydrophobicContact CB-CB 4.16Å; D2037-N2040 VanDerWaalsContact O-CB 3.29Å; D2037-N2040 WeakPolarHBondContact O-CB 3.47Å; D2037-N2040 PolarHBondContact O-N 3.19Å
2038	P	36	Very low	30.7	Very low	114 Å²	114	114.4 Å²	114.4	74%	0.74	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.6	-17.1	177.1	27	-35.5	0	0	0	114	N2040	P2038-N2040 VanDerWaalsContact C-N 3.29Å
2039	L	40.8	Very low	30.8	Very low	61 Å²	61	109.4 Å²	109.4	32%	0.319	57%	0.569	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.9	-2.5	174	-62.5	173.6	0	0	0	113.8	D2037 H2192 R2339 L2343	D2037-L2039 PolarHBondContact O-N 2.72Å; D2037-L2039 WeakPolarHBondContact OD1-CB 3.3Å; D2037-L2039 PolarHBondContact OD1-N 3.45Å; L2039-H2192 PolarHBondContact O-CE1 3.5Å; L2039-H2192 VanDerWaalsContact O-CE1 3.29Å; L2039-R2339 PolarHBondContact O-NE 3.31Å; L2039-R2339 PolarHBondContact O-NH2 2.7Å; L2039-L2343 HydrophobicContact CD2-CD1 4.43Å; L2039-L2343 HydrophobicContact CD2-CD2 4.3Å; L2039-L2343 HydrophobicContact CD2-CG 4.4Å
2040	N	46.1	Very low	30.9	Very low	41 Å²	41	107.9 Å²	107.9	22%	0.219	57%	0.569	C	S	.	*			trans	-97.5	102.9	178.9	-177	-2.7	0	0	0	110.8	D2037 P2038 K2042 A2043	D2037-N2040 HydrophobicContact CB-CB 4.16Å; D2037-N2040 VanDerWaalsContact O-CB 3.29Å; D2037-N2040 WeakPolarHBondContact O-CB 3.47Å; D2037-N2040 PolarHBondContact O-N 3.19Å; P2038-N2040 VanDerWaalsContact C-N 3.29Å; N2040-K2042 PolarHBondContact O-N 2.78Å; N2040-K2042 WeakPolarHBondContact OD1-CB 3.45Å; N2040-K2042 PolarHBondContact OD1-N 3.13Å; N2040-K2042 VanDerWaalsContact OD1-N 3.12Å; N2040-A2043 PolarHBondContact O-N 3.33Å
2041	L	42.8	Very low	30.8	Very low	4 Å²	4	110.7 Å²	110.7	2%	0.021	57%	0.57	C	S	.	*	H	α-helix	trans	-59.4	-24.5	-178.8	-94	87.4	0	0	0	113.3	A2043 V2044 Y2045 L2188 H2192 F2338	L2041-A2043 VanDerWaalsContact C-N 3.28Å; L2041-A2043 PolarHBondContact O-N 2.8Å; L2041-V2044 PolarHBondContact O-N 3.04Å; L2041-Y2045 HydrophobicContact CD2-CD2 4.42Å; L2041-Y2045 HydrophobicContact CD2-CE2 4.1Å; L2041-Y2045 HydrophobicContact CG-CE2 4.49Å; L2041-Y2045 PolarHBondContact O-N 2.9Å; L2041-L2188 HydrophobicContact CD2-CB 4.49Å; L2041-L2188 HydrophobicContact CD2-CD2 3.68Å; L2041-L2188 HydrophobicContact CD2-CG 3.6Å; L2041-H2192 HydrophobicContact CB-CB 4.29Å; L2041-H2192 WeakPolarHBondContact CD1-ND1 3.4Å; L2041-H2192 PolarHBondContact N-NE2 2.69Å; L2041-F2338 HydrophobicContact CD1-CD1 3.94Å; L2041-F2338 HydrophobicContact CD1-CE1 3.85Å; L2041-F2338 HydrophobicContact CD2-CD1 4.13Å; L2041-F2338 HydrophobicContact CD2-CE1 3.87Å; L2041-F2338 HydrophobicContact CD2-CZ 4.41Å; L2041-F2338 HydrophobicContact CG-CD1 4.24Å; L2041-F2338 HydrophobicContact CG-CE1 3.76Å
2042	K	36.3	Very low	30.7	Very low	87 Å²	87	109.1 Å²	109.1	38%	0.378	57%	0.57	S	S	.	*	H	α-helix	trans	-60.9	-38.4	176.1	-164.7	-180	-177.3	177.8	0	111.4	N2040 Q2046 F2193	N2040-K2042 PolarHBondContact O-N 2.78Å; N2040-K2042 WeakPolarHBondContact OD1-CB 3.45Å; N2040-K2042 PolarHBondContact OD1-N 3.13Å; N2040-K2042 VanDerWaalsContact OD1-N 3.12Å; K2042-Q2046 VanDerWaalsContact CG-CD 3.45Å; K2042-Q2046 HydrophobicContact CG-CG 3.85Å; K2042-Q2046 WeakPolarHBondContact O-CB 3.23Å; K2042-Q2046 VanDerWaalsContact O-CG 3.29Å; K2042-Q2046 WeakPolarHBondContact O-CG 3.29Å; K2042-Q2046 PolarHBondContact O-N 2.9Å; K2042-F2193 HydrophobicContact CB-CZ 4.49Å; K2042-F2193 HydrophobicContact CD-CE1 4.2Å; K2042-F2193 HydrophobicContact CD-CZ 3.83Å; K2042-F2193 HydrophobicContact CG-CZ 4.11Å
2043	A	39.8	Very low	30.4	Very low	40 Å²	40	108.7 Å²	108.7	33%	0.331	56%	0.56	S	S	.	*	H	α-helix	trans	-72.5	-29.8	178.9	0	0	0	0	0	113	L2036 N2040 L2041	L2036-A2043 HydrophobicContact CD2-CB 4.2Å; L2036-A2043 HydrophobicContact CG-CB 4.05Å; N2040-A2043 PolarHBondContact O-N 3.33Å; L2041-A2043 VanDerWaalsContact C-N 3.28Å; L2041-A2043 PolarHBondContact O-N 2.8Å
2044	V	40.3	Very low	30.3	Very low	78 Å²	78	107.3 Å²	107.3	47%	0.473	55%	0.554	S	S	.	*	H	α-helix	trans	-73.2	-38.2	178.6	-178.9	0	0	0	0	111.6	L2041	L2041-V2044 PolarHBondContact O-N 3.04Å
2045	Y	42.5	Very low	29.9	Very low	75 Å²	75	107.4 Å²	107.4	29%	0.294	55%	0.547	S	S	.	.	H	α-helix	trans	-107.1	-12.9	-172.5	-68.6	-73.2	0	0	0	115.5	L2041 R2047 E2185 V2189 F2338	L2041-Y2045 HydrophobicContact CD2-CD2 4.42Å; L2041-Y2045 HydrophobicContact CD2-CE2 4.1Å; L2041-Y2045 HydrophobicContact CG-CE2 4.49Å; L2041-Y2045 PolarHBondContact O-N 2.9Å; Y2045-R2047 PolarHBondContact O-N 3.38Å; Y2045-R2047 VanDerWaalsContact O-N 3.11Å; Y2045-E2185 HydrophobicContact CD1-CG 3.69Å; Y2045-E2185 VanDerWaalsContact CD1-OE1 3.24Å; Y2045-E2185 WeakPolarHBondContact CD1-OE1 3.37Å; Y2045-E2185 HydrophobicContact CE1-CG 3.57Å; Y2045-E2185 HydrophobicContact CG-CG 4.36Å; Y2045-V2189 HydrophobicContact CD2-CG2 3.88Å; Y2045-V2189 HydrophobicContact CG-CG2 4.27Å; Y2045-F2338 AromaticContact CE2-CZ 3.98Å; Y2045-F2338 HydrophobicContact CE2-CZ 3.98Å
2046	Q	33.5	Very low	29.6	Very low	92 Å²	92	110.3 Å²	110.3	43%	0.43	56%	0.558	S	S	.	*			trans	-85.7	79.3	177.3	-69.2	-160.6	-31.4	0	0	114.2	K2042	K2042-Q2046 VanDerWaalsContact CG-CD 3.45Å; K2042-Q2046 HydrophobicContact CG-CG 3.85Å; K2042-Q2046 WeakPolarHBondContact O-CB 3.23Å; K2042-Q2046 VanDerWaalsContact O-CG 3.29Å; K2042-Q2046 WeakPolarHBondContact O-CG 3.29Å; K2042-Q2046 PolarHBondContact O-N 2.9Å
2047	R	23.1	Very low	29.4	Very low	212 Å²	212	108.6 Å²	108.6	80%	0.8	56%	0.558	S	S	*	*			trans	-101.5	93.4	138.5	-69.6	-168.8	-174.6	-170.8	4.7	108.2	Y2045 C2155	Y2045-R2047 PolarHBondContact O-N 3.38Å; Y2045-R2047 VanDerWaalsContact O-N 3.11Å; R2047-C2155 PolarHBondContact NH1-SG 2.85Å
2048	R	24.3	Very low	28.6	Very low	206 Å²	206	110.7 Å²	110.7	78%	0.777	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-89.2	128.8	173.6	-81.4	-170.2	171.1	-169.2	-1.8	110.4
2049	G	21.8	Very low	27.8	Very low	52 Å²	52	113.6 Å²	113.6	54%	0.536	58%	0.582	S	S	.	*	P	Polyproline II helix	trans	-70.7	161.2	161	0	0	0	0	0	111.5
2050	P	22.8	Very low	26.7	Very low	130 Å²	130	117.7 Å²	117.7	84%	0.844	60%	0.604	S	S	*	*	P	Polyproline II helix	trans	-74.2	162.1	-175.1	31.3	-36.1	0	0	0	113.4
2051	E	18.9	Very low	25.4	Very low	161 Å²	161	122 Å²	122	75%	0.752	62%	0.623	S	S	*	*	P	Polyproline II helix	trans	-75.1	140.1	-177.4	-64	167.1	169.8	0	0	111.7
2052	I	19.9	Very low	24.4	Very low	163 Å²	163	126.8 Å²	126.8	84%	0.836	66%	0.656	S	S	*	*			trans	-109.2	102.9	166.3	-61.3	178.9	0	0	0	107.4
2053	F	18.6	Very low	23.6	Very low	152 Å²	152	128.9 Å²	128.9	67%	0.667	67%	0.672	S	S	*	*			trans	-78.1	134.2	166.9	-96	-98.9	0	0	0	110.4	I2055	F2053-I2055 HydrophobicContact CB-CD1 4.43Å; F2053-I2055 HydrophobicContact CD1-CG1 4.42Å
2054	N	19.3	Very low	22.6	Very low	146 Å²	146	135.7 Å²	135.7	78%	0.781	69%	0.694	S	S	*	*			trans	-156.3	114.3	144.6	-87.8	-30.3	0	0	0	104.8
2055	I	17.5	Very low	21.5	Very low	114 Å²	114	137.5 Å²	137.5	59%	0.585	71%	0.706	S	S	*	*			cis	78.7	128.9	46.7	-57.7	174.3	0	0	0	111.8	F2053	F2053-I2055 HydrophobicContact CB-CD1 4.43Å; F2053-I2055 HydrophobicContact CD1-CG1 4.42Å
2056	E	18.3	Very low	20.4	Very low	180 Å²	180	142.7 Å²	142.7	84%	0.841	73%	0.732	S	S	*	*			trans	67	149.3	171.7	-75.7	163.9	-142.1	0	0	117.8
2057	S	20	Very low	19.6	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	75%	0.746	S	S	*	*			cis	-157.5	170.7	-15.8	53.2	0	0	0	0	110.7
2058	S	18.9	Very low	19.4	Very low	118 Å²	118	139 Å²	139	83%	0.825	75%	0.75	S	S	*	*			trans	-115.6	129.5	174.8	42.9	0	0	0	0	112.1
2059	Q	19.1	Very low	19.1	Very low	175 Å²	175	133.5 Å²	133.5	82%	0.818	75%	0.748	S	S	*	*			trans	-160.5	166.6	179	-72.8	-168	5.4	0	0	108.7
2060	N	18.2	Very low	19	Very low	146 Å²	146	140.1 Å²	140.1	78%	0.781	76%	0.764	S	S	*	*				-156.2	-176.3	-50.1	-142.1	-7.5	0	0	0	108.5
2061	Q	18.7	Very low	19.2	Very low	133 Å²	133	138.5 Å²	138.5	62%	0.621	75%	0.754	S	S	*	*			trans	-69.9	164.3	-163.4	-56.5	166.9	-7.5	0	0	119.1	E1994	E1994-Q2061 PolarHBondContact OE1-NE2 3.34Å
2062	S	20.1	Very low	19.2	Very low	103 Å²	103	138.9 Å²	138.9	72%	0.72	76%	0.76	S	S	*	*			trans	80.7	163.8	147.1	90.7	0	0	0	0	118.8
2063	N	19.9	Very low	19.2	Very low	132 Å²	132	139 Å²	139	71%	0.706	76%	0.756	S	S	*	*			cis	-161.6	152.1	-6.5	-134.7	-26.1	0	0	0	112.6
2064	K	18.7	Very low	19.2	Very low	182 Å²	182	136.1 Å²	136.1	79%	0.791	76%	0.755	S	S	*	*			trans	59.1	170.8	155.6	-76	-176.8	-178.8	-178.7	0	120
2065	T	18.3	Very low	19.2	Very low	117 Å²	117	137.8 Å²	137.8	72%	0.718	76%	0.758	S	S	*	*			cis	-151.1	174.4	-49.9	19.5	0	0	0	0	109.1
2066	E	17.7	Very low	19.2	Very low	183 Å²	183	139 Å²	139	86%	0.855	76%	0.764	S	S	*	*			trans	73.3	164	173.6	-57.1	-178.4	-172.1	0	0	117.1
2067	S	18	Very low	19.2	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	76%	0.759	S	S	*	*				174.6	101.4	-77.5	54.6	0	0	0	0	110.8
2068	S	17.9	Very low	19.1	Very low	124 Å²	124	139.7 Å²	139.7	87%	0.867	77%	0.771	S	S	*	*			trans	170.5	162.7	139.7	46.9	0	0	0	0	113.3
2069	A	17.7	Very low	19.1	Very low	90 Å²	90	138.6 Å²	138.6	74%	0.744	77%	0.769	S	S	*	*			trans	63.8	89	161.9	0	0	0	0	0	120.7
2070	H	21.7	Very low	19.1	Very low	190 Å²	190	137.7 Å²	137.7	88%	0.88	77%	0.769	S	S	*	*				34.7	156.2	111.1	-86.1	-57.6	0	0	0	123.2
2071	P	26.9	Very low	19.2	Very low	97 Å²	97	138.5 Å²	138.5	63%	0.63	77%	0.774	S	S	*	*				-131.5	175	-119.4	43.7	-28.6	0	0	0	116.4
2072	I	18.7	Very low	19.3	Very low	169 Å²	169	137.3 Å²	137.3	87%	0.867	78%	0.78	S	S	*	*			trans	-133.8	155.1	163.8	-65	-177.7	0	0	0	109.2
2073	Q	18.4	Very low	19.4	Very low	165 Å²	165	137.8 Å²	137.8	77%	0.771	78%	0.783	S	S	*	*			trans	-146.7	158.2	-169.7	-84.9	-165.7	-115.8	0	0	112.5
2074	S	19	Very low	19.5	Very low	92 Å²	92	134.7 Å²	134.7	64%	0.643	77%	0.772	S	S	*	*			cis	-176.9	122.5	-24.3	50.4	0	0	0	0	109
2075	E	18.7	Very low	19.9	Very low	180 Å²	180	127.9 Å²	127.9	84%	0.841	75%	0.748	S	S	*	*			trans	-122.5	125.2	-172.1	-91.3	-172.6	165.1	0	0	116.5
2076	I	18.7	Very low	20.1	Very low	139 Å²	139	126.1 Å²	126.1	71%	0.713	75%	0.753	S	S	*	*				58.2	95.8	127.4	-58.9	177.9	0	0	0	119.8
2077	S	18.6	Very low	20.4	Very low	103 Å²	103	122 Å²	122	72%	0.72	74%	0.74	S	S	*	*			trans	55.7	141	132.1	77.2	0	0	0	0	123.7
2078	M	17.2	Very low	20.7	Very low	192 Å²	192	125.7 Å²	125.7	95%	0.946	74%	0.738	S	S	*	*			trans	-60.7	135.6	159.3	-63.1	170.4	165.7	0	0	113
2079	A	18.7	Very low	20.9	Very low	95 Å²	95	131.3 Å²	131.3	79%	0.785	74%	0.74	S	S	*	*			trans	-148	150.4	156.5	0	0	0	0	0	110.7
2080	N	18.9	Very low	21.1	Very low	155 Å²	155	135.4 Å²	135.4	83%	0.829	74%	0.741	S	S	*	*			trans	-75.3	130.1	-177.9	-64.4	-61.6	0	0	0	111.8	S2082	N2080-S2082 PolarHBondContact O-N 3.2Å
2081	N	21.8	Very low	21.2	Very low	163 Å²	163	132.9 Å²	132.9	87%	0.872	73%	0.733	S	S	*	*			trans	-93.8	71.5	166.2	-113.8	-23.6	0	0	0	111.2	S2083	N2081-S2083 PolarHBondContact O-N 3.06Å
2082	S	19.5	Very low	21	Very low	109 Å²	109	136.2 Å²	136.2	76%	0.762	74%	0.74	S	S	*	*			trans	-72.4	75.5	161.7	56	0	0	0	0	109.5	N2080 S2084	N2080-S2082 PolarHBondContact O-N 3.2Å; S2082-S2084 PolarHBondContact O-N 2.81Å
2083	S	22.7	Very low	21.1	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	74%	0.735	S	S	*	*			trans	-64.7	128.2	177.4	60.7	0	0	0	0	110.9	N2081	N2081-S2083 PolarHBondContact O-N 3.06Å
2084	S	22.1	Very low	21.2	Very low	67 Å²	67	135.9 Å²	135.9	47%	0.469	74%	0.737	S	S	.	*			trans	-90.5	150	-167.1	58.2	0	0	0	0	114.1	S2082 S2321	S2082-S2084 PolarHBondContact O-N 2.81Å; S2084-S2321 WeakPolarHBondContact CB-OG 3.11Å
2085	S	26.3	Very low	21.3	Very low	40 Å²	40	138.5 Å²	138.5	28%	0.28	74%	0.743	S	S	.	*			trans	50.6	123	139.6	75.7	0	0	0	0	120.4	V2087 S2321 D2322	S2085-V2087 PolarHBondContact O-N 2.79Å; S2085-S2321 WeakPolarHBondContact CB-O 3.4Å; S2085-D2322 VanDerWaalsContact OG-C 3.26Å; S2085-D2322 WeakPolarHBondContact OG-CA 3.45Å; S2085-D2322 PolarHBondContact OG-O 3.18Å
2086	G	23.2	Very low	21.5	Very low	80 Å²	80	135.9 Å²	135.9	83%	0.825	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-65.9	0.2	170.1	0	0	0	0	0	116.1	R2088	G2086-R2088 VanDerWaalsContact C-N 3.26Å; G2086-R2088 PolarHBondContact O-N 2.98Å
2087	V	24.5	Very low	21.6	Very low	96 Å²	96	135.3 Å²	135.3	58%	0.582	75%	0.749	S	S	*	*	G	3₁₀ helix	trans	-67.7	-20.1	-172.2	-179.4	0	0	0	0	113.3	S2085 D2322	S2085-V2087 PolarHBondContact O-N 2.79Å; V2087-D2322 HydrophobicContact CB-CB 4.04Å; V2087-D2322 HydrophobicContact CG1-CB 4.12Å; V2087-D2322 HydrophobicContact CG2-CB 3.86Å
2088	R	22.8	Very low	21.7	Very low	181 Å²	181	134.8 Å²	134.8	68%	0.683	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-101.4	5.5	-172.4	-101	-166.6	-169.6	-168.7	6.3	117.8	G2086 S2323	G2086-R2088 VanDerWaalsContact C-N 3.26Å; G2086-R2088 PolarHBondContact O-N 2.98Å; R2088-S2323 PolarHBondContact NE-OG 2.91Å; R2088-S2323 PolarHBondContact NH2-OG 3.03Å
2089	R	23	Very low	21.9	Very low	242 Å²	242	134.8 Å²	134.8	91%	0.913	75%	0.752	S	S	*	*	S	Bend	trans	-94.4	2.5	-172.3	-124.9	180	-169	-179.4	3.7	117.7
2090	F	22.5	Very low	21.9	Very low	176 Å²	176	137.3 Å²	137.3	77%	0.772	75%	0.752	S	S	*	*	S	Bend	trans	-117.9	-26.5	-177.2	-143.4	-93.4	0	0	0	116
2091	I	22.7	Very low	21.9	Very low	137 Å²	137	137.6 Å²	137.6	70%	0.703	75%	0.752	S	S	*	*	S	Bend	trans	-89.7	-24.7	-167.5	-65.4	177	0	0	0	113.8	N2093	I2091-N2093 PolarHBondContact O-N 2.81Å
2092	H	22.5	Very low	21.8	Very low	168 Å²	168	139.4 Å²	139.4	78%	0.778	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.6	-5.6	-169.8	-149.6	-64.5	0	0	0	115.5
2093	N	21.9	Very low	21.8	Very low	145 Å²	145	140.1 Å²	140.1	78%	0.775	75%	0.752	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	0.3	-174.1	-77.3	18.3	0	0	0	114.9	I2091	I2091-N2093 PolarHBondContact O-N 2.81Å
2094	F	20.4	Very low	21.6	Very low	181 Å²	181	145 Å²	145	79%	0.794	76%	0.76	S	S	*	*	S	Bend	trans	-127.6	12.2	-173.3	-89.5	-74.6	0	0	0	116
2095	L	20.9	Very low	21.5	Very low	148 Å²	148	145 Å²	145	78%	0.775	77%	0.77	S	S	*	*	S	Bend	trans	-124.7	109.5	171.1	-81.9	165.2	0	0	0	110.2
2096	P	22.7	Very low	21.1	Very low	125 Å²	125	152.7 Å²	152.7	81%	0.812	80%	0.802	S	S	*	*			trans	-63.8	141	177	-23.2	34.6	0	0	0	112.8	A2098	P2096-A2098 PolarHBondContact O-N 3.19Å
2097	S	20.1	Very low	21.1	Very low	126 Å²	126	154.7 Å²	154.7	88%	0.881	80%	0.8	S	S	*	*			trans	-76.6	115.6	179.8	53.9	0	0	0	0	112.7
2098	A	21.3	Very low	21	Very low	93 Å²	93	156.4 Å²	156.4	77%	0.769	81%	0.811	S	S	*	*			trans	-153.1	104.3	165.1	0	0	0	0	0	113.3	P2096	P2096-A2098 PolarHBondContact O-N 3.19Å
2099	M	20.7	Very low	21.1	Very low	192 Å²	192	152.2 Å²	152.2	95%	0.946	81%	0.807	S	S	*	*			trans	62.3	138.5	157.2	-69.4	-170.1	160.9	0	0	122
2100	D	19.4	Very low	21.2	Very low	147 Å²	147	146.8 Å²	146.8	79%	0.786	80%	0.803	S	S	*	*			trans	-63.9	146	166.3	-55.3	-101.9	0	0	0	113.4
2101	L	19.9	Very low	21.3	Very low	161 Å²	161	148.9 Å²	148.9	84%	0.843	81%	0.807	S	S	*	*			trans	-153.4	108.5	151.1	-117.2	163.4	0	0	0	111.2	V2103	L2101-V2103 HydrophobicContact CD2-CG2 4.09Å
2102	K	18.1	Very low	21.3	Very low	201 Å²	201	149.1 Å²	149.1	87%	0.874	81%	0.805	S	S	*	*			trans	-84.3	107.6	173.1	-68.7	176.6	-179.7	173.1	0	110
2103	V	19.6	Very low	21.4	Very low	124 Å²	124	148.3 Å²	148.3	75%	0.752	80%	0.802	S	S	*	*			trans	-136.8	143.2	163.7	-175.3	0	0	0	0	109.3	L2101	L2101-V2103 HydrophobicContact CD2-CG2 4.09Å
2104	F	19.7	Very low	21.5	Very low	215 Å²	215	146.7 Å²	146.7	94%	0.943	80%	0.799	S	S	*	*			trans	-76.2	148.6	-179.1	-74.7	-107.3	0	0	0	112.5
2105	G	19	Very low	21.5	Very low	67 Å²	67	143.4 Å²	143.4	69%	0.691	79%	0.786	S	S	*	*			trans	164.3	126.9	169.3	0	0	0	0	0	110.8	P2107	G2105-P2107 WeakPolarHBondContact O-CD 3.25Å
2106	E	18.9	Very low	21.6	Very low	201 Å²	201	143.5 Å²	143.5	94%	0.939	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72.1	123.2	-176.2	-63.3	-178.7	125.4	0	0	112
2107	P	23.7	Very low	21.6	Very low	122 Å²	122	142.8 Å²	142.8	79%	0.792	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-97.8	133.5	175.9	34.8	-28.4	0	0	0	112.5	G2105	G2105-P2107 WeakPolarHBondContact O-CD 3.25Å
2108	V	22.3	Very low	21.8	Very low	133 Å²	133	144.1 Å²	144.1	81%	0.806	78%	0.776	S	S	*	*	P	Polyproline II helix	trans	-66.7	149.1	174.2	173.6	0	0	0	0	110.9
2109	P	24.3	Very low	22	Very low	92 Å²	92	143.3 Å²	143.3	60%	0.597	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-67.7	140.3	-166.8	-22.9	35.1	0	0	0	115.3	Y2111	P2109-Y2111 PolarHBondContact O-N 3.25Å
2110	P	24.4	Very low	22.3	Very low	128 Å²	128	138.2 Å²	138.2	83%	0.831	74%	0.74	S	S	*	*			trans	-78.5	100.3	178.5	31	-34.2	0	0	0	112.3
2111	Y	25.5	Very low	22.8	Very low	221 Å²	221	138.2 Å²	138.2	87%	0.867	74%	0.735	S	S	*	*			trans	-95.4	70.2	167.2	-81.7	-81.8	0	0	0	111.4	P2109	P2109-Y2111 PolarHBondContact O-N 3.25Å
2112	E	23.3	Very low	23.3	Very low	141 Å²	141	133.8 Å²	133.8	66%	0.659	72%	0.718	S	S	*	*			trans	-150.9	126.7	168	-120.1	167	-123.2	0	0	110.3
2113	H	24.3	Very low	23.9	Very low	152 Å²	152	126.6 Å²	126.6	70%	0.704	69%	0.692	S	S	*	*			trans	-86.9	136.8	176.4	-94.6	-69.8	0	0	0	110
2114	P	22.9	Very low	24.8	Very low	111 Å²	111	123.3 Å²	123.3	72%	0.721	67%	0.67	S	S	*	*			trans	-62.2	144	175.9	26.6	-34.3	0	0	0	111.2	L2116	P2114-L2116 PolarHBondContact O-N 2.75Å; P2114-L2116 VanDerWaalsContact O-N 3.13Å
2115	Q	21.4	Very low	25.6	Very low	111 Å²	111	116.5 Å²	116.5	52%	0.519	64%	0.644	S	S	.	*			trans	-67.2	108.9	-175.3	-65.7	175.2	-24	0	0	110.9	T2117	Q2115-T2117 VanDerWaalsContact C-N 3.35Å; Q2115-T2117 PolarHBondContact O-N 3.45Å
2116	L	22	Very low	26.4	Very low	151 Å²	151	116.4 Å²	116.4	79%	0.791	63%	0.627	S	S	*	*			trans	-74.6	85.1	174	-84.7	165.6	0	0	0	111.2	P2114	P2114-L2116 PolarHBondContact O-N 2.75Å; P2114-L2116 VanDerWaalsContact O-N 3.13Å
2117	T	22.8	Very low	27.1	Very low	109 Å²	109	111.6 Å²	111.6	67%	0.669	61%	0.607	S	S	*	*			trans	-60.2	140	155.7	-3.7	0	0	0	0	109.2	Q2115 C2119	Q2115-T2117 VanDerWaalsContact C-N 3.35Å; Q2115-T2117 PolarHBondContact O-N 3.45Å; T2117-C2119 PolarHBondContact O-N 2.69Å
2118	I	23.7	Very low	27.8	Very low	155 Å²	155	111.1 Å²	111.1	80%	0.795	59%	0.592	S	S	*	*	S	Bend	trans	-76.8	75.2	179.9	-52.8	175.7	0	0	0	108.9
2119	C	25.4	Very low	28.5	Very low	76 Å²	76	113.6 Å²	113.6	51%	0.514	59%	0.587	S	S	.	*			trans	-126.5	34.7	-171.8	-71	0	0	0	0	113	T2117 E2121	T2117-C2119 PolarHBondContact O-N 2.69Å; C2119-E2121 PolarHBondContact O-N 2.64Å
2120	D	28	Very low	29	Very low	85 Å²	85	111.5 Å²	111.5	46%	0.455	57%	0.57	S	S	.	*			trans	-74	112.2	172	-167.8	57.9	0	0	0	109.1	S2122 C2123 I2124	D2120-S2122 VanDerWaalsContact CG-OG 3.25Å; D2120-S2122 PolarHBondContact O-N 2.67Å; D2120-S2122 PolarHBondContact OD1-OG 3.33Å; D2120-S2122 WeakPolarHBondContact OD2-CB 3.28Å; D2120-S2122 PolarHBondContact OD2-OG 3.32Å; D2120-C2123 HydrophobicContact CB-CB 4.06Å; D2120-C2123 PolarHBondContact O-N 3.13Å; D2120-C2123 PolarHBondContact OD2-N 3.09Å; D2120-C2123 PolarHBondContact OD2-SG 3.3Å; D2120-I2124 PolarHBondContact O-N 3.28Å
2121	E	28.9	Very low	29.7	Very low	146 Å²	146	110.9 Å²	110.9	68%	0.682	56%	0.556	S	S	*	*	H	α-helix	trans	-64.1	-29.9	-171.2	-165.1	-178.4	-165.8	0	0	112	C2119 N2125	C2119-E2121 PolarHBondContact O-N 2.64Å; E2121-N2125 WeakPolarHBondContact O-CB 3.5Å; E2121-N2125 VanDerWaalsContact O-CG 3.26Å; E2121-N2125 PolarHBondContact O-N 2.76Å; E2121-N2125 PolarHBondContact O-ND2 2.73Å
2122	S	32	Very low	30.5	Very low	68 Å²	68	103.7 Å²	103.7	48%	0.476	54%	0.536	S	S	.	.	H	α-helix	trans	-57.6	-57	166.9	15.1	0	0	0	0	112	D2120 I2124 N2125 I2126	D2120-S2122 VanDerWaalsContact CG-OG 3.25Å; D2120-S2122 PolarHBondContact O-N 2.67Å; D2120-S2122 PolarHBondContact OD1-OG 3.33Å; D2120-S2122 WeakPolarHBondContact OD2-CB 3.28Å; D2120-S2122 PolarHBondContact OD2-OG 3.32Å; S2122-I2124 VanDerWaalsContact C-N 3.34Å; S2122-I2124 PolarHBondContact O-N 2.96Å; S2122-N2125 PolarHBondContact O-N 3.49Å; S2122-I2126 WeakPolarHBondContact O-CG1 3.23Å; S2122-I2126 PolarHBondContact O-N 3.46Å
2123	C	30.5	Very low	31.2	Very low	50 Å²	50	101.1 Å²	101.1	34%	0.338	53%	0.529	S	S	.	.	H	α-helix	trans	-66.2	-35.4	-179.8	-65.4	0	0	0	0	112.1	D2120 I2126 L2127	D2120-C2123 HydrophobicContact CB-CB 4.06Å; D2120-C2123 PolarHBondContact O-N 3.13Å; D2120-C2123 PolarHBondContact OD2-N 3.09Å; D2120-C2123 PolarHBondContact OD2-SG 3.3Å; C2123-I2126 PolarHBondContact O-N 3.11Å; C2123-L2127 VanDerWaalsContact O-CB 3.28Å; C2123-L2127 WeakPolarHBondContact O-CB 3.25Å; C2123-L2127 VanDerWaalsContact O-CG 3.27Å; C2123-L2127 WeakPolarHBondContact O-CG 3.35Å; C2123-L2127 PolarHBondContact O-N 3.25Å
2124	I	37.2	Very low	31.8	Very low	55 Å²	55	97.4 Å²	97.4	28%	0.282	52%	0.517	S	S	.	.	H	α-helix	trans	-65.9	-39.1	172.6	-74	177.3	0	0	0	111	D2120 S2122 K2128	D2120-I2124 PolarHBondContact O-N 3.28Å; S2122-I2124 VanDerWaalsContact C-N 3.34Å; S2122-I2124 PolarHBondContact O-N 2.96Å; I2124-K2128 HydrophobicContact CG2-CD 3.85Å; I2124-K2128 HydrophobicContact CG2-CG 4.28Å; I2124-K2128 WeakPolarHBondContact O-CB 3.31Å; I2124-K2128 WeakPolarHBondContact O-CG 3.47Å; I2124-K2128 PolarHBondContact O-N 3.35Å
2125	N	37	Very low	32.3	Very low	73 Å²	73	96.7 Å²	96.7	39%	0.39	51%	0.507	S	S	.	.	H	α-helix	trans	-75.9	-26	176.7	-75.8	-31.5	0	0	0	113	E2121 S2122 R2129	E2121-N2125 WeakPolarHBondContact O-CB 3.5Å; E2121-N2125 VanDerWaalsContact O-CG 3.26Å; E2121-N2125 PolarHBondContact O-N 2.76Å; E2121-N2125 PolarHBondContact O-ND2 2.73Å; S2122-N2125 PolarHBondContact O-N 3.49Å; N2125-R2129 VanDerWaalsContact O-CB 3.24Å; N2125-R2129 WeakPolarHBondContact O-CB 3.21Å; N2125-R2129 WeakPolarHBondContact O-CG 3.31Å; N2125-R2129 PolarHBondContact O-N 3.28Å
2126	I	35.1	Very low	33.1	Very low	65 Å²	65	98.7 Å²	98.7	33%	0.333	51%	0.514	S	S	.	.	H	α-helix	trans	-71.8	-45.8	168.5	-69.9	165.6	0	0	0	110.3	S2122 C2123 R2129 I2130 L2157	S2122-I2126 WeakPolarHBondContact O-CG1 3.23Å; S2122-I2126 PolarHBondContact O-N 3.46Å; C2123-I2126 PolarHBondContact O-N 3.11Å; I2126-R2129 CarbonylContact O-C 3.53Å; I2126-R2129 WeakPolarHBondContact O-CB 3.42Å; I2126-R2129 PolarHBondContact O-N 3.08Å; I2126-R2129 VanDerWaalsContact O-N 3.15Å; I2126-I2130 HydrophobicContact CG2-CD1 3.92Å; I2126-I2130 WeakPolarHBondContact O-CG1 3Å; I2126-I2130 PolarHBondContact O-N 2.92Å; I2126-L2157 HydrophobicContact CG2-CD1 4.21Å; I2126-L2157 HydrophobicContact CG2-CG 4.42Å
2127	L	34.8	Very low	33.5	Very low	100 Å²	100	93.8 Å²	93.8	52%	0.524	49%	0.493	S	S	.	.	H	α-helix	trans	-65.1	-44.2	176.1	-74.4	169	0	0	0	111.5	C2123 R2129 I2130 E2131	C2123-L2127 VanDerWaalsContact O-CB 3.28Å; C2123-L2127 WeakPolarHBondContact O-CB 3.25Å; C2123-L2127 VanDerWaalsContact O-CG 3.27Å; C2123-L2127 WeakPolarHBondContact O-CG 3.35Å; C2123-L2127 PolarHBondContact O-N 3.25Å; L2127-R2129 VanDerWaalsContact C-N 3.28Å; L2127-R2129 PolarHBondContact O-N 2.8Å; L2127-I2130 PolarHBondContact O-N 2.95Å; L2127-E2131 WeakPolarHBondContact O-CB 3.23Å; L2127-E2131 PolarHBondContact O-N 2.84Å
2128	K	38.8	Very low	33.9	Very low	111 Å²	111	94.9 Å²	94.9	48%	0.483	49%	0.494	S	S	.	.	H	α-helix	trans	-62.4	-32	170.4	-75.3	174.1	179.9	173.5	0	112.2	I2124 T2132	I2124-K2128 HydrophobicContact CG2-CD 3.85Å; I2124-K2128 HydrophobicContact CG2-CG 4.28Å; I2124-K2128 WeakPolarHBondContact O-CB 3.31Å; I2124-K2128 WeakPolarHBondContact O-CG 3.47Å; I2124-K2128 PolarHBondContact O-N 3.35Å; K2128-T2132 VanDerWaalsContact O-CB 3.26Å; K2128-T2132 WeakPolarHBondContact O-CB 3.43Å; K2128-T2132 VanDerWaalsContact O-CG2 3.25Å; K2128-T2132 WeakPolarHBondContact O-CG2 3.19Å; K2128-T2132 PolarHBondContact O-N 2.58Å; K2128-T2132 PolarHBondContact O-OG1 3.49Å
2129	R	35.5	Very low	34.2	Very low	186 Å²	186	96.2 Å²	96.2	70%	0.702	50%	0.498	S	S	*	.	H	α-helix	trans	-67.5	-47.7	171.2	-94.8	-177.8	161.5	134	-3.2	111.5	N2125 I2126 L2127 T2132 T2133	N2125-R2129 VanDerWaalsContact O-CB 3.24Å; N2125-R2129 WeakPolarHBondContact O-CB 3.21Å; N2125-R2129 WeakPolarHBondContact O-CG 3.31Å; N2125-R2129 PolarHBondContact O-N 3.28Å; I2126-R2129 CarbonylContact O-C 3.53Å; I2126-R2129 WeakPolarHBondContact O-CB 3.42Å; I2126-R2129 PolarHBondContact O-N 3.08Å; I2126-R2129 VanDerWaalsContact O-N 3.15Å; L2127-R2129 VanDerWaalsContact C-N 3.28Å; L2127-R2129 PolarHBondContact O-N 2.8Å; R2129-T2132 PolarHBondContact O-N 3.47Å; R2129-T2132 PolarHBondContact O-OG1 3.3Å; R2129-T2133 WeakPolarHBondContact O-CG2 3.28Å; R2129-T2133 PolarHBondContact O-N 2.97Å; R2129-T2133 PolarHBondContact O-OG1 3.37Å; R2129-T2133 VanDerWaalsContact O-OG1 3.06Å
2130	I	36.3	Very low	34.3	Very low	47 Å²	47	98.8 Å²	98.8	24%	0.241	51%	0.505	C	S	.	.	H	α-helix	trans	-60.5	-49.9	176.8	-68.3	165	0	0	0	109.6	I2126 L2127 T2132 T2133 V2134 L2157	I2126-I2130 HydrophobicContact CG2-CD1 3.92Å; I2126-I2130 WeakPolarHBondContact O-CG1 3Å; I2126-I2130 PolarHBondContact O-N 2.92Å; L2127-I2130 PolarHBondContact O-N 2.95Å; I2130-T2132 PolarHBondContact O-N 3.32Å; I2130-T2133 WeakPolarHBondContact CA-OG1 3.4Å; I2130-T2133 PolarHBondContact O-N 3.02Å; I2130-T2133 PolarHBondContact O-OG1 2.8Å; I2130-V2134 HydrophobicContact CG2-CG2 4.4Å; I2130-V2134 WeakPolarHBondContact O-CB 3.4Å; I2130-V2134 VanDerWaalsContact O-CG2 3.29Å; I2130-V2134 WeakPolarHBondContact O-CG2 3.29Å; I2130-V2134 PolarHBondContact O-N 3.27Å; I2130-L2157 HydrophobicContact CD1-CD1 3.74Å
2131	E	37.3	Very low	34.1	Very low	115 Å²	115	104.1 Å²	104.1	54%	0.537	52%	0.524	S	S	.	.	H	α-helix	trans	-61.4	-39.4	177.3	-174.9	171.6	-129.9	0	0	112.4	L2127 N2135	L2127-E2131 WeakPolarHBondContact O-CB 3.23Å; L2127-E2131 PolarHBondContact O-N 2.84Å; E2131-N2135 WeakPolarHBondContact O-CB 3.15Å; E2131-N2135 PolarHBondContact O-N 3.02Å; E2131-N2135 PolarHBondContact O-ND2 3.3Å
2132	T	43.4	Very low	33.8	Very low	71 Å²	71	103.9 Å²	103.9	44%	0.436	53%	0.527	S	S	.	.	H	α-helix	trans	-76.5	-27.4	173.7	53.4	0	0	0	0	113.6	K2128 R2129 I2130 K2136	K2128-T2132 VanDerWaalsContact O-CB 3.26Å; K2128-T2132 WeakPolarHBondContact O-CB 3.43Å; K2128-T2132 VanDerWaalsContact O-CG2 3.25Å; K2128-T2132 WeakPolarHBondContact O-CG2 3.19Å; K2128-T2132 PolarHBondContact O-N 2.58Å; K2128-T2132 PolarHBondContact O-OG1 3.49Å; R2129-T2132 PolarHBondContact O-N 3.47Å; R2129-T2132 PolarHBondContact O-OG1 3.3Å; I2130-T2132 PolarHBondContact O-N 3.32Å; T2132-K2136 WeakPolarHBondContact O-CB 3.16Å; T2132-K2136 WeakPolarHBondContact O-CG 3.31Å; T2132-K2136 PolarHBondContact O-N 2.95Å
2133	T	37.9	Very low	33.6	Very low	86 Å²	86	107.5 Å²	107.5	53%	0.528	54%	0.54	S	S	.	.	H	α-helix	trans	-71.6	-40.4	169.6	52.7	0	0	0	0	111.8	R2129 I2130 S2137	R2129-T2133 WeakPolarHBondContact O-CG2 3.28Å; R2129-T2133 PolarHBondContact O-N 2.97Å; R2129-T2133 PolarHBondContact O-OG1 3.37Å; R2129-T2133 VanDerWaalsContact O-OG1 3.06Å; I2130-T2133 WeakPolarHBondContact CA-OG1 3.4Å; I2130-T2133 PolarHBondContact O-N 3.02Å; I2130-T2133 PolarHBondContact O-OG1 2.8Å; T2133-S2137 WeakPolarHBondContact O-CB 3.18Å; T2133-S2137 PolarHBondContact O-N 2.9Å
2134	V	35.9	Very low	33.5	Very low	74 Å²	74	111 Å²	111	45%	0.448	57%	0.566	S	S	.	*	H	α-helix	trans	-66.1	-50	174.5	169.8	0	0	0	0	110.3	I2130 K2136 S2137 N2138	I2130-V2134 HydrophobicContact CG2-CG2 4.4Å; I2130-V2134 WeakPolarHBondContact O-CB 3.4Å; I2130-V2134 VanDerWaalsContact O-CG2 3.29Å; I2130-V2134 WeakPolarHBondContact O-CG2 3.29Å; I2130-V2134 PolarHBondContact O-N 3.27Å; V2134-K2136 VanDerWaalsContact C-N 3.3Å; V2134-K2136 PolarHBondContact O-N 2.58Å; V2134-S2137 WeakPolarHBondContact O-CB 3.49Å; V2134-S2137 PolarHBondContact O-N 3.41Å; V2134-S2137 PolarHBondContact O-OG 3.3Å; V2134-N2138 PolarHBondContact O-N 3.2Å
2135	N	34.2	Very low	33.1	Very low	96 Å²	96	113.2 Å²	113.2	51%	0.513	59%	0.585	S	S	.	*	H	α-helix	trans	-67	-28	179.1	-68.7	-19.8	0	0	0	112.9	E2131	E2131-N2135 WeakPolarHBondContact O-CB 3.15Å; E2131-N2135 PolarHBondContact O-N 3.02Å; E2131-N2135 PolarHBondContact O-ND2 3.3Å
2136	K	37.4	Very low	32.7	Very low	153 Å²	153	113.9 Å²	113.9	67%	0.665	59%	0.588	S	S	*	*	H	α-helix	trans	-77	-26.3	169.2	-74.6	178.6	176.6	-173.3	0	113.4	T2132 V2134 N2138 Q2139	T2132-K2136 WeakPolarHBondContact O-CB 3.16Å; T2132-K2136 WeakPolarHBondContact O-CG 3.31Å; T2132-K2136 PolarHBondContact O-N 2.95Å; V2134-K2136 VanDerWaalsContact C-N 3.3Å; V2134-K2136 PolarHBondContact O-N 2.58Å; K2136-N2138 PolarHBondContact O-N 2.8Å; K2136-Q2139 PolarHBondContact O-N 3.15Å; K2136-Q2139 VanDerWaalsContact O-N 3.15Å
2137	S	31.5	Very low	32.3	Very low	48 Å²	48	119.9 Å²	119.9	34%	0.336	61%	0.608	S	S	.	*	H	α-helix	trans	-65.4	-20.4	175.5	74.4	0	0	0	0	113.1	T2133 V2134 Q2139 I2140	T2133-S2137 WeakPolarHBondContact O-CB 3.18Å; T2133-S2137 PolarHBondContact O-N 2.9Å; V2134-S2137 WeakPolarHBondContact O-CB 3.49Å; V2134-S2137 PolarHBondContact O-N 3.41Å; V2134-S2137 PolarHBondContact O-OG 3.3Å; S2137-Q2139 PolarHBondContact O-N 3.12Å; S2137-Q2139 VanDerWaalsContact O-N 3.14Å; S2137-I2140 PolarHBondContact O-N 3.14Å
2138	N	30.5	Very low	32.2	Very low	132 Å²	132	118.4 Å²	118.4	71%	0.706	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.3	-2.7	172	-71.6	-11.6	0	0	0	114.9	V2134 K2136	V2134-N2138 PolarHBondContact O-N 3.2Å; K2136-N2138 PolarHBondContact O-N 2.8Å
2139	Q	30.2	Very low	31.8	Very low	184 Å²	184	121 Å²	121	86%	0.86	61%	0.613	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122.6	3.8	177.9	-74.8	-168.4	-20.5	0	0	114.9	K2136 S2137	K2136-Q2139 PolarHBondContact O-N 3.15Å; K2136-Q2139 VanDerWaalsContact O-N 3.15Å; S2137-Q2139 PolarHBondContact O-N 3.12Å; S2137-Q2139 VanDerWaalsContact O-N 3.14Å
2140	I	26.9	Very low	31.6	Very low	130 Å²	130	116 Å²	116	67%	0.667	60%	0.599	S	S	*	*	S	Bend	trans	-119	123.8	178.3	-58.4	-179.5	0	0	0	108.7	S2137 L2142	S2137-I2140 PolarHBondContact O-N 3.14Å; I2140-L2142 PolarHBondContact O-N 3.04Å
2141	K	25	Very low	31.4	Very low	197 Å²	197	116 Å²	116	86%	0.857	60%	0.604	S	S	*	*			trans	-56	129.2	-179.2	-72.2	-169.2	174.6	-169.2	0	110.1	N2143	K2141-N2143 PolarHBondContact O-N 3.27Å
2142	L	22.9	Very low	31.2	Very low	141 Å²	141	115.9 Å²	115.9	74%	0.738	60%	0.603	S	S	*	*	S	Bend	trans	-83.3	51	-154.2	-146	153.1	0	0	0	114	I2140	I2140-L2142 PolarHBondContact O-N 3.04Å
2143	N	26.5	Very low	30.7	Very low	143 Å²	143	115.1 Å²	115.1	77%	0.765	60%	0.601	S	S	*	*	S	Bend	trans	-108.3	132.2	167.2	-73.2	-19	0	0	0	108.5	K2141	K2141-N2143 PolarHBondContact O-N 3.27Å
2144	S	29.3	Very low	30.5	Very low	125 Å²	125	114.8 Å²	114.8	87%	0.874	60%	0.595	S	S	*	*			trans	56.4	86.5	-167.3	63.7	0	0	0	0	114.6
2145	C	28.1	Very low	30.3	Very low	101 Å²	101	112.7 Å²	112.7	68%	0.682	58%	0.583	S	S	*	*			trans	-105.4	119.9	160.2	-168	0	0	0	0	108.4	Y2147	C2145-Y2147 PolarHBondContact O-N 3Å
2146	D	28.6	Very low	30.1	Very low	86 Å²	86	114.7 Å²	114.7	46%	0.46	59%	0.589	S	S	.	*			trans	-65.2	88.7	-173.1	-84.9	-31.9	0	0	0	112.5	S2148 R2149 L2150	D2146-S2148 PolarHBondContact O-N 3.45Å; D2146-S2148 VanDerWaalsContact O-N 3.17Å; D2146-R2149 HydrophobicContact CB-CB 4.18Å; D2146-R2149 HydrophobicContact CB-CG 4.36Å; D2146-R2149 PolarHBondContact O-N 3.39Å; D2146-R2149 IonicContact OD2-NH1 2.82Å; D2146-R2149 PolarHBondContact OD2-NH1 3.27Å; D2146-L2150 PolarHBondContact O-N 3.12Å
2147	Y	27.7	Very low	29.6	Very low	191 Å²	191	111 Å²	111	75%	0.749	58%	0.577	S	S	*	*	H	α-helix	trans	-58.2	-28.5	173.7	-156.2	-86.3	0	0	0	111.9	C2145 S2151	C2145-Y2147 PolarHBondContact O-N 3Å; Y2147-S2151 VanDerWaalsContact O-CB 3.22Å; Y2147-S2151 WeakPolarHBondContact O-CB 3.45Å; Y2147-S2151 PolarHBondContact O-N 3.06Å; Y2147-S2151 PolarHBondContact O-OG 3.29Å
2148	S	32.2	Very low	29.6	Very low	69 Å²	69	115 Å²	115	48%	0.483	59%	0.593	S	S	.	*	H	α-helix	trans	-54.2	-59.6	172.2	52.3	0	0	0	0	112.1	D2146 L2150 S2151 E2152	D2146-S2148 PolarHBondContact O-N 3.45Å; D2146-S2148 VanDerWaalsContact O-N 3.17Å; S2148-L2150 PolarHBondContact O-N 2.75Å; S2148-S2151 PolarHBondContact O-N 3.36Å; S2148-S2151 PolarHBondContact O-OG 3.36Å; S2148-E2152 PolarHBondContact O-N 3.43Å
2149	R	29.8	Very low	29.5	Very low	167 Å²	167	114.7 Å²	114.7	63%	0.63	59%	0.591	S	S	*	*	H	α-helix	trans	-65.2	-35.7	-178.5	-77	176.1	162	160.2	-7.7	113.3	D2146 S2153	D2146-R2149 HydrophobicContact CB-CB 4.18Å; D2146-R2149 HydrophobicContact CB-CG 4.36Å; D2146-R2149 PolarHBondContact O-N 3.39Å; D2146-R2149 IonicContact OD2-NH1 2.82Å; D2146-R2149 PolarHBondContact OD2-NH1 3.27Å; R2149-S2153 WeakPolarHBondContact O-CB 3.33Å; R2149-S2153 PolarHBondContact O-N 3.44Å; R2149-S2153 PolarHBondContact O-OG 3.06Å
2150	L	31.7	Very low	29.5	Very low	79 Å²	79	109.3 Å²	109.3	41%	0.414	58%	0.578	S	S	.	*	H	α-helix	trans	-67.1	-44	174.1	-170.2	66.9	0	0	0	110.7	D2146 S2148 E2152 S2153 I2154	D2146-L2150 PolarHBondContact O-N 3.12Å; S2148-L2150 PolarHBondContact O-N 2.75Å; L2150-E2152 VanDerWaalsContact C-N 3.34Å; L2150-E2152 PolarHBondContact O-N 3.25Å; L2150-S2153 PolarHBondContact O-N 3.08Å; L2150-I2154 HydrophobicContact CD1-CD1 4.24Å; L2150-I2154 HydrophobicContact CD2-CD1 4.46Å; L2150-I2154 HydrophobicContact CG-CD1 3.88Å; L2150-I2154 WeakPolarHBondContact O-CB 3.41Å; L2150-I2154 VanDerWaalsContact O-CG1 3.29Å; L2150-I2154 WeakPolarHBondContact O-CG1 3.46Å; L2150-I2154 PolarHBondContact O-N 3.2Å
2151	S	33.3	Very low	30.2	Very low	47 Å²	47	107.1 Å²	107.1	33%	0.329	57%	0.565	S	S	.	*	H	α-helix	trans	-63.3	-37.5	176.1	78.8	0	0	0	0	112.5	Y2147 S2148 I2154 C2155	Y2147-S2151 VanDerWaalsContact O-CB 3.22Å; Y2147-S2151 WeakPolarHBondContact O-CB 3.45Å; Y2147-S2151 PolarHBondContact O-N 3.06Å; Y2147-S2151 PolarHBondContact O-OG 3.29Å; S2148-S2151 PolarHBondContact O-N 3.36Å; S2148-S2151 PolarHBondContact O-OG 3.36Å; S2151-I2154 PolarHBondContact O-N 3.37Å; S2151-C2155 VanDerWaalsContact O-CB 3.22Å; S2151-C2155 WeakPolarHBondContact O-CB 3.5Å; S2151-C2155 PolarHBondContact O-N 3.31Å; S2151-C2155 PolarHBondContact O-SG 2.95Å
2152	E	32.7	Very low	31.3	Very low	114 Å²	114	99.2 Å²	99.2	53%	0.533	53%	0.534	S	S	.	.	H	α-helix	trans	-68.5	-42.1	177.8	-169.6	167.9	-135	0	0	111.6	S2148 L2150 C2155 Q2156	S2148-E2152 PolarHBondContact O-N 3.43Å; L2150-E2152 VanDerWaalsContact C-N 3.34Å; L2150-E2152 PolarHBondContact O-N 3.25Å; E2152-C2155 PolarHBondContact O-N 3.39Å; E2152-Q2156 PolarHBondContact O-N 3.4Å
2153	S	32.1	Very low	33	Very low	54 Å²	54	99 Å²	99	38%	0.378	53%	0.533	S	S	.	.	H	α-helix	trans	-65.9	-41.2	175.1	-55.1	0	0	0	0	112.2	R2149 L2150 Q2156 L2157	R2149-S2153 WeakPolarHBondContact O-CB 3.33Å; R2149-S2153 PolarHBondContact O-N 3.44Å; R2149-S2153 PolarHBondContact O-OG 3.06Å; L2150-S2153 PolarHBondContact O-N 3.08Å; S2153-Q2156 PolarHBondContact O-N 3.38Å; S2153-L2157 PolarHBondContact O-N 3.41Å
2154	I	33.7	Very low	35.2	Very low	79 Å²	79	92.9 Å²	92.9	41%	0.405	50%	0.501	S	S	.	.	H	α-helix	trans	-69.7	-36	175	-69.4	172.5	0	0	0	110.8	L2150 S2151 Q2156 L2157 L2158	L2150-I2154 HydrophobicContact CD1-CD1 4.24Å; L2150-I2154 HydrophobicContact CD2-CD1 4.46Å; L2150-I2154 HydrophobicContact CG-CD1 3.88Å; L2150-I2154 WeakPolarHBondContact O-CB 3.41Å; L2150-I2154 VanDerWaalsContact O-CG1 3.29Å; L2150-I2154 WeakPolarHBondContact O-CG1 3.46Å; L2150-I2154 PolarHBondContact O-N 3.2Å; S2151-I2154 PolarHBondContact O-N 3.37Å; I2154-Q2156 VanDerWaalsContact C-N 3.35Å; I2154-Q2156 PolarHBondContact O-N 3.03Å; I2154-L2157 PolarHBondContact O-N 3.04Å; I2154-L2158 HydrophobicContact CG2-CD1 3.86Å; I2154-L2158 HydrophobicContact CG2-CG 4.3Å; I2154-L2158 WeakPolarHBondContact O-CB 3.27Å; I2154-L2158 WeakPolarHBondContact O-CG 3.2Å; I2154-L2158 PolarHBondContact O-N 3.49Å
2155	C	31.2	Very low	37.4	Very low	31 Å²	31	94 Å²	94	21%	0.209	49%	0.487	C	S	.	.	H	α-helix	trans	-64.1	-36.7	172.4	-82.3	0	0	0	0	112.1	R2047 S2151 E2152 L2157 L2158 L2159	R2047-C2155 PolarHBondContact NH1-SG 2.85Å; S2151-C2155 VanDerWaalsContact O-CB 3.22Å; S2151-C2155 WeakPolarHBondContact O-CB 3.5Å; S2151-C2155 PolarHBondContact O-N 3.31Å; S2151-C2155 PolarHBondContact O-SG 2.95Å; E2152-C2155 PolarHBondContact O-N 3.39Å; C2155-L2157 VanDerWaalsContact C-N 3.32Å; C2155-L2157 PolarHBondContact O-N 2.89Å; C2155-L2158 PolarHBondContact O-N 2.82Å; C2155-L2159 WeakPolarHBondContact O-CB 3.35Å; C2155-L2159 VanDerWaalsContact O-CG 3.26Å; C2155-L2159 WeakPolarHBondContact O-CG 3.35Å; C2155-L2159 PolarHBondContact O-N 2.72Å
2156	Q	30.7	Very low	39.8	Very low	137 Å²	137	91.3 Å²	91.3	64%	0.64	47%	0.468	S	S	*	.	H	α-helix	trans	-66.4	-33	172.7	-71.1	-176.3	17.2	0	0	112.6	E2152 S2153 I2154 L2159 A2160	E2152-Q2156 PolarHBondContact O-N 3.4Å; S2153-Q2156 PolarHBondContact O-N 3.38Å; I2154-Q2156 VanDerWaalsContact C-N 3.35Å; I2154-Q2156 PolarHBondContact O-N 3.03Å; Q2156-L2159 CarbonylContact O-C 3.52Å; Q2156-A2160 PolarHBondContact O-N 3.45Å
2157	L	28.1	Very low	42.1	Very low	76 Å²	76	89.6 Å²	89.6	40%	0.398	46%	0.459	S	S	.	.	H	α-helix	trans	-72.9	-33.5	172.1	-82.6	162.5	0	0	0	113.5	I2126 I2130 S2153 I2154 C2155 A2160	I2126-L2157 HydrophobicContact CG2-CD1 4.21Å; I2126-L2157 HydrophobicContact CG2-CG 4.42Å; I2130-L2157 HydrophobicContact CD1-CD1 3.74Å; S2153-L2157 PolarHBondContact O-N 3.41Å; I2154-L2157 PolarHBondContact O-N 3.04Å; C2155-L2157 VanDerWaalsContact C-N 3.32Å; C2155-L2157 PolarHBondContact O-N 2.89Å; L2157-A2160 WeakPolarHBondContact O-CB 3.44Å
2158	L	30	Very low	44	Very low	131 Å²	131	83 Å²	83	69%	0.686	44%	0.436	S	S	*	.	H	α-helix	trans	-79.4	-25.7	175.8	-73	170.1	0	0	0	113.2	I2154 C2155 A2160	I2154-L2158 HydrophobicContact CG2-CD1 3.86Å; I2154-L2158 HydrophobicContact CG2-CG 4.3Å; I2154-L2158 WeakPolarHBondContact O-CB 3.27Å; I2154-L2158 WeakPolarHBondContact O-CG 3.2Å; I2154-L2158 PolarHBondContact O-N 3.49Å; C2155-L2158 PolarHBondContact O-N 2.82Å; L2158-A2160 VanDerWaalsContact C-N 3.31Å
2159	L	29.1	Very low	45.8	Very low	126 Å²	126	90.7 Å²	90.7	66%	0.66	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.2	19.7	172.4	-63.4	171.5	0	0	0	112.1	C2155 Q2156 H2161	C2155-L2159 WeakPolarHBondContact O-CB 3.35Å; C2155-L2159 VanDerWaalsContact O-CG 3.26Å; C2155-L2159 WeakPolarHBondContact O-CG 3.35Å; C2155-L2159 PolarHBondContact O-N 2.72Å; Q2156-L2159 CarbonylContact O-C 3.52Å; L2159-H2161 PolarHBondContact O-N 3.26Å
2160	A	31.1	Very low	48.3	Very low	71 Å²	71	84 Å²	84	59%	0.587	43%	0.43	S	S	*	.			trans	-57	110.6	162	0	0	0	0	0	108.1	Q2156 L2157 L2158	Q2156-A2160 PolarHBondContact O-N 3.45Å; L2157-A2160 WeakPolarHBondContact O-CB 3.44Å; L2158-A2160 VanDerWaalsContact C-N 3.31Å
2161	H	40.7	Very low	50.8	Low	84 Å²	84	80.9 Å²	80.9	39%	0.389	41%	0.414	S	S	.	.			trans	-57.9	147.8	177	-70.1	-112.5	0	0	0	109	L2159 D2163 T2180	L2159-H2161 PolarHBondContact O-N 3.26Å; H2161-D2163 PolarHBondContact O-N 2.63Å; H2161-T2180 PolarHBondContact CE1-O 3.44Å; H2161-T2180 VanDerWaalsContact CE1-O 3.28Å; H2161-T2180 PolarHBondContact ND1-O 2.95Å
2162	P	48.8	Very low	53.4	Low	31 Å²	31	78.7 Å²	78.7	20%	0.201	40%	0.398	C	S	.	.			trans	-58.9	134.3	172.5	25.7	-33.3	0	0	0	109.6	V2164 T2180 I2353 Q2354	P2162-V2164 VanDerWaalsContact C-N 3.27Å; P2162-V2164 HydrophobicContact CG-CG2 4.37Å; P2162-V2164 PolarHBondContact O-N 3.26Å; P2162-T2180 HydrophobicContact CG-CG2 4.03Å; P2162-I2353 HydrophobicContact CG-CG2 4.27Å; P2162-Q2354 HydrophobicContact CB-CG 3.93Å; P2162-Q2354 HydrophobicContact CG-CG 4.14Å
2163	D	57.5	Low	56.2	Low	136 Å²	136	73.3 Å²	73.3	73%	0.727	37%	0.373	S	S	*	.			trans	-68.2	81.3	178.9	-64.1	-57.5	0	0	0	111.1	H2161 Y2165	H2161-D2163 PolarHBondContact O-N 2.63Å; D2163-Y2165 HydrophobicContact CB-CD2 4.46Å; D2163-Y2165 HydrophobicContact CB-CE2 3.85Å; D2163-Y2165 WeakPolarHBondContact O-CD2 3.27Å; D2163-Y2165 PolarHBondContact O-N 2.76Å; D2163-Y2165 VanDerWaalsContact O-N 3.15Å
2164	V	72.4	Confident	58.9	Low	15 Å²	15	70.7 Å²	70.7	9%	0.091	36%	0.355	C	S	.	.			trans	-81.8	92.8	176.7	-174.2	0	0	0	0	109.5	P2162 V2166 S2173 A2176 F2177 T2180 I2353	P2162-V2164 VanDerWaalsContact C-N 3.27Å; P2162-V2164 HydrophobicContact CG-CG2 4.37Å; P2162-V2164 PolarHBondContact O-N 3.26Å; V2164-V2166 PolarHBondContact O-N 2.68Å; V2164-S2173 WeakPolarHBondContact CG1-O 3.27Å; V2164-A2176 HydrophobicContact CG1-CB 3.68Å; V2164-A2176 HydrophobicContact CG2-CB 4.17Å; V2164-F2177 HydrophobicContact CB-CB 4.45Å; V2164-F2177 HydrophobicContact CG1-CB 4.03Å; V2164-T2180 HydrophobicContact CG2-CG2 4.09Å; V2164-I2353 HydrophobicContact CG2-CG2 4.33Å
2165	Y	77	Confident	61.7	Low	148 Å²	148	67 Å²	67	58%	0.58	34%	0.336	S	S	*	.			trans	-69.9	123.6	165.8	-62	-84.5	0	0	0	110.1	D2163	D2163-Y2165 HydrophobicContact CB-CD2 4.46Å; D2163-Y2165 HydrophobicContact CB-CE2 3.85Å; D2163-Y2165 WeakPolarHBondContact O-CD2 3.27Å; D2163-Y2165 PolarHBondContact O-N 2.76Å; D2163-Y2165 VanDerWaalsContact O-N 3.15Å
2166	V	77.6	Confident	64.5	Low	45 Å²	45	65.5 Å²	65.5	27%	0.273	33%	0.326	S	S	.	.			trans	-75.1	136.2	172.3	179.2	0	0	0	0	109.5	V2164 I2174 F2177 F2320 F2327	V2164-V2166 PolarHBondContact O-N 2.68Å; V2166-I2174 HydrophobicContact CG1-CG1 3.78Å; V2166-F2177 HydrophobicContact CG2-CB 3.58Å; V2166-F2177 HydrophobicContact CG2-CD1 4.35Å; V2166-F2177 HydrophobicContact CG2-CD2 4.01Å; V2166-F2177 HydrophobicContact CG2-CG 3.72Å; V2166-F2320 HydrophobicContact CG2-CE2 4.06Å; V2166-F2320 HydrophobicContact CG2-CZ 4.27Å; V2166-F2327 HydrophobicContact CG1-CD1 4.24Å; V2166-F2327 HydrophobicContact CG1-CE1 3.79Å; V2166-F2327 HydrophobicContact CG1-CZ 3.97Å
2167	N	76.4	Confident	67.3	Low	51 Å²	51	62.4 Å²	62.4	27%	0.273	31%	0.311	S	S	.	.			trans	-133.4	116.2	177.5	171.8	11.5	0	0	0	108.4	R2169 E2170 S2173	N2167-R2169 PolarHBondContact O-N 3.11Å; N2167-R2169 PolarHBondContact OD1-N 2.87Å; N2167-R2169 VanDerWaalsContact OD1-N 3.07Å; N2167-E2170 HydrophobicContact CB-CB 4.22Å; N2167-E2170 WeakPolarHBondContact ND2-CG 3.26Å; N2167-E2170 PolarHBondContact ND2-OE1 2.87Å; N2167-E2170 CarbonylContact O-C 3.23Å; N2167-E2170 VanDerWaalsContact O-C 3.24Å; N2167-E2170 WeakPolarHBondContact O-CA 3.36Å; N2167-E2170 PolarHBondContact O-N 2.93Å; N2167-S2173 PolarHBondContact N-OG 2.87Å; N2167-S2173 PolarHBondContact O-OG 2.79Å
2168	D	68.8	Low	70.2	Confident	52 Å²	52	58.8 Å²	58.8	28%	0.278	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.3	-178.5	-63.6	20.2	0	0	0	112.9	T2325 F2327 F2428	D2168-T2325 PolarHBondContact OD2-OG1 3.14Å; D2168-F2327 WeakPolarHBondContact OD1-CE1 3.25Å; D2168-F2327 WeakPolarHBondContact OD1-CZ 3.49Å; D2168-F2428 HydrophobicContact CB-CZ 4.3Å
2169	R	70	Confident	73.1	Confident	230 Å²	230	52.9 Å²	52.9	87%	0.868	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-13.8	174.9	-61.7	-176	176.8	-174.6	-1	114.5	N2167	N2167-R2169 PolarHBondContact O-N 3.11Å; N2167-R2169 PolarHBondContact OD1-N 2.87Å; N2167-R2169 VanDerWaalsContact OD1-N 3.07Å
2170	E	80.7	Confident	75.8	Confident	26 Å²	26	47.9 Å²	47.9	12%	0.121	24%	0.236	C	C	.	.			trans	-124	75.2	177.4	-69.7	179.1	-100.9	0	0	108.8	N2167 T2172 S2173 R2358 C2359	N2167-E2170 HydrophobicContact CB-CB 4.22Å; N2167-E2170 WeakPolarHBondContact ND2-CG 3.26Å; N2167-E2170 PolarHBondContact ND2-OE1 2.87Å; N2167-E2170 CarbonylContact O-C 3.23Å; N2167-E2170 VanDerWaalsContact O-C 3.24Å; N2167-E2170 WeakPolarHBondContact O-CA 3.36Å; N2167-E2170 PolarHBondContact O-N 2.93Å; E2170-T2172 PolarHBondContact O-N 3.12Å; E2170-S2173 VanDerWaalsContact O-CB 3.28Å; E2170-S2173 WeakPolarHBondContact O-CB 3.41Å; E2170-S2173 PolarHBondContact O-N 3.4Å; E2170-S2173 PolarHBondContact O-OG 3.29Å; E2170-R2358 WeakPolarHBondContact OE1-CD 3.19Å; E2170-R2358 IonicContact OE1-CZ 3.73Å; E2170-R2358 IonicContact OE1-NE 2.77Å; E2170-R2358 IonicContact OE1-NH1 2.82Å; E2170-R2358 PolarHBondContact OE1-NH1 3.24Å; E2170-R2358 WeakPolarHBondContact OE2-CA 3.4Å; E2170-R2358 WeakPolarHBondContact OE2-CD 3.21Å; E2170-C2359 PolarHBondContact OE2-N 3.42Å
2171	F	84.5	Confident	78.5	Confident	15 Å²	15	45.9 Å²	45.9	7%	0.066	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-18	-173.9	65.5	-106.6	0	0	0	114.6	S2173 I2174 L2372 M2374 V2426 F2439 V2441	F2171-S2173 PolarHBondContact O-N 2.9Å; F2171-I2174 HydrophobicContact CB-CD1 4.04Å; F2171-I2174 VanDerWaalsContact O-CB 3.24Å; F2171-I2174 WeakPolarHBondContact O-CB 3.21Å; F2171-I2174 PolarHBondContact O-N 3.16Å; F2171-I2174 VanDerWaalsContact O-N 3.15Å; F2171-L2372 HydrophobicContact CE1-CD2 3.86Å; F2171-L2372 HydrophobicContact CZ-CD2 4.28Å; F2171-M2374 HydrophobicContact CD1-SD 4.42Å; F2171-M2374 HydrophobicContact CE1-SD 3.58Å; F2171-M2374 VanDerWaalsContact CE1-SD 3.58Å; F2171-M2374 HydrophobicContact CE2-SD 4.2Å; F2171-M2374 HydrophobicContact CZ-SD 3.44Å; F2171-M2374 WeakPolarHBondContact CZ-SD 3.24Å; F2171-V2426 HydrophobicContact CD2-CG1 3.72Å; F2171-V2426 HydrophobicContact CE2-CG1 4.3Å; F2171-V2426 HydrophobicContact CG-CG1 4.42Å; F2171-F2439 HydrophobicContact CB-CD2 4.44Å; F2171-F2439 AromaticContact CD1-CD2 3.78Å; F2171-F2439 HydrophobicContact CD1-CD2 3.78Å; F2171-F2439 AromaticContact CD1-CE2 3.74Å; F2171-F2439 HydrophobicContact CD1-CE2 3.74Å; F2171-F2439 HydrophobicContact CD1-CG 4.42Å; F2171-F2439 HydrophobicContact CD1-CZ 4.36Å; F2171-F2439 HydrophobicContact CD2-CD2 4.5Å; F2171-F2439 HydrophobicContact CE1-CD2 4.12Å; F2171-F2439 HydrophobicContact CE1-CE2 4.24Å; F2171-F2439 HydrophobicContact CE1-CG 4.32Å; F2171-F2439 AromaticContact CG-CD2 3.99Å; F2171-F2439 HydrophobicContact CG-CD2 3.99Å; F2171-F2439 HydrophobicContact CG-CE2 4.26Å; F2171-V2441 HydrophobicContact CE2-CG1 3.79Å; F2171-V2441 HydrophobicContact CE2-CG2 4.33Å; F2171-V2441 HydrophobicContact CZ-CG1 4.01Å
2172	T	89.4	Confident	80.4	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-65.5	-25.3	173.1	63.1	0	0	0	0	112.8	E2170 I2174 I2175 A2176 L2356 C2359 M2374 I2383	E2170-T2172 PolarHBondContact O-N 3.12Å; T2172-I2174 VanDerWaalsContact C-N 3.29Å; T2172-I2174 PolarHBondContact O-N 3.36Å; T2172-I2175 WeakPolarHBondContact O-CB 3.24Å; T2172-I2175 PolarHBondContact O-N 3.33Å; T2172-I2175 VanDerWaalsContact O-N 3.13Å; T2172-A2176 PolarHBondContact O-N 3.29Å; T2172-L2356 CarbonylContact C-O 3.56Å; T2172-L2356 WeakPolarHBondContact CB-O 3.36Å; T2172-L2356 PolarHBondContact OG1-O 3.27Å; T2172-C2359 HydrophobicContact CG2-CB 3.96Å; T2172-C2359 WeakPolarHBondContact OG1-CB 3.28Å; T2172-C2359 PolarHBondContact OG1-SG 3.19Å; T2172-M2374 HydrophobicContact CG2-SD 4.26Å; T2172-I2383 HydrophobicContact CG2-CD1 4.45Å; T2172-I2383 HydrophobicContact CG2-CG1 4.23Å
2173	S	89.7	Confident	82.1	Confident	1 Å²	1	53 Å²	53	1%	0.007	24%	0.238	C	C	.	.	H	α-helix	trans	-63.4	-34.5	171.6	66.3	0	0	0	0	112	V2164 N2167 E2170 F2171 I2175 A2176 F2177	V2164-S2173 WeakPolarHBondContact CG1-O 3.27Å; N2167-S2173 PolarHBondContact N-OG 2.87Å; N2167-S2173 PolarHBondContact O-OG 2.79Å; E2170-S2173 VanDerWaalsContact O-CB 3.28Å; E2170-S2173 WeakPolarHBondContact O-CB 3.41Å; E2170-S2173 PolarHBondContact O-N 3.4Å; E2170-S2173 PolarHBondContact O-OG 3.29Å; F2171-S2173 PolarHBondContact O-N 2.9Å; S2173-I2175 VanDerWaalsContact C-N 3.3Å; S2173-I2175 PolarHBondContact O-N 3.4Å; S2173-A2176 PolarHBondContact O-N 3.05Å; S2173-F2177 WeakPolarHBondContact O-CB 3.42Å; S2173-F2177 PolarHBondContact O-N 2.85Å
2174	I	89.5	Confident	83.7	Confident	0 Å²	0	46.7 Å²	46.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-61.4	-41.3	172.2	-52.6	167.3	0	0	0	109.9	V2166 F2171 T2172 A2178 F2320 F2327 V2426 F2428	V2166-I2174 HydrophobicContact CG1-CG1 3.78Å; F2171-I2174 HydrophobicContact CB-CD1 4.04Å; F2171-I2174 VanDerWaalsContact O-CB 3.24Å; F2171-I2174 WeakPolarHBondContact O-CB 3.21Å; F2171-I2174 PolarHBondContact O-N 3.16Å; F2171-I2174 VanDerWaalsContact O-N 3.15Å; T2172-I2174 VanDerWaalsContact C-N 3.29Å; T2172-I2174 PolarHBondContact O-N 3.36Å; I2174-A2178 VanDerWaalsContact O-CB 3.3Å; I2174-A2178 WeakPolarHBondContact O-CB 3.35Å; I2174-A2178 PolarHBondContact O-N 2.82Å; I2174-F2320 HydrophobicContact CB-CZ 4.49Å; I2174-F2320 HydrophobicContact CG2-CE1 4.07Å; I2174-F2320 HydrophobicContact CG2-CZ 3.66Å; I2174-F2327 HydrophobicContact CD1-CD1 3.79Å; I2174-F2327 HydrophobicContact CD1-CE1 4.29Å; I2174-F2327 HydrophobicContact CG1-CD1 3.92Å; I2174-F2327 HydrophobicContact CG1-CE1 4.36Å; I2174-F2327 HydrophobicContact CG2-CB 4.11Å; I2174-F2327 HydrophobicContact CG2-CD1 4.4Å; I2174-V2426 HydrophobicContact CB-CG2 3.82Å; I2174-V2426 HydrophobicContact CD1-CG2 4.11Å; I2174-V2426 HydrophobicContact CG2-CG2 3.77Å; I2174-F2428 HydrophobicContact CD1-CD1 4.27Å
2175	I	91.8	Very high	84.2	Confident	0 Å²	0	49 Å²	49	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-67.5	-47.8	177.7	-55	174.1	0	0	0	110.5	T2172 S2173 F2177 A2178 L2179 L2356 F2424 V2426 V2441	T2172-I2175 WeakPolarHBondContact O-CB 3.24Å; T2172-I2175 PolarHBondContact O-N 3.33Å; T2172-I2175 VanDerWaalsContact O-N 3.13Å; S2173-I2175 VanDerWaalsContact C-N 3.3Å; S2173-I2175 PolarHBondContact O-N 3.4Å; I2175-F2177 VanDerWaalsContact C-N 3.32Å; I2175-F2177 PolarHBondContact O-N 2.96Å; I2175-A2178 PolarHBondContact O-N 3.5Å; I2175-L2179 HydrophobicContact CG2-CD1 4.03Å; I2175-L2179 HydrophobicContact CG2-CG 4.48Å; I2175-L2179 WeakPolarHBondContact O-CG 3.26Å; I2175-L2179 PolarHBondContact O-N 3.36Å; I2175-L2356 HydrophobicContact CG2-CD1 4.18Å; I2175-F2424 HydrophobicContact CD1-CB 3.86Å; I2175-F2424 HydrophobicContact CD1-CD2 4.11Å; I2175-F2424 HydrophobicContact CD1-CG 3.98Å; I2175-F2424 HydrophobicContact CG1-CB 4.3Å; I2175-F2424 HydrophobicContact CG1-CG 4.38Å; I2175-F2424 HydrophobicContact CG2-CD1 3.46Å; I2175-F2424 VanDerWaalsContact CG2-CD1 3.46Å; I2175-F2424 HydrophobicContact CG2-CD2 4.04Å; I2175-F2424 HydrophobicContact CG2-CE1 3.51Å; I2175-F2424 HydrophobicContact CG2-CE2 4.09Å; I2175-F2424 HydrophobicContact CG2-CG 3.74Å; I2175-F2424 HydrophobicContact CG2-CZ 3.84Å; I2175-V2426 HydrophobicContact CD1-CB 4.35Å; I2175-V2426 HydrophobicContact CD1-CG1 4.18Å; I2175-V2426 HydrophobicContact CG1-CB 4.07Å; I2175-V2426 HydrophobicContact CG1-CG1 4.39Å; I2175-V2426 HydrophobicContact CG1-CG2 3.91Å; I2175-V2441 HydrophobicContact CD1-CG2 3.78Å
2176	A	90.3	Very high	84.6	Confident	0 Å²	0	49.4 Å²	49.4	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-61.2	-40.3	178.1	0	0	0	0	0	111.8	V2164 T2172 S2173 L2179 T2180 I2353 L2356	V2164-A2176 HydrophobicContact CG1-CB 3.68Å; V2164-A2176 HydrophobicContact CG2-CB 4.17Å; T2172-A2176 PolarHBondContact O-N 3.29Å; S2173-A2176 PolarHBondContact O-N 3.05Å; A2176-L2179 PolarHBondContact O-N 2.88Å; A2176-T2180 PolarHBondContact O-N 3.5Å; A2176-T2180 VanDerWaalsContact O-N 3.12Å; A2176-I2353 HydrophobicContact CB-CG2 4.27Å; A2176-L2356 HydrophobicContact CB-CB 4.03Å
2177	F	89.6	Confident	85	Confident	72 Å²	72	50.1 Å²	50.1	32%	0.316	21%	0.214	S	C	.	.	H	α-helix	trans	-67	-44.6	175	-178.4	-88.2	0	0	0	111.5	V2164 V2166 S2173 I2175 L2179 T2180 T2181 F2320	V2164-F2177 HydrophobicContact CB-CB 4.45Å; V2164-F2177 HydrophobicContact CG1-CB 4.03Å; V2166-F2177 HydrophobicContact CG2-CB 3.58Å; V2166-F2177 HydrophobicContact CG2-CD1 4.35Å; V2166-F2177 HydrophobicContact CG2-CD2 4.01Å; V2166-F2177 HydrophobicContact CG2-CG 3.72Å; S2173-F2177 WeakPolarHBondContact O-CB 3.42Å; S2173-F2177 PolarHBondContact O-N 2.85Å; I2175-F2177 VanDerWaalsContact C-N 3.32Å; I2175-F2177 PolarHBondContact O-N 2.96Å; F2177-L2179 VanDerWaalsContact C-N 3.28Å; F2177-L2179 PolarHBondContact O-N 3.33Å; F2177-T2180 PolarHBondContact O-N 2.88Å; F2177-T2180 VanDerWaalsContact O-N 3.09Å; F2177-T2180 PolarHBondContact O-OG1 2.96Å; F2177-T2181 HydrophobicContact CD1-CG2 4.25Å; F2177-T2181 HydrophobicContact CE1-CG2 4.05Å; F2177-T2181 WeakPolarHBondContact O-CG2 3.28Å; F2177-T2181 PolarHBondContact O-N 3.18Å; F2177-F2320 HydrophobicContact CB-CZ 4.38Å; F2177-F2320 AromaticContact CD1-CD1 4Å; F2177-F2320 HydrophobicContact CD1-CD1 4Å; F2177-F2320 HydrophobicContact CD1-CD2 4.07Å; F2177-F2320 AromaticContact CD1-CE1 3.59Å; F2177-F2320 HydrophobicContact CD1-CE1 3.59Å; F2177-F2320 AromaticContact CD1-CE2 3.66Å; F2177-F2320 HydrophobicContact CD1-CE2 3.66Å; F2177-F2320 HydrophobicContact CD1-CG 4.22Å; F2177-F2320 AromaticContact CD1-CZ 3.39Å; F2177-F2320 HydrophobicContact CD1-CZ 3.39Å; F2177-F2320 HydrophobicContact CE1-CD1 4.03Å; F2177-F2320 AromaticContact CE1-CD2 3.82Å; F2177-F2320 HydrophobicContact CE1-CD2 3.82Å; F2177-F2320 HydrophobicContact CE1-CE1 4.1Å; F2177-F2320 AromaticContact CE1-CE2 3.89Å; F2177-F2320 HydrophobicContact CE1-CE2 3.89Å; F2177-F2320 AromaticContact CE1-CG 3.88Å; F2177-F2320 HydrophobicContact CE1-CG 3.88Å; F2177-F2320 HydrophobicContact CE1-CZ 4.01Å; F2177-F2320 HydrophobicContact CG-CE2 4.45Å; F2177-F2320 HydrophobicContact CG-CZ 4.18Å
2178	A	89.4	Confident	85.5	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56	-44.6	176	0	0	0	0	0	111.4	I2174 I2175 T2180 T2181 Y2184 I2318 F2320 C2329	I2174-A2178 VanDerWaalsContact O-CB 3.3Å; I2174-A2178 WeakPolarHBondContact O-CB 3.35Å; I2174-A2178 PolarHBondContact O-N 2.82Å; I2175-A2178 PolarHBondContact O-N 3.5Å; A2178-T2180 VanDerWaalsContact C-N 3.34Å; A2178-T2180 PolarHBondContact O-N 3.25Å; A2178-T2181 WeakPolarHBondContact O-CB 3.25Å; A2178-T2181 PolarHBondContact O-N 3.23Å; A2178-T2181 VanDerWaalsContact O-N 3.16Å; A2178-T2181 PolarHBondContact O-OG1 2.83Å; A2178-Y2184 WeakPolarHBondContact O-CB 3.27Å; A2178-I2318 HydrophobicContact CB-CB 4.46Å; A2178-I2318 HydrophobicContact CB-CD1 4.09Å; A2178-I2318 HydrophobicContact CB-CG2 4.25Å; A2178-F2320 HydrophobicContact CB-CE1 4.5Å; A2178-C2329 HydrophobicContact CB-CB 3.65Å
2179	L	90.6	Very high	86.2	Confident	8 Å²	8	46.5 Å²	46.5	4%	0.042	20%	0.196	C	C	.	.	H	α-helix	trans	-69.4	-22.9	177.8	-67.4	172.1	0	0	0	114.2	I2175 A2176 F2177 Y2184 V2331 F2352 I2353 L2356 F2424	I2175-L2179 HydrophobicContact CG2-CD1 4.03Å; I2175-L2179 HydrophobicContact CG2-CG 4.48Å; I2175-L2179 WeakPolarHBondContact O-CG 3.26Å; I2175-L2179 PolarHBondContact O-N 3.36Å; A2176-L2179 PolarHBondContact O-N 2.88Å; F2177-L2179 VanDerWaalsContact C-N 3.28Å; F2177-L2179 PolarHBondContact O-N 3.33Å; L2179-Y2184 HydrophobicContact CD2-CD1 3.97Å; L2179-Y2184 HydrophobicContact CD2-CD2 4.1Å; L2179-Y2184 HydrophobicContact CD2-CE1 3.56Å; L2179-Y2184 HydrophobicContact CD2-CE2 3.72Å; L2179-Y2184 HydrophobicContact CD2-CG 4.24Å; L2179-Y2184 VanDerWaalsContact CD2-CZ 3.44Å; L2179-Y2184 WeakPolarHBondContact O-CD1 3.46Å; L2179-V2331 HydrophobicContact CD2-CG2 4.05Å; L2179-F2352 HydrophobicContact CD1-CD1 4.17Å; L2179-F2352 HydrophobicContact CD1-CE1 3.91Å; L2179-I2353 HydrophobicContact CB-CD1 3.75Å; L2179-I2353 HydrophobicContact CB-CG1 3.7Å; L2179-I2353 HydrophobicContact CD1-CG1 4.07Å; L2179-L2356 HydrophobicContact CD1-CD1 4.4Å; L2179-F2424 HydrophobicContact CD1-CE1 4.12Å; L2179-F2424 HydrophobicContact CD1-CZ 4.2Å; L2179-F2424 HydrophobicContact CD2-CE1 4.32Å; L2179-F2424 HydrophobicContact CG-CE1 4.47Å
2180	T	86.5	Confident	86.7	Confident	21 Å²	21	39.2 Å²	39.2	13%	0.129	17%	0.174	C	C	.	.	H	α-helix	trans	-81.9	-11.3	170.1	54.7	0	0	0	0	113.9	H2161 P2162 V2164 A2176 F2177 A2178 I2353	H2161-T2180 PolarHBondContact CE1-O 3.44Å; H2161-T2180 VanDerWaalsContact CE1-O 3.28Å; H2161-T2180 PolarHBondContact ND1-O 2.95Å; P2162-T2180 HydrophobicContact CG-CG2 4.03Å; V2164-T2180 HydrophobicContact CG2-CG2 4.09Å; A2176-T2180 PolarHBondContact O-N 3.5Å; A2176-T2180 VanDerWaalsContact O-N 3.12Å; F2177-T2180 PolarHBondContact O-N 2.88Å; F2177-T2180 VanDerWaalsContact O-N 3.09Å; F2177-T2180 PolarHBondContact O-OG1 2.96Å; A2178-T2180 VanDerWaalsContact C-N 3.34Å; A2178-T2180 PolarHBondContact O-N 3.25Å; T2180-I2353 HydrophobicContact CG2-CG2 3.58Å
2181	T	87.4	Confident	86.6	Confident	28 Å²	28	39 Å²	39	17%	0.172	17%	0.173	C	C	.	.	S	Bend	trans	-67	139.4	-178.9	66.1	0	0	0	0	112.6	F2177 A2178 E2183 Y2184 E2185 I2318	F2177-T2181 HydrophobicContact CD1-CG2 4.25Å; F2177-T2181 HydrophobicContact CE1-CG2 4.05Å; F2177-T2181 WeakPolarHBondContact O-CG2 3.28Å; F2177-T2181 PolarHBondContact O-N 3.18Å; A2178-T2181 WeakPolarHBondContact O-CB 3.25Å; A2178-T2181 PolarHBondContact O-N 3.23Å; A2178-T2181 VanDerWaalsContact O-N 3.16Å; A2178-T2181 PolarHBondContact O-OG1 2.83Å; T2181-E2183 PolarHBondContact O-N 3.24Å; T2181-E2183 VanDerWaalsContact O-N 3.1Å; T2181-Y2184 WeakPolarHBondContact O-CB 3.29Å; T2181-Y2184 PolarHBondContact O-N 2.8Å; T2181-Y2184 PolarHBondContact OG1-N 3.15Å; T2181-E2185 PolarHBondContact O-N 3.39Å; T2181-I2318 HydrophobicContact CG2-CG2 4.41Å
2182	R	81.4	Confident	86.1	Confident	197 Å²	197	38.4 Å²	38.4	74%	0.743	17%	0.171	S	C	*	.	H	α-helix	trans	-59.6	-18.2	166.1	-65.5	-178.1	-178	173.2	0.4	112.8	R2186	R2182-R2186 WeakPolarHBondContact O-CB 3.22Å; R2182-R2186 PolarHBondContact O-N 3.24Å
2183	E	84.3	Confident	85.1	Confident	67 Å²	67	42.6 Å²	42.6	31%	0.313	19%	0.189	S	C	.	.	H	α-helix	trans	-71.5	-41.2	173.1	-161	-169.3	-171.8	0	0	112	T2181 K2187	T2181-E2183 PolarHBondContact O-N 3.24Å; T2181-E2183 VanDerWaalsContact O-N 3.1Å; E2183-K2187 HydrophobicContact CG-CD 4.13Å; E2183-K2187 VanDerWaalsContact O-CB 3.3Å; E2183-K2187 WeakPolarHBondContact O-CB 3.48Å; E2183-K2187 VanDerWaalsContact O-CG 3.32Å; E2183-K2187 WeakPolarHBondContact O-CG 3.38Å; E2183-K2187 PolarHBondContact O-N 3.4Å; E2183-K2187 VanDerWaalsContact OE1-CE 3.32Å; E2183-K2187 WeakPolarHBondContact OE1-CE 3.33Å; E2183-K2187 IonicContact OE1-NZ 2.78Å; E2183-K2187 PolarHBondContact OE1-NZ 3.35Å
2184	Y	90.1	Very high	84	Confident	4 Å²	4	45.8 Å²	45.8	2%	0.016	21%	0.209	C	C	.	.	H	α-helix	trans	-57.8	-53.1	169.8	179.1	-117.7	0	0	0	110.5	A2178 L2179 T2181 R2186 K2187 L2188 I2316 I2318 V2331 A2334	A2178-Y2184 WeakPolarHBondContact O-CB 3.27Å; L2179-Y2184 HydrophobicContact CD2-CD1 3.97Å; L2179-Y2184 HydrophobicContact CD2-CD2 4.1Å; L2179-Y2184 HydrophobicContact CD2-CE1 3.56Å; L2179-Y2184 HydrophobicContact CD2-CE2 3.72Å; L2179-Y2184 HydrophobicContact CD2-CG 4.24Å; L2179-Y2184 VanDerWaalsContact CD2-CZ 3.44Å; L2179-Y2184 WeakPolarHBondContact O-CD1 3.46Å; T2181-Y2184 WeakPolarHBondContact O-CB 3.29Å; T2181-Y2184 PolarHBondContact O-N 2.8Å; T2181-Y2184 PolarHBondContact OG1-N 3.15Å; Y2184-R2186 PolarHBondContact O-N 3.48Å; Y2184-K2187 PolarHBondContact O-N 2.76Å; Y2184-L2188 HydrophobicContact CE1-CD2 4.06Å; Y2184-L2188 HydrophobicContact CE2-CD1 4.4Å; Y2184-L2188 WeakPolarHBondContact O-CB 3.4Å; Y2184-L2188 PolarHBondContact O-N 2.8Å; Y2184-I2316 HydrophobicContact CD2-CB 4.42Å; Y2184-I2316 HydrophobicContact CD2-CD1 4.04Å; Y2184-I2316 HydrophobicContact CD2-CG2 3.95Å; Y2184-I2316 HydrophobicContact CE2-CD1 3.93Å; Y2184-I2318 HydrophobicContact CD2-CD1 4.04Å; Y2184-I2318 HydrophobicContact CG-CD1 4.28Å; Y2184-V2331 HydrophobicContact CD2-CG2 4.24Å; Y2184-V2331 HydrophobicContact CE2-CB 4.31Å; Y2184-V2331 HydrophobicContact CE2-CG1 4.2Å; Y2184-V2331 HydrophobicContact CE2-CG2 4.01Å; Y2184-A2334 HydrophobicContact CE2-CB 4.31Å
2185	E	83.7	Confident	82.6	Confident	65 Å²	65	48 Å²	48	30%	0.304	22%	0.22	S	C	.	.	H	α-helix	trans	-54	-53.1	-179.2	-174.7	-174.2	159.6	0	0	112.3	Y2045 T2181 L2188 V2189	Y2045-E2185 HydrophobicContact CD1-CG 3.69Å; Y2045-E2185 VanDerWaalsContact CD1-OE1 3.24Å; Y2045-E2185 WeakPolarHBondContact CD1-OE1 3.37Å; Y2045-E2185 HydrophobicContact CE1-CG 3.57Å; Y2045-E2185 HydrophobicContact CG-CG 4.36Å; T2181-E2185 PolarHBondContact O-N 3.39Å; E2185-L2188 PolarHBondContact O-N 3.13Å; E2185-V2189 WeakPolarHBondContact O-CG2 3.5Å; E2185-V2189 PolarHBondContact O-N 2.63Å; E2185-V2189 VanDerWaalsContact O-N 3.08Å
2186	R	84.5	Confident	80.7	Confident	156 Å²	156	51.6 Å²	51.6	59%	0.589	24%	0.237	S	C	*	.	H	α-helix	trans	-60	-51.6	178.1	-169.5	-176.2	70.1	-173.2	-3.4	111.2	R2182 Y2184 L2188 V2189 D2190	R2182-R2186 WeakPolarHBondContact O-CB 3.22Å; R2182-R2186 PolarHBondContact O-N 3.24Å; Y2184-R2186 PolarHBondContact O-N 3.48Å; R2186-L2188 PolarHBondContact O-N 2.65Å; R2186-V2189 PolarHBondContact O-N 2.82Å; R2186-V2189 VanDerWaalsContact O-N 3.16Å; R2186-D2190 PolarHBondContact O-N 2.95Å
2187	K	87.7	Confident	78.6	Confident	59 Å²	59	52.9 Å²	52.9	26%	0.257	25%	0.25	S	S	.	.	H	α-helix	trans	-61.4	-30.7	-179.5	-74.4	176.4	172	168.6	0	112.4	E2183 Y2184 L2191 I2316 K2317	E2183-K2187 HydrophobicContact CG-CD 4.13Å; E2183-K2187 VanDerWaalsContact O-CB 3.3Å; E2183-K2187 WeakPolarHBondContact O-CB 3.48Å; E2183-K2187 VanDerWaalsContact O-CG 3.32Å; E2183-K2187 WeakPolarHBondContact O-CG 3.38Å; E2183-K2187 PolarHBondContact O-N 3.4Å; E2183-K2187 VanDerWaalsContact OE1-CE 3.32Å; E2183-K2187 WeakPolarHBondContact OE1-CE 3.33Å; E2183-K2187 IonicContact OE1-NZ 2.78Å; E2183-K2187 PolarHBondContact OE1-NZ 3.35Å; Y2184-K2187 PolarHBondContact O-N 2.76Å; K2187-L2191 VanDerWaalsContact O-CB 3.26Å; K2187-L2191 WeakPolarHBondContact O-CB 3.27Å; K2187-L2191 PolarHBondContact O-N 2.88Å; K2187-I2316 HydrophobicContact CB-CD1 3.97Å; K2187-I2316 HydrophobicContact CB-CG1 4.11Å; K2187-I2316 HydrophobicContact CB-CG2 3.84Å; K2187-I2316 HydrophobicContact CD-CG2 3.85Å; K2187-I2316 HydrophobicContact CG-CG2 4.49Å; K2187-K2317 PolarHBondContact NZ-O 2.85Å
2188	L	86.8	Confident	76.2	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-71.1	-41.4	177.4	-171.5	72.5	0	0	0	111.7	L2041 Y2184 E2185 R2186 H2192 I2316 A2334 F2338	L2041-L2188 HydrophobicContact CD2-CB 4.49Å; L2041-L2188 HydrophobicContact CD2-CD2 3.68Å; L2041-L2188 HydrophobicContact CD2-CG 3.6Å; Y2184-L2188 HydrophobicContact CE1-CD2 4.06Å; Y2184-L2188 HydrophobicContact CE2-CD1 4.4Å; Y2184-L2188 WeakPolarHBondContact O-CB 3.4Å; Y2184-L2188 PolarHBondContact O-N 2.8Å; E2185-L2188 PolarHBondContact O-N 3.13Å; R2186-L2188 PolarHBondContact O-N 2.65Å; L2188-H2192 PolarHBondContact O-N 3.23Å; L2188-H2192 VanDerWaalsContact O-N 3.08Å; L2188-I2316 HydrophobicContact CB-CD1 3.88Å; L2188-I2316 HydrophobicContact CD1-CD1 3.94Å; L2188-A2334 HydrophobicContact CD1-CB 4.08Å; L2188-A2334 WeakPolarHBondContact CD1-O 3.27Å; L2188-F2338 HydrophobicContact CD1-CB 4.22Å; L2188-F2338 HydrophobicContact CD2-CB 4.27Å; L2188-F2338 HydrophobicContact CD2-CD1 4.22Å; L2188-F2338 HydrophobicContact CD2-CD2 3.57Å; L2188-F2338 HydrophobicContact CD2-CE1 4.43Å; L2188-F2338 HydrophobicContact CD2-CE2 3.8Å; L2188-F2338 HydrophobicContact CD2-CG 3.77Å; L2188-F2338 HydrophobicContact CD2-CZ 4.22Å
2189	V	82.2	Confident	73.5	Confident	28 Å²	28	58 Å²	58	17%	0.17	28%	0.284	C	S	.	.	H	α-helix	trans	-65.7	-44	172.3	172.8	0	0	0	0	111.1	Y2045 E2185 R2186 L2191 H2192 F2193	Y2045-V2189 HydrophobicContact CD2-CG2 3.88Å; Y2045-V2189 HydrophobicContact CG-CG2 4.27Å; E2185-V2189 WeakPolarHBondContact O-CG2 3.5Å; E2185-V2189 PolarHBondContact O-N 2.63Å; E2185-V2189 VanDerWaalsContact O-N 3.08Å; R2186-V2189 PolarHBondContact O-N 2.82Å; R2186-V2189 VanDerWaalsContact O-N 3.16Å; V2189-L2191 VanDerWaalsContact C-N 3.34Å; V2189-L2191 PolarHBondContact O-N 2.83Å; V2189-H2192 WeakPolarHBondContact O-CB 3.37Å; V2189-H2192 PolarHBondContact O-N 3.41Å; V2189-F2193 HydrophobicContact CG1-CD2 3.82Å; V2189-F2193 HydrophobicContact CG1-CE2 3.58Å; V2189-F2193 VanDerWaalsContact O-CD2 3.31Å; V2189-F2193 WeakPolarHBondContact O-CD2 3.44Å; V2189-F2193 PolarHBondContact O-N 3.2Å
2190	D	80.1	Confident	70.6	Confident	77 Å²	77	64.3 Å²	64.3	41%	0.412	31%	0.314	S	S	.	.	H	α-helix	trans	-59.5	-43	176.7	-61.4	-29.5	0	0	0	111.8	R2186 F2193 T2194	R2186-D2190 PolarHBondContact O-N 2.95Å; D2190-F2193 PolarHBondContact O-N 3.13Å; D2190-T2194 WeakPolarHBondContact O-CB 3.48Å; D2190-T2194 PolarHBondContact O-N 3.16Å; D2190-T2194 PolarHBondContact O-OG1 2.95Å
2191	L	80.2	Confident	67.8	Low	20 Å²	20	70.6 Å²	70.6	11%	0.105	34%	0.342	C	S	.	.	H	α-helix	trans	-66	-38	177.7	-154	171.8	0	0	0	110.9	K2187 V2189 T2194 L2195 I2316 A2334	K2187-L2191 VanDerWaalsContact O-CB 3.26Å; K2187-L2191 WeakPolarHBondContact O-CB 3.27Å; K2187-L2191 PolarHBondContact O-N 2.88Å; V2189-L2191 VanDerWaalsContact C-N 3.34Å; V2189-L2191 PolarHBondContact O-N 2.83Å; L2191-T2194 WeakPolarHBondContact O-CB 3.43Å; L2191-T2194 PolarHBondContact O-N 3.17Å; L2191-L2195 HydrophobicContact CD2-CD1 3.61Å; L2191-L2195 HydrophobicContact CD2-CG 3.97Å; L2191-L2195 WeakPolarHBondContact O-CG 3.48Å; L2191-L2195 PolarHBondContact O-N 3.36Å; L2191-I2316 HydrophobicContact CD1-CD1 4.21Å; L2191-I2316 HydrophobicContact CD1-CG1 3.92Å; L2191-A2334 HydrophobicContact CD1-CB 4.44Å
2192	H	72.3	Confident	64.8	Low	4 Å²	4	73 Å²	73	2%	0.019	36%	0.36	C	S	.	.	H	α-helix	trans	-63.7	-46.1	175.4	-166.7	79.3	0	0	0	112.7	L2039 L2041 L2188 V2189 T2194 L2195 Q2196 R2339	L2039-H2192 PolarHBondContact O-CE1 3.5Å; L2039-H2192 VanDerWaalsContact O-CE1 3.29Å; L2041-H2192 HydrophobicContact CB-CB 4.29Å; L2041-H2192 WeakPolarHBondContact CD1-ND1 3.4Å; L2041-H2192 PolarHBondContact N-NE2 2.69Å; L2188-H2192 PolarHBondContact O-N 3.23Å; L2188-H2192 VanDerWaalsContact O-N 3.08Å; V2189-H2192 WeakPolarHBondContact O-CB 3.37Å; V2189-H2192 PolarHBondContact O-N 3.41Å; H2192-T2194 VanDerWaalsContact C-N 3.32Å; H2192-T2194 PolarHBondContact O-N 3.34Å; H2192-L2195 PolarHBondContact O-N 3Å; H2192-Q2196 PolarHBondContact CD2-NE2 2.75Å; H2192-Q2196 PolarHBondContact NE2-NE2 3.06Å; H2192-Q2196 PolarHBondContact O-N 3.4Å; H2192-R2339 PolarHBondContact CE1-NH2 2.83Å
2193	F	68.9	Low	62	Low	88 Å²	88	67.6 Å²	67.6	39%	0.386	35%	0.352	S	S	.	.	H	α-helix	trans	-61.5	-40.5	172.9	-80	-66.2	0	0	0	111.9	K2042 V2189 D2190 L2195 Q2196 G2197	K2042-F2193 HydrophobicContact CB-CZ 4.49Å; K2042-F2193 HydrophobicContact CD-CE1 4.2Å; K2042-F2193 HydrophobicContact CD-CZ 3.83Å; K2042-F2193 HydrophobicContact CG-CZ 4.11Å; V2189-F2193 HydrophobicContact CG1-CD2 3.82Å; V2189-F2193 HydrophobicContact CG1-CE2 3.58Å; V2189-F2193 VanDerWaalsContact O-CD2 3.31Å; V2189-F2193 WeakPolarHBondContact O-CD2 3.44Å; V2189-F2193 PolarHBondContact O-N 3.2Å; D2190-F2193 PolarHBondContact O-N 3.13Å; F2193-L2195 VanDerWaalsContact C-N 3.32Å; F2193-L2195 PolarHBondContact O-N 3.01Å; F2193-Q2196 PolarHBondContact O-N 2.88Å; F2193-G2197 PolarHBondContact O-N 2.77Å
2194	T	66	Low	59.1	Low	67 Å²	67	72.7 Å²	72.7	41%	0.411	38%	0.381	S	S	.	.	H	α-helix	trans	-61.5	-39.5	177.7	-57.2	0	0	0	0	112	D2190 L2191 H2192 S2198	D2190-T2194 WeakPolarHBondContact O-CB 3.48Å; D2190-T2194 PolarHBondContact O-N 3.16Å; D2190-T2194 PolarHBondContact O-OG1 2.95Å; L2191-T2194 WeakPolarHBondContact O-CB 3.43Å; L2191-T2194 PolarHBondContact O-N 3.17Å; H2192-T2194 VanDerWaalsContact C-N 3.32Å; H2192-T2194 PolarHBondContact O-N 3.34Å; T2194-S2198 WeakPolarHBondContact O-CB 3.4Å; T2194-S2198 PolarHBondContact O-N 3.2Å
2195	L	60.1	Low	55.9	Low	46 Å²	46	77.9 Å²	77.9	24%	0.241	41%	0.413	C	S	.	.	H	α-helix	trans	-67.2	-47	175.2	-73.4	167.8	0	0	0	111.7	L2191 H2192 F2193 G2197 S2198 L2199	L2191-L2195 HydrophobicContact CD2-CD1 3.61Å; L2191-L2195 HydrophobicContact CD2-CG 3.97Å; L2191-L2195 WeakPolarHBondContact O-CG 3.48Å; L2191-L2195 PolarHBondContact O-N 3.36Å; H2192-L2195 PolarHBondContact O-N 3Å; F2193-L2195 VanDerWaalsContact C-N 3.32Å; F2193-L2195 PolarHBondContact O-N 3.01Å; L2195-G2197 PolarHBondContact O-N 3.38Å; L2195-S2198 PolarHBondContact O-N 3.46Å; L2195-S2198 PolarHBondContact O-OG 2.85Å; L2195-L2199 PolarHBondContact O-N 3.36Å
2196	Q	52.9	Low	53	Low	76 Å²	76	84.1 Å²	84.1	36%	0.355	44%	0.442	S	S	.	.	H	α-helix	trans	-59.9	-45.9	176.6	-70.6	-177.4	-2.2	0	0	112.1	H2192 F2193 S2198 L2199 Q2200	H2192-Q2196 PolarHBondContact CD2-NE2 2.75Å; H2192-Q2196 PolarHBondContact NE2-NE2 3.06Å; H2192-Q2196 PolarHBondContact O-N 3.4Å; F2193-Q2196 PolarHBondContact O-N 2.88Å; Q2196-S2198 VanDerWaalsContact C-N 3.3Å; Q2196-S2198 PolarHBondContact O-N 2.83Å; Q2196-L2199 PolarHBondContact O-N 2.73Å; Q2196-Q2200 PolarHBondContact O-N 2.68Å
2197	G	46.1	Very low	49.9	Very low	27 Å²	27	85.5 Å²	85.5	28%	0.278	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-32.1	176.7	0	0	0	0	0	113.4	F2193 L2195 L2199 Q2200 Q2201	F2193-G2197 PolarHBondContact O-N 2.77Å; L2195-G2197 PolarHBondContact O-N 3.38Å; G2197-L2199 VanDerWaalsContact C-N 3.33Å; G2197-L2199 PolarHBondContact O-N 2.92Å; G2197-Q2200 PolarHBondContact O-N 3.32Å; G2197-Q2200 VanDerWaalsContact O-N 3.17Å; G2197-Q2201 PolarHBondContact O-N 3.37Å
2198	S	40.2	Very low	46.7	Very low	52 Å²	52	85.4 Å²	85.4	36%	0.364	48%	0.477	S	S	.	.	H	α-helix	trans	-68	-30.2	175.7	70.6	0	0	0	0	113.7	T2194 L2195 Q2196 Q2200 Q2201	T2194-S2198 WeakPolarHBondContact O-CB 3.4Å; T2194-S2198 PolarHBondContact O-N 3.2Å; L2195-S2198 PolarHBondContact O-N 3.46Å; L2195-S2198 PolarHBondContact O-OG 2.85Å; Q2196-S2198 VanDerWaalsContact C-N 3.3Å; Q2196-S2198 PolarHBondContact O-N 2.83Å; S2198-Q2200 VanDerWaalsContact C-N 3.32Å; S2198-Q2201 PolarHBondContact O-N 3.2Å
2199	L	32.4	Very low	43.7	Very low	128 Å²	128	93.8 Å²	93.8	67%	0.67	52%	0.516	S	S	*	.	H	α-helix	trans	-73.9	-22	172.2	-82.2	150.6	0	0	0	112.8	L2195 Q2196 G2197 S2202	L2195-L2199 PolarHBondContact O-N 3.36Å; Q2196-L2199 PolarHBondContact O-N 2.73Å; G2197-L2199 VanDerWaalsContact C-N 3.33Å; G2197-L2199 PolarHBondContact O-N 2.92Å; L2199-S2202 PolarHBondContact O-OG 2.94Å
2200	Q	28.6	Very low	41.3	Very low	140 Å²	140	99 Å²	99	65%	0.654	55%	0.55	S	S	*	*	H	α-helix	trans	-82.1	-20.1	174.8	-68.6	178.9	-46	0	0	113	Q2196 G2197 S2198 S2202 S2203	Q2196-Q2200 PolarHBondContact O-N 2.68Å; G2197-Q2200 PolarHBondContact O-N 3.32Å; G2197-Q2200 VanDerWaalsContact O-N 3.17Å; S2198-Q2200 VanDerWaalsContact C-N 3.32Å; Q2200-S2202 PolarHBondContact O-N 3.25Å; Q2200-S2203 WeakPolarHBondContact O-CB 3.25Å; Q2200-S2203 PolarHBondContact O-OG 2.91Å
2201	Q	28.4	Very low	38.5	Very low	153 Å²	153	99.6 Å²	99.6	72%	0.715	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	6.2	174.7	-63.8	-165.5	-66.6	0	0	113.9	G2197 S2198	G2197-Q2201 PolarHBondContact O-N 3.37Å; S2198-Q2201 PolarHBondContact O-N 3.2Å
2202	S	24.1	Very low	35.6	Very low	80 Å²	80	107.4 Å²	107.4	56%	0.559	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-119.9	37.6	169	64.4	0	0	0	0	111.7	L2199 Q2200	L2199-S2202 PolarHBondContact O-OG 2.94Å; Q2200-S2202 PolarHBondContact O-N 3.25Å
2203	S	22.6	Very low	33.2	Very low	82 Å²	82	110.7 Å²	110.7	57%	0.573	64%	0.635	S	S	*	*			trans	-108.7	17.2	-170.2	68.3	0	0	0	0	116.5	Q2200 V2205	Q2200-S2203 WeakPolarHBondContact O-CB 3.25Å; Q2200-S2203 PolarHBondContact O-OG 2.91Å; S2203-V2205 PolarHBondContact O-N 3.31Å
2204	D	22.9	Very low	31	Very low	174 Å²	174	113.9 Å²	113.9	93%	0.93	66%	0.656	S	S	*	*			trans	-76.4	52.2	157.2	-79.7	-39.4	0	0	0	111.2
2205	V	23.7	Very low	29.1	Very low	114 Å²	114	118 Å²	118	69%	0.691	68%	0.68	S	S	*	*			trans	-137.9	87.6	172.8	-175.1	0	0	0	0	107.8	S2203 L2207	S2203-V2205 PolarHBondContact O-N 3.31Å; V2205-L2207 PolarHBondContact O-N 2.94Å
2206	Q	23.3	Very low	27.1	Very low	195 Å²	195	123.6 Å²	123.6	91%	0.911	70%	0.703	S	S	*	*			trans	-63.6	122.8	176.5	-72.7	-174.4	-12.1	0	0	110.7	G2208	Q2206-G2208 VanDerWaalsContact C-N 3.31Å; Q2206-G2208 PolarHBondContact O-N 3.39Å
2207	L	19	Very low	25.6	Very low	185 Å²	185	126.1 Å²	126.1	97%	0.969	72%	0.719	S	S	*	*			trans	-81.8	67.9	-172.5	-169.7	69.7	0	0	0	111.7	V2205	V2205-L2207 PolarHBondContact O-N 2.94Å
2208	G	20.3	Very low	24.3	Very low	58 Å²	58	131.3 Å²	131.3	60%	0.598	74%	0.74	S	S	*	*			trans	-158.2	103.1	-173.2	0	0	0	0	0	117.1	Q2206	Q2206-G2208 VanDerWaalsContact C-N 3.31Å; Q2206-G2208 PolarHBondContact O-N 3.39Å
2209	Q	22.8	Very low	23.3	Very low	176 Å²	176	137.3 Å²	137.3	82%	0.822	76%	0.762	S	S	*	*			trans	71.3	140	163.5	-47.6	-169.3	30.2	0	0	118	A2211	Q2209-A2211 PolarHBondContact O-N 3.45Å
2210	P	33.7	Very low	22.8	Very low	137 Å²	137	137 Å²	137	89%	0.89	77%	0.771	S	S	*	*			trans	-89.9	101.8	-179.9	34.2	-32.2	0	0	0	112.2
2211	A	20.4	Very low	22.3	Very low	90 Å²	90	135.9 Å²	135.9	74%	0.744	77%	0.774	S	S	*	*			trans	-104.3	93.9	179.1	0	0	0	0	0	112.5	Q2209 A2213	Q2209-A2211 PolarHBondContact O-N 3.45Å; A2211-A2213 PolarHBondContact O-N 3.11Å
2212	L	19.9	Very low	22.1	Very low	184 Å²	184	134.8 Å²	134.8	96%	0.963	78%	0.777	S	S	*	*			trans	-78	55.4	168.7	-168.2	121.5	0	0	0	110.8
2213	A	22.1	Very low	21.8	Very low	73 Å²	73	136.8 Å²	136.8	60%	0.603	78%	0.78	S	S	*	*			trans	-163	82.6	-177.8	0	0	0	0	0	113	A2211	A2211-A2213 PolarHBondContact O-N 3.11Å
2214	N	21.2	Very low	21.6	Very low	154 Å²	154	138.6 Å²	138.6	82%	0.824	79%	0.788	S	S	*	*			trans	175.7	78.4	139	-91.6	-17.9	0	0	0	111.2
2215	V	25.8	Very low	21.5	Very low	153 Å²	153	138.6 Å²	138.6	93%	0.927	78%	0.782	S	S	*	*			trans	-117.4	117.4	142.6	176.2	0	0	0	0	105.3
2216	K	18.9	Very low	21.2	Very low	165 Å²	165	140 Å²	140	72%	0.717	79%	0.786	S	S	*	*			trans	-124.2	152.1	176.3	-116.9	-167.9	178	-167.8	0	108.1
2217	D	20.9	Very low	21	Very low	129 Å²	129	138.9 Å²	138.9	69%	0.69	78%	0.783	S	S	*	*			trans	74.3	133.9	161	-48.4	-26.1	0	0	0	118.1
2218	N	19.6	Very low	21.1	Very low	135 Å²	135	135.3 Å²	135.3	72%	0.722	77%	0.773	S	S	*	*			trans	80.9	106	159	-56.6	-6	0	0	0	121.2
2219	E	18.8	Very low	21.1	Very low	178 Å²	178	138.1 Å²	138.1	83%	0.832	78%	0.783	S	S	*	*				57.7	122.4	125	-60.9	171.1	165.4	0	0	118.5
2220	S	21.9	Very low	21.1	Very low	123 Å²	123	134.6 Å²	134.6	86%	0.86	79%	0.785	S	S	*	*			cis	-161.2	-178.9	41.9	48	0	0	0	0	114
2221	V	18.9	Very low	20.5	Very low	116 Å²	116	137.8 Å²	137.8	70%	0.703	79%	0.785	S	S	*	*			trans	-86.7	138.7	-164.2	173.9	0	0	0	0	114.4	I2223	V2221-I2223 HydrophobicContact CG1-CD1 3.59Å; V2221-I2223 HydrophobicContact CG1-CG1 3.86Å
2222	V	22.7	Very low	20.4	Very low	130 Å²	130	139.4 Å²	139.4	79%	0.788	79%	0.789	S	S	*	*			trans	173.9	105.6	135.3	151.2	0	0	0	0	105.9
2223	I	17.7	Very low	20.5	Very low	121 Å²	121	137.8 Å²	137.8	62%	0.621	78%	0.78	S	S	*	*				75.4	113.7	67.1	-62.7	175.8	0	0	0	113	V2221	V2221-I2223 HydrophobicContact CG1-CD1 3.59Å; V2221-I2223 HydrophobicContact CG1-CG1 3.86Å
2224	T	19.3	Very low	20.4	Very low	120 Å²	120	141.6 Å²	141.6	74%	0.736	79%	0.79	S	S	*	*			trans	63.9	146.8	169.2	51.5	0	0	0	0	117.6
2225	E	20.1	Very low	20.5	Very low	175 Å²	175	140.8 Å²	140.8	82%	0.818	78%	0.781	S	S	*	*			cis	-148.3	-174.5	2.3	-137.2	165.5	-140.8	0	0	114.4
2226	N	18	Very low	20.4	Very low	143 Å²	143	141.2 Å²	141.2	77%	0.765	77%	0.771	S	S	*	*			trans	-85.9	162.7	-176.3	-76.2	-74.7	0	0	0	113.6
2227	M	19.4	Very low	20.5	Very low	172 Å²	172	141.3 Å²	141.3	85%	0.847	77%	0.774	S	S	*	*			trans	55.5	124.6	144.5	-72.3	-82.5	177.8	0	0	117.6
2228	S	21.2	Very low	20.7	Very low	109 Å²	109	144.5 Å²	144.5	76%	0.762	78%	0.776	S	S	*	*				173.7	-179.3	69.9	49.6	0	0	0	0	111.9
2229	S	20.4	Very low	20.8	Very low	117 Å²	117	144.3 Å²	144.3	82%	0.818	77%	0.773	S	S	*	*			trans	-75.4	133.1	178.4	56.4	0	0	0	0	114.4
2230	A	23	Very low	20.9	Very low	103 Å²	103	142.5 Å²	142.5	85%	0.851	77%	0.77	S	S	*	*			trans	-111.2	146.6	161.8	0	0	0	0	0	111.2
2231	K	19.8	Very low	21.1	Very low	204 Å²	204	142.9 Å²	142.9	89%	0.887	76%	0.761	S	S	*	*			trans	-151.8	125.6	-173.9	-169.4	-175.2	-175.9	-176.3	0	111.5
2232	C	18.5	Very low	21.2	Very low	124 Å²	124	144.2 Å²	144.2	84%	0.838	76%	0.763	S	S	*	*			trans	77.7	167.4	163.8	-149.1	0	0	0	0	118.2
2233	I	21.6	Very low	21.2	Very low	150 Å²	150	144.4 Å²	144.4	77%	0.769	76%	0.76	S	S	*	*			trans	83.7	84.5	167.2	-45.4	-175.7	0	0	0	118.2
2234	D	21.4	Very low	21.6	Very low	153 Å²	153	145.5 Å²	145.5	82%	0.818	77%	0.767	S	S	*	*				56.3	172.2	106.8	-124.2	-31.2	0	0	0	123.7
2235	E	21.8	Very low	21.6	Very low	137 Å²	137	147.1 Å²	147.1	64%	0.64	77%	0.766	S	S	*	*			trans	-63.8	138.4	-161.9	-67.4	-155.9	127.4	0	0	118.7
2236	K	23.5	Very low	21.6	Very low	162 Å²	162	144 Å²	144	70%	0.704	76%	0.759	S	S	*	*			trans	51.1	102.2	140.3	-59.2	164.7	-168.2	144.6	0	118.4
2237	E	22.3	Very low	21.8	Very low	166 Å²	166	143 Å²	143	78%	0.776	76%	0.763	S	S	*	*				-151.3	127.8	124.8	-120.3	-173.3	154.8	0	0	115.5
2238	R	23.9	Very low	21.8	Very low	197 Å²	197	141.6 Å²	141.6	74%	0.743	76%	0.758	S	S	*	*			trans	33.7	119.8	137.1	-74.8	179.6	153.6	-176.2	-7.9	123
2239	I	23	Very low	21.9	Very low	130 Å²	130	142.2 Å²	142.2	67%	0.667	76%	0.76	S	S	*	*				77.5	134.9	117.2	-65.8	169.3	0	0	0	119.6
2240	N	21.4	Very low	22	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	75%	0.752	S	S	*	*			trans	107	144.4	143.5	-100.8	3.7	0	0	0	122.3
2241	I	24	Very low	22.1	Very low	130 Å²	130	143.1 Å²	143.1	67%	0.667	75%	0.748	S	S	*	*			trans	86.8	104.1	147.9	-74.8	160.7	0	0	0	118.6
2242	L	21	Very low	22.1	Very low	144 Å²	144	138 Å²	138	75%	0.754	73%	0.734	S	S	*	*			trans	55.1	152.1	131.5	-50.3	174.1	0	0	0	119.1
2243	D	24.6	Very low	22.3	Very low	135 Å²	135	138.9 Å²	138.9	72%	0.722	73%	0.73	S	S	*	*			cis	-143.7	175.9	30.4	-79.2	-67.1	0	0	0	114.5
2244	D	24.3	Very low	22.2	Very low	143 Å²	143	139.5 Å²	139.5	77%	0.765	74%	0.735	S	S	*	*			trans	68.5	111.2	150.9	-69.4	-7.7	0	0	0	125.3
2245	E	19.9	Very low	22.1	Very low	154 Å²	154	134.7 Å²	134.7	72%	0.72	72%	0.722	S	S	*	*				70.5	117.9	120.3	-67.8	-71.3	83.2	0	0	124.4
2246	T	21	Very low	22	Very low	109 Å²	109	133.6 Å²	133.6	67%	0.669	73%	0.729	S	S	*	*			trans	63	94.5	139.3	61.9	0	0	0	0	121
2247	S	22.5	Very low	21.8	Very low	123 Å²	123	130.2 Å²	130.2	86%	0.86	73%	0.726	S	S	*	*				176.5	136.1	92.6	44.3	0	0	0	0	112.6
2248	L	18.8	Very low	21.7	Very low	142 Å²	142	131.5 Å²	131.5	74%	0.743	73%	0.729	S	S	*	*			trans	-97.1	148.3	174.2	-90.6	151	0	0	0	109.7	N2250	L2248-N2250 HydrophobicContact CD2-CB 4.31Å
2249	P	22.9	Very low	21.4	Very low	122 Å²	122	131.5 Å²	131.5	79%	0.792	73%	0.734	S	S	*	*				-134.6	136.5	92.7	36	-25.7	0	0	0	115.1
2250	N	22.1	Very low	21.2	Very low	122 Å²	122	129.8 Å²	129.8	65%	0.652	73%	0.734	S	S	*	*			trans	-98.4	151.1	154.5	-69.9	-23.6	0	0	0	108.4	L2248 T2252	L2248-N2250 HydrophobicContact CD2-CB 4.31Å; N2250-T2252 HydrophobicContact CB-CG2 4.26Å
2251	P	26	Very low	21.2	Very low	117 Å²	117	131.7 Å²	131.7	76%	0.76	74%	0.738	S	S	*	*				-123.1	139.8	90.8	4.4	16.9	0	0	0	110.8
2252	T	19.7	Very low	21.2	Very low	97 Å²	97	131.7 Å²	131.7	60%	0.595	74%	0.744	S	S	*	*				72.7	138.8	55	74.7	0	0	0	0	115.8	N2250	N2250-T2252 HydrophobicContact CB-CG2 4.26Å
2253	D	22.1	Very low	21.5	Very low	143 Å²	143	130 Å²	130	77%	0.765	75%	0.745	S	S	*	*			trans	71.9	135.1	157.4	-46	-34	0	0	0	119.6
2254	D	20.7	Very low	21.5	Very low	163 Å²	163	132.1 Å²	132.1	87%	0.872	75%	0.75	S	S	*	*			cis	-154.6	176.4	-25.3	-156.9	-3.9	0	0	0	109.8
2255	G	19.3	Very low	22	Very low	52 Å²	52	133.6 Å²	133.6	54%	0.536	75%	0.752	S	S	.	*			trans	-99	155.4	-166	0	0	0	0	0	118.6
2256	S	18.9	Very low	22.2	Very low	113 Å²	113	135.6 Å²	135.6	79%	0.79	76%	0.762	S	S	*	*			trans	92.9	149.9	141.2	91.3	0	0	0	0	121.6
2257	S	20	Very low	22.7	Very low	92 Å²	92	135.3 Å²	135.3	64%	0.643	76%	0.764	S	S	*	*			trans	83	111.1	141.1	-59.6	0	0	0	0	122.7
2258	K	19.3	Very low	23	Very low	192 Å²	192	136.7 Å²	136.7	84%	0.835	76%	0.762	S	S	*	*			trans	76.4	113.1	131.1	-63.4	173	-177.2	172.2	0	122
2259	K	18.1	Very low	23.3	Very low	198 Å²	198	141.1 Å²	141.1	86%	0.861	77%	0.769	S	S	*	*				56.6	151	121.4	-77.4	-164.2	170.3	-165.3	0	123.8
2260	S	19.1	Very low	23.5	Very low	94 Å²	94	142.7 Å²	142.7	66%	0.657	77%	0.769	S	S	*	*			trans	79.2	98.5	145.8	43.3	0	0	0	0	122.6
2261	E	21.4	Very low	23.6	Very low	181 Å²	181	142 Å²	142	85%	0.846	77%	0.774	S	S	*	*				74.7	157.7	115.8	-70.6	172.3	132.2	0	0	124.4
2262	T	24.1	Very low	23.5	Very low	130 Å²	130	141.3 Å²	141.3	80%	0.798	77%	0.772	S	S	*	*			trans	84.3	98.6	160.7	38.6	0	0	0	0	124.2
2263	S	27	Very low	23.8	Very low	109 Å²	109	139.5 Å²	139.5	76%	0.762	76%	0.763	S	S	*	*				82.6	152.8	118	69.8	0	0	0	0	125.7
2264	Q	24.3	Very low	24.1	Very low	179 Å²	179	135.4 Å²	135.4	84%	0.836	75%	0.746	S	S	*	*			trans	95.3	167.8	162	-57.4	-155.8	-74.7	0	0	120.6
2265	E	34.3	Very low	24.1	Very low	173 Å²	173	130.4 Å²	130.4	81%	0.808	72%	0.724	S	S	*	*			trans	-126.9	161.9	-144.4	-57.3	161.7	107	0	0	114.2
2266	E	25.1	Very low	24.2	Very low	196 Å²	196	134.2 Å²	134.2	92%	0.916	74%	0.736	S	S	*	*			trans	167.2	-165.4	137.8	-90	-152.7	141.3	0	0	113.6
2267	S	30.3	Very low	24.3	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	73%	0.731	S	S	*	*			trans	-137.8	160.3	-150	-58.3	0	0	0	0	119.1
2268	N	28.8	Very low	24.2	Very low	153 Å²	153	134.8 Å²	134.8	82%	0.818	74%	0.735	S	S	*	*			trans	84.2	143.3	145.7	-75.6	-46.1	0	0	0	125.2
2269	R	26	Very low	24.1	Very low	234 Å²	234	132.3 Å²	132.3	88%	0.883	73%	0.73	S	S	*	*			trans	94.7	-175	151.7	-73	171.4	-176.7	-159.9	1.3	122.7
2270	I	27.7	Very low	24.2	Very low	155 Å²	155	132.1 Å²	132.1	80%	0.795	72%	0.724	S	S	*	*			trans	-145.8	144.1	-136.4	-62	148.4	0	0	0	115
2271	S	24.2	Very low	24.4	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	72%	0.72	S	S	*	*			trans	159.3	152.4	140	-73.4	0	0	0	0	120.7
2272	S	24	Very low	24.4	Very low	101 Å²	101	129.1 Å²	129.1	71%	0.706	70%	0.703	S	S	*	*			trans	58.2	157.7	136.9	72.2	0	0	0	0	130.7
2273	S	25.7	Very low	24.1	Very low	59 Å²	59	131.9 Å²	131.9	41%	0.413	70%	0.704	S	S	.	*			trans	84.7	161.9	130.4	61.5	0	0	0	0	127.1	D2281 Q2282	S2273-D2281 WeakPolarHBondContact O-CB 3.26Å; S2273-Q2282 WeakPolarHBondContact O-CA 3.5Å; S2273-Q2282 PolarHBondContact O-N 2.89Å
2274	S	27.1	Very low	23.9	Very low	58 Å²	58	131.4 Å²	131.4	41%	0.406	70%	0.698	S	S	.	*			trans	51.9	140.7	161.1	-17.4	0	0	0	0	122.8	R2280 D2281 Q2282	S2274-R2280 CarbonylContact C-O 3.48Å; S2274-R2280 WeakPolarHBondContact CB-O 3.23Å; S2274-D2281 WeakPolarHBondContact CB-OD2 3.36Å; S2274-D2281 CarbonylContact O-C 3.6Å; S2274-D2281 PolarHBondContact OG-OD2 3.41Å; S2274-Q2282 VanDerWaalsContact O-CA 3.29Å; S2274-Q2282 WeakPolarHBondContact O-CA 3.22Å; S2274-Q2282 WeakPolarHBondContact O-CB 3.49Å; S2274-Q2282 PolarHBondContact O-N 3.24Å
2275	S	21.9	Very low	23.8	Very low	58 Å²	58	128.1 Å²	128.1	41%	0.406	69%	0.692	S	S	.	*			trans	-146	166.5	-161	-51.8	0	0	0	0	119.4	Q2282	S2275-Q2282 PolarHBondContact OG-NE2 3.38Å; S2275-Q2282 PolarHBondContact OG-OE1 2.87Å
2276	V	21.9	Very low	23.1	Very low	131 Å²	131	125.3 Å²	125.3	79%	0.794	69%	0.687	S	S	*	*	S	Bend	trans	76.7	-174.6	166.1	160.9	0	0	0	0	115.3
2277	S	19.5	Very low	23	Very low	97 Å²	97	124.8 Å²	124.8	68%	0.678	69%	0.685	S	S	*	*	S	Bend	trans	-56.6	140.8	173.3	56.2	0	0	0	0	111.8
2278	T	19.4	Very low	22.5	Very low	120 Å²	120	124.8 Å²	124.8	74%	0.736	68%	0.68	S	S	*	*	S	Bend	trans	64.6	121.8	-174.3	70.2	0	0	0	0	113.8
2279	L	16.7	Very low	22.2	Very low	141 Å²	141	126.5 Å²	126.5	74%	0.738	68%	0.683	S	S	*	*	S	Bend	trans	70.5	138.1	-178.6	-50.6	128.8	0	0	0	115.3
2280	R	19.5	Very low	21.9	Very low	194 Å²	194	121.7 Å²	121.7	73%	0.732	68%	0.675	S	S	*	*			trans	39.1	124.8	134.6	-67.9	-178.2	172.7	162.2	-2.8	120.9	S2274	S2274-R2280 CarbonylContact C-O 3.48Å; S2274-R2280 WeakPolarHBondContact CB-O 3.23Å
2281	D	23.4	Very low	21.6	Very low	105 Å²	105	122 Å²	122	56%	0.561	68%	0.676	S	S	*	*			trans	81.2	-161.1	149.7	-30.8	-36.8	0	0	0	119.8	S2273 S2274	S2273-D2281 WeakPolarHBondContact O-CB 3.26Å; S2274-D2281 WeakPolarHBondContact CB-OD2 3.36Å; S2274-D2281 CarbonylContact O-C 3.6Å; S2274-D2281 PolarHBondContact OG-OD2 3.41Å
2282	Q	20.7	Very low	21.4	Very low	106 Å²	106	122 Å²	122	50%	0.495	68%	0.676	S	S	.	*			trans	86.2	103.1	-176.3	-175.5	133.1	86.4	0	0	119.4	S2273 S2274 S2275	S2273-Q2282 WeakPolarHBondContact O-CA 3.5Å; S2273-Q2282 PolarHBondContact O-N 2.89Å; S2274-Q2282 VanDerWaalsContact O-CA 3.29Å; S2274-Q2282 WeakPolarHBondContact O-CA 3.22Å; S2274-Q2282 WeakPolarHBondContact O-CB 3.49Å; S2274-Q2282 PolarHBondContact O-N 3.24Å; S2275-Q2282 PolarHBondContact OG-NE2 3.38Å; S2275-Q2282 PolarHBondContact OG-OE1 2.87Å
2283	K	19.5	Very low	21.3	Very low	189 Å²	189	121.9 Å²	121.9	82%	0.822	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-101.3	133.2	130.9	-81.5	177.6	172.7	174.3	0	110.5
2284	P	21.6	Very low	21.1	Very low	98 Å²	98	123.8 Å²	123.8	64%	0.636	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-80.4	159.5	162.6	33.2	-32.9	0	0	0	111.5
2285	P	23	Very low	20.8	Very low	110 Å²	110	125.6 Å²	125.6	71%	0.714	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-102.5	171.1	-174.3	39.9	-36.1	0	0	0	114.9
2286	T	19.7	Very low	20.8	Very low	114 Å²	114	131 Å²	131	70%	0.699	73%	0.726	S	S	*	*			trans	45.4	111.4	152.6	50.7	0	0	0	0	119.6
2287	H	21.7	Very low	20.7	Very low	186 Å²	186	130.2 Å²	130.2	86%	0.861	72%	0.722	S	S	*	*				-150.9	124	94.5	-113.5	-79.9	0	0	0	111.6
2288	T	20.3	Very low	20.8	Very low	103 Å²	103	132.6 Å²	132.6	63%	0.632	73%	0.733	S	S	*	*			trans	-79.6	138.3	170.1	45.7	0	0	0	0	110.4
2289	H	22.1	Very low	20.8	Very low	188 Å²	188	132.6 Å²	132.6	87%	0.87	74%	0.737	S	S	*	*				-142.7	122.4	129.8	-111.6	-78.4	0	0	0	110
2290	N	21.2	Very low	20.9	Very low	134 Å²	134	134 Å²	134	72%	0.717	74%	0.744	S	S	*	*			trans	-82.9	158.6	176.8	-64.3	-39.7	0	0	0	110.8
2291	I	20.9	Very low	20.9	Very low	161 Å²	161	129.4 Å²	129.4	83%	0.826	74%	0.743	S	S	*	*			trans	148.5	118.5	152.8	-82.6	156.4	0	0	0	106.4
2292	S	20.1	Very low	20.8	Very low	109 Å²	109	130.7 Å²	130.7	76%	0.762	75%	0.754	S	S	*	*			cis	-153.4	-172	-1.3	-104.4	0	0	0	0	111.4
2293	A	22.3	Very low	20.8	Very low	98 Å²	98	131.3 Å²	131.3	81%	0.81	77%	0.768	S	S	*	*			trans	-56.9	168.6	178	0	0	0	0	0	114
2294	S	21	Very low	21	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	76%	0.761	S	S	*	*			cis	-159.6	144.5	22.4	55.3	0	0	0	0	115.5
2295	S	20.3	Very low	21.1	Very low	97 Å²	97	129.8 Å²	129.8	68%	0.678	77%	0.772	S	S	*	*			trans	56.3	145.4	140.7	66.1	0	0	0	0	123.2
2296	H	21.4	Very low	21.1	Very low	170 Å²	170	130.4 Å²	130.4	79%	0.787	77%	0.77	S	S	*	*			trans	78.2	83.6	160.1	-67.3	-62.3	0	0	0	121
2297	T	19.6	Very low	21.4	Very low	116 Å²	116	135.2 Å²	135.2	71%	0.712	78%	0.781	S	S	*	*				25.5	114.1	116.2	57	0	0	0	0	119.2
2298	T	22	Very low	21.7	Very low	147 Å²	147	131.4 Å²	131.4	90%	0.902	78%	0.775	S	S	*	*				-164.1	156.9	106.6	13.2	0	0	0	0	111.3
2299	S	19.1	Very low	22.1	Very low	120 Å²	120	134.5 Å²	134.5	84%	0.839	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-80.9	127.3	-175.6	51.5	0	0	0	0	112.7
2300	L	20.1	Very low	22.6	Very low	169 Å²	169	129.3 Å²	129.3	89%	0.885	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-91.7	139.4	158.9	-163.3	72.5	0	0	0	109.7
2301	S	19.8	Very low	23.4	Very low	99 Å²	99	128.3 Å²	128.3	69%	0.692	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-77.4	154.3	176.3	47.1	0	0	0	0	112.4	P2303	S2301-P2303 WeakPolarHBondContact O-CD 3.34Å
2302	T	19.9	Very low	24.9	Very low	132 Å²	132	128.5 Å²	128.5	81%	0.81	78%	0.779	S	S	*	*			trans	-89.5	115.9	171.9	44.4	0	0	0	0	111.5
2303	P	22.4	Very low	27.2	Very low	119 Å²	119	127.4 Å²	127.4	77%	0.773	77%	0.771	S	S	*	*			trans	-76.6	134.6	160.5	-4.5	23.5	0	0	0	109.3	S2301	S2301-P2303 WeakPolarHBondContact O-CD 3.34Å
2304	T	22.6	Very low	30.2	Very low	110 Å²	110	127 Å²	127	68%	0.675	75%	0.749	S	S	*	*			trans	-72.9	139	178.8	39.9	0	0	0	0	112.4	D2306	T2304-D2306 PolarHBondContact O-N 3.46Å; T2304-D2306 PolarHBondContact OG1-OD2 2.91Å
2305	T	23.7	Very low	33.5	Very low	144 Å²	144	124.3 Å²	124.3	88%	0.883	73%	0.725	S	S	*	*			trans	-81.2	68.4	169.7	39.2	0	0	0	0	110.7	K2307	T2305-K2307 PolarHBondContact O-N 3.49Å
2306	D	24	Very low	36.9	Very low	124 Å²	124	119.9 Å²	119.9	66%	0.663	69%	0.694	S	S	*	*			trans	-68	117.1	-178.3	-78.5	-53.2	0	0	0	112.6	T2304 S2308	T2304-D2306 PolarHBondContact O-N 3.46Å; T2304-D2306 PolarHBondContact OG1-OD2 2.91Å; D2306-S2308 PolarHBondContact O-N 3.18Å; D2306-S2308 VanDerWaalsContact O-N 3.11Å
2307	K	24.8	Very low	40.3	Very low	215 Å²	215	119.2 Å²	119.2	94%	0.935	69%	0.689	S	S	*	*			trans	-65.6	106.7	174.7	-65.4	175.6	-178.8	175.2	0	109.5	T2305	T2305-K2307 PolarHBondContact O-N 3.49Å
2308	S	28.9	Very low	43.8	Very low	106 Å²	106	113.9 Å²	113.9	74%	0.741	66%	0.656	S	S	*	*			trans	-124.8	130.3	170.1	51.2	0	0	0	0	110.6	D2306	D2306-S2308 PolarHBondContact O-N 3.18Å; D2306-S2308 VanDerWaalsContact O-N 3.11Å
2309	N	27.8	Very low	47	Very low	167 Å²	167	113.9 Å²	113.9	89%	0.893	65%	0.646	S	S	*	*			trans	-66.2	134.5	179.9	-74.7	-24.3	0	0	0	110.3	S2311	N2309-S2311 PolarHBondContact O-N 2.89Å
2310	G	32.8	Very low	50.4	Low	79 Å²	79	109.9 Å²	109.9	81%	0.814	61%	0.613	S	S	*	*			trans	-67.2	83.7	-174.5	0	0	0	0	0	114	R2312	G2310-R2312 PolarHBondContact O-N 3.1Å; G2310-R2312 VanDerWaalsContact O-N 3.16Å
2311	S	37.7	Very low	53.5	Low	113 Å²	113	103.7 Å²	103.7	79%	0.79	58%	0.584	S	S	*	*			trans	-62.4	112.5	171.5	-172.9	0	0	0	0	110.1	N2309 S2313	N2309-S2311 PolarHBondContact O-N 2.89Å; S2311-S2313 PolarHBondContact O-N 3.42Å
2312	R	53.4	Low	56.5	Low	165 Å²	165	100.2 Å²	100.2	62%	0.623	56%	0.558	S	S	*	*			trans	-61.4	103.2	-178	-66.2	-179.7	-179.6	166.1	1.3	109.6	G2310 R2314	G2310-R2312 PolarHBondContact O-N 3.1Å; G2310-R2312 VanDerWaalsContact O-N 3.16Å; R2312-R2314 PolarHBondContact O-N 3.44Å
2313	S	67.3	Low	59.4	Low	86 Å²	86	95.9 Å²	95.9	60%	0.601	53%	0.533	S	S	*	.			trans	-72.8	120.3	-168.4	58.4	0	0	0	0	112.9	S2311 H2315	S2311-S2313 PolarHBondContact O-N 3.42Å; S2313-H2315 PolarHBondContact O-N 3.45Å
2314	R	84.6	Confident	62.3	Low	89 Å²	89	91.8 Å²	91.8	34%	0.336	51%	0.507	S	S	.	.	S	Bend	trans	-75.6	25.8	175.6	-50.8	-172.8	-173.2	-170.3	2.4	113.7	R2312 Y2333 A2334 E2336	R2312-R2314 PolarHBondContact O-N 3.44Å; R2314-Y2333 WeakPolarHBondContact O-CA 3.09Å; R2314-Y2333 PolarHBondContact O-N 2.95Å; R2314-A2334 PolarHBondContact O-N 3.01Å; R2314-E2336 WeakPolarHBondContact CD-OE1 3.26Å; R2314-E2336 IonicContact NH1-OE1 2.67Å; R2314-E2336 PolarHBondContact NH1-OE1 3.41Å
2315	H	91.5	Very high	65.4	Low	43 Å²	43	86.7 Å²	86.7	20%	0.199	48%	0.476	C	S	.	.	S	Bend	trans	-136.4	134.3	-165.7	-51.7	-23.3	0	0	0	109	S2313 V2331 Y2332 Y2333 H2395	S2313-H2315 PolarHBondContact O-N 3.45Å; H2315-V2331 CarbonylContact C-O 3.6Å; H2315-V2331 VanDerWaalsContact CA-O 3.27Å; H2315-V2331 WeakPolarHBondContact CA-O 3.36Å; H2315-Y2332 AromaticContact CD2-CD1 3.54Å; H2315-Y2332 AromaticContact CE1-CD1 3.99Å; H2315-Y2332 AromaticContact CG-CD1 3.8Å; H2315-Y2332 AromaticContact NE2-CD1 3.69Å; H2315-Y2333 AromaticContact CE1-CD2 3.91Å; H2315-Y2333 AromaticContact CE1-CE2 3.72Å; H2315-Y2333 AromaticContact CE1-CZ 3.82Å; H2315-Y2333 PolarHBondContact ND1-N 3.09Å; H2315-Y2333 VanDerWaalsContact ND1-N 3.15Å; H2315-H2395 AromaticContact NE2-CE1 3.56Å
2316	I	92.2	Very high	68.4	Low	5 Å²	5	82.6 Å²	82.6	3%	0.026	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	109.7	-175	-65.4	177.7	0	0	0	109	Y2184 K2187 L2188 L2191 I2318 C2330 V2331 A2334	Y2184-I2316 HydrophobicContact CD2-CB 4.42Å; Y2184-I2316 HydrophobicContact CD2-CD1 4.04Å; Y2184-I2316 HydrophobicContact CD2-CG2 3.95Å; Y2184-I2316 HydrophobicContact CE2-CD1 3.93Å; K2187-I2316 HydrophobicContact CB-CD1 3.97Å; K2187-I2316 HydrophobicContact CB-CG1 4.11Å; K2187-I2316 HydrophobicContact CB-CG2 3.84Å; K2187-I2316 HydrophobicContact CD-CG2 3.85Å; K2187-I2316 HydrophobicContact CG-CG2 4.49Å; L2188-I2316 HydrophobicContact CB-CD1 3.88Å; L2188-I2316 HydrophobicContact CD1-CD1 3.94Å; L2191-I2316 HydrophobicContact CD1-CD1 4.21Å; L2191-I2316 HydrophobicContact CD1-CG1 3.92Å; I2316-I2318 HydrophobicContact CG2-CD1 3.92Å; I2316-I2318 HydrophobicContact CG2-CG1 3.99Å; I2316-C2330 CarbonylContact O-C 3.6Å; I2316-C2330 WeakPolarHBondContact O-CA 3.31Å; I2316-V2331 HydrophobicContact CB-CB 4.41Å; I2316-V2331 PolarHBondContact N-O 3.41Å; I2316-V2331 PolarHBondContact O-N 2.94Å; I2316-A2334 HydrophobicContact CB-CB 4.16Å; I2316-A2334 HydrophobicContact CD1-CB 3.52Å; I2316-A2334 HydrophobicContact CG1-CB 3.68Å
2317	K	92.2	Very high	71.6	Confident	156 Å²	156	77 Å²	77	68%	0.678	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.5	130.3	171.7	-67.8	179.6	-179.9	-178.9	0	110.2	K2187 C2330	K2187-K2317 PolarHBondContact NZ-O 2.85Å; K2317-C2330 HydrophobicContact CG-CB 3.9Å; K2317-C2330 WeakPolarHBondContact CG-SG 3.37Å
2318	I	92.3	Very high	74.8	Confident	4 Å²	4	69 Å²	69	2%	0.021	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	137.8	177.6	-65.9	154.3	0	0	0	107	A2178 T2181 Y2184 I2316 F2320 F2328 C2329	A2178-I2318 HydrophobicContact CB-CB 4.46Å; A2178-I2318 HydrophobicContact CB-CD1 4.09Å; A2178-I2318 HydrophobicContact CB-CG2 4.25Å; T2181-I2318 HydrophobicContact CG2-CG2 4.41Å; Y2184-I2318 HydrophobicContact CD2-CD1 4.04Å; Y2184-I2318 HydrophobicContact CG-CD1 4.28Å; I2316-I2318 HydrophobicContact CG2-CD1 3.92Å; I2316-I2318 HydrophobicContact CG2-CG1 3.99Å; I2318-F2320 HydrophobicContact CG2-CD1 4.26Å; I2318-F2328 WeakPolarHBondContact O-CA 3.37Å; I2318-C2329 PolarHBondContact N-O 3.24Å; I2318-C2329 PolarHBondContact O-N 3.17Å
2319	Q	90.1	Very high	77.9	Confident	146 Å²	146	64 Å²	64	68%	0.682	35%	0.351	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.4	134.3	178.6	-176.4	179.4	-19.7	0	0	109.2	F2327	Q2319-F2327 WeakPolarHBondContact CA-O 3.27Å; Q2319-F2327 WeakPolarHBondContact CG-O 3.44Å
2320	F	89.7	Confident	81.1	Confident	37 Å²	37	56.5 Å²	56.5	16%	0.162	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	175.6	177.3	57.6	-87	0	0	0	109.7	V2166 I2174 F2177 A2178 I2318 F2327	V2166-F2320 HydrophobicContact CG2-CE2 4.06Å; V2166-F2320 HydrophobicContact CG2-CZ 4.27Å; I2174-F2320 HydrophobicContact CB-CZ 4.49Å; I2174-F2320 HydrophobicContact CG2-CE1 4.07Å; I2174-F2320 HydrophobicContact CG2-CZ 3.66Å; F2177-F2320 HydrophobicContact CB-CZ 4.38Å; F2177-F2320 AromaticContact CD1-CD1 4Å; F2177-F2320 HydrophobicContact CD1-CD1 4Å; F2177-F2320 HydrophobicContact CD1-CD2 4.07Å; F2177-F2320 AromaticContact CD1-CE1 3.59Å; F2177-F2320 HydrophobicContact CD1-CE1 3.59Å; F2177-F2320 AromaticContact CD1-CE2 3.66Å; F2177-F2320 HydrophobicContact CD1-CE2 3.66Å; F2177-F2320 HydrophobicContact CD1-CG 4.22Å; F2177-F2320 AromaticContact CD1-CZ 3.39Å; F2177-F2320 HydrophobicContact CD1-CZ 3.39Å; F2177-F2320 HydrophobicContact CE1-CD1 4.03Å; F2177-F2320 AromaticContact CE1-CD2 3.82Å; F2177-F2320 HydrophobicContact CE1-CD2 3.82Å; F2177-F2320 HydrophobicContact CE1-CE1 4.1Å; F2177-F2320 AromaticContact CE1-CE2 3.89Å; F2177-F2320 HydrophobicContact CE1-CE2 3.89Å; F2177-F2320 AromaticContact CE1-CG 3.88Å; F2177-F2320 HydrophobicContact CE1-CG 3.88Å; F2177-F2320 HydrophobicContact CE1-CZ 4.01Å; F2177-F2320 HydrophobicContact CG-CE2 4.45Å; F2177-F2320 HydrophobicContact CG-CZ 4.18Å; A2178-F2320 HydrophobicContact CB-CE1 4.5Å; I2318-F2320 HydrophobicContact CG2-CD1 4.26Å; F2320-F2327 HydrophobicContact CD1-CB 4.29Å; F2320-F2327 HydrophobicContact CD2-CB 3.78Å; F2320-F2327 AromaticContact CD2-CD2 3.63Å; F2320-F2327 HydrophobicContact CD2-CD2 3.63Å; F2320-F2327 HydrophobicContact CD2-CG 4.01Å; F2320-F2327 HydrophobicContact CE1-CB 4.04Å; F2320-F2327 HydrophobicContact CE2-CB 3.49Å; F2320-F2327 VanDerWaalsContact CE2-CB 3.49Å; F2320-F2327 HydrophobicContact CE2-CD1 4.44Å; F2320-F2327 AromaticContact CE2-CD2 3.51Å; F2320-F2327 HydrophobicContact CE2-CD2 3.51Å; F2320-F2327 HydrophobicContact CE2-CE2 4.34Å; F2320-F2327 AromaticContact CE2-CG 3.57Å; F2320-F2327 HydrophobicContact CE2-CG 3.57Å; F2320-F2327 HydrophobicContact CG-CB 4.18Å; F2320-F2327 HydrophobicContact CZ-CB 3.66Å; F2320-F2327 HydrophobicContact CZ-CD2 4.46Å; F2320-F2327 HydrophobicContact CZ-CG 4.1Å; F2320-F2327 PolarHBondContact N-O 3.37Å; F2320-F2327 PolarHBondContact O-N 3.05Å
2321	S	85.2	Confident	84	Confident	39 Å²	39	52.7 Å²	52.7	27%	0.273	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	167.1	175.7	79.5	0	0	0	0	110.7	S2084 S2085 T2325	S2084-S2321 WeakPolarHBondContact CB-OG 3.11Å; S2085-S2321 WeakPolarHBondContact CB-O 3.4Å; S2321-T2325 CarbonylContact C-O 3.46Å; S2321-T2325 WeakPolarHBondContact CA-O 3.41Å; S2321-T2325 VanDerWaalsContact CB-O 3.31Å; S2321-T2325 WeakPolarHBondContact CB-O 3.42Å
2322	D	83.6	Confident	86.7	Confident	25 Å²	25	49 Å²	49	13%	0.134	24%	0.241	C	C	.	.			trans	-101.9	-149.2	152.4	64.9	59.4	0	0	0	110.3	S2085 V2087 S2324 T2325 F2327	S2085-D2322 VanDerWaalsContact OG-C 3.26Å; S2085-D2322 WeakPolarHBondContact OG-CA 3.45Å; S2085-D2322 PolarHBondContact OG-O 3.18Å; V2087-D2322 HydrophobicContact CB-CB 4.04Å; V2087-D2322 HydrophobicContact CG1-CB 4.12Å; V2087-D2322 HydrophobicContact CG2-CB 3.86Å; D2322-S2324 VanDerWaalsContact C-N 3.35Å; D2322-S2324 WeakPolarHBondContact OD1-CA 3.32Å; D2322-S2324 PolarHBondContact OD1-N 3.37Å; D2322-S2324 PolarHBondContact OD1-OG 2.96Å; D2322-T2325 PolarHBondContact N-O 3.15Å; D2322-T2325 PolarHBondContact OD1-N 3.49Å; D2322-T2325 WeakPolarHBondContact OD2-CB 3.44Å; D2322-F2327 VanDerWaalsContact OD2-CE2 3.32Å; D2322-F2327 WeakPolarHBondContact OD2-CE2 3.42Å
2323	S	81	Confident	88.6	Confident	42 Å²	42	41.9 Å²	41.9	29%	0.294	22%	0.215	S	C	.	.	S	Bend	trans	-82.3	-5.8	176.3	61.3	0	0	0	0	115.7	R2088	R2088-S2323 PolarHBondContact NE-OG 2.91Å; R2088-S2323 PolarHBondContact NH2-OG 3.03Å
2324	S	83.8	Confident	89.7	Confident	33 Å²	33	37.8 Å²	37.8	23%	0.231	19%	0.186	C	C	.	.	S	Bend	trans	-147.1	-38.6	-165.5	22.9	0	0	0	0	112	D2322 N2430 S2431	D2322-S2324 VanDerWaalsContact C-N 3.35Å; D2322-S2324 WeakPolarHBondContact OD1-CA 3.32Å; D2322-S2324 PolarHBondContact OD1-N 3.37Å; D2322-S2324 PolarHBondContact OD1-OG 2.96Å; S2324-N2430 CarbonylContact O-C 2.89Å; S2324-S2431 PolarHBondContact O-N 2.88Å; S2324-S2431 PolarHBondContact O-OG 2.9Å
2325	T	86.2	Confident	89.9	Confident	3 Å²	3	33.6 Å²	33.6	2%	0.018	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.8	-179.7	-58.1	0	0	0	0	111.4	D2168 S2321 D2322 F2327 F2428 N2430	D2168-T2325 PolarHBondContact OD2-OG1 3.14Å; S2321-T2325 CarbonylContact C-O 3.46Å; S2321-T2325 WeakPolarHBondContact CA-O 3.41Å; S2321-T2325 VanDerWaalsContact CB-O 3.31Å; S2321-T2325 WeakPolarHBondContact CB-O 3.42Å; D2322-T2325 PolarHBondContact N-O 3.15Å; D2322-T2325 PolarHBondContact OD1-N 3.49Å; D2322-T2325 WeakPolarHBondContact OD2-CB 3.44Å; T2325-F2327 HydrophobicContact CG2-CD1 4Å; T2325-F2327 HydrophobicContact CG2-CD2 4.3Å; T2325-F2327 HydrophobicContact CG2-CE1 3.49Å; T2325-F2327 VanDerWaalsContact CG2-CE1 3.49Å; T2325-F2327 HydrophobicContact CG2-CE2 3.83Å; T2325-F2327 HydrophobicContact CG2-CG 4.38Å; T2325-F2327 HydrophobicContact CG2-CZ 3.39Å; T2325-F2428 HydrophobicContact CG2-CB 3.73Å; T2325-F2428 HydrophobicContact CG2-CD2 3.86Å; T2325-F2428 HydrophobicContact CG2-CG 4.14Å; T2325-N2430 HydrophobicContact CG2-CB 4.42Å; T2325-N2430 PolarHBondContact OG1-ND2 3.37Å
2326	T	87.8	Confident	89.9	Confident	57 Å²	57	32.6 Å²	32.6	35%	0.35	17%	0.166	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	129.9	169.8	54.3	0	0	0	0	109.2	F2428 K2429	T2326-F2428 CarbonylContact O-C 3.6Å; T2326-F2428 WeakPolarHBondContact O-CA 3.17Å; T2326-K2429 PolarHBondContact N-O 3.16Å; T2326-K2429 PolarHBondContact O-N 2.85Å; T2326-K2429 PolarHBondContact OG1-O 3.17Å
2327	F	91.6	Very high	89.9	Confident	6 Å²	6	32.4 Å²	32.4	3%	0.026	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	143.1	-174.5	-56.8	-85.1	0	0	0	110.5	V2166 D2168 I2174 Q2319 F2320 D2322 T2325 F2428	V2166-F2327 HydrophobicContact CG1-CD1 4.24Å; V2166-F2327 HydrophobicContact CG1-CE1 3.79Å; V2166-F2327 HydrophobicContact CG1-CZ 3.97Å; D2168-F2327 WeakPolarHBondContact OD1-CE1 3.25Å; D2168-F2327 WeakPolarHBondContact OD1-CZ 3.49Å; I2174-F2327 HydrophobicContact CD1-CD1 3.79Å; I2174-F2327 HydrophobicContact CD1-CE1 4.29Å; I2174-F2327 HydrophobicContact CG1-CD1 3.92Å; I2174-F2327 HydrophobicContact CG1-CE1 4.36Å; I2174-F2327 HydrophobicContact CG2-CB 4.11Å; I2174-F2327 HydrophobicContact CG2-CD1 4.4Å; Q2319-F2327 WeakPolarHBondContact CA-O 3.27Å; Q2319-F2327 WeakPolarHBondContact CG-O 3.44Å; F2320-F2327 HydrophobicContact CD1-CB 4.29Å; F2320-F2327 HydrophobicContact CD2-CB 3.78Å; F2320-F2327 AromaticContact CD2-CD2 3.63Å; F2320-F2327 HydrophobicContact CD2-CD2 3.63Å; F2320-F2327 HydrophobicContact CD2-CG 4.01Å; F2320-F2327 HydrophobicContact CE1-CB 4.04Å; F2320-F2327 HydrophobicContact CE2-CB 3.49Å; F2320-F2327 VanDerWaalsContact CE2-CB 3.49Å; F2320-F2327 HydrophobicContact CE2-CD1 4.44Å; F2320-F2327 AromaticContact CE2-CD2 3.51Å; F2320-F2327 HydrophobicContact CE2-CD2 3.51Å; F2320-F2327 HydrophobicContact CE2-CE2 4.34Å; F2320-F2327 AromaticContact CE2-CG 3.57Å; F2320-F2327 HydrophobicContact CE2-CG 3.57Å; F2320-F2327 HydrophobicContact CG-CB 4.18Å; F2320-F2327 HydrophobicContact CZ-CB 3.66Å; F2320-F2327 HydrophobicContact CZ-CD2 4.46Å; F2320-F2327 HydrophobicContact CZ-CG 4.1Å; F2320-F2327 PolarHBondContact N-O 3.37Å; F2320-F2327 PolarHBondContact O-N 3.05Å; D2322-F2327 VanDerWaalsContact OD2-CE2 3.32Å; D2322-F2327 WeakPolarHBondContact OD2-CE2 3.42Å; T2325-F2327 HydrophobicContact CG2-CD1 4Å; T2325-F2327 HydrophobicContact CG2-CD2 4.3Å; T2325-F2327 HydrophobicContact CG2-CE1 3.49Å; T2325-F2327 VanDerWaalsContact CG2-CE1 3.49Å; T2325-F2327 HydrophobicContact CG2-CE2 3.83Å; T2325-F2327 HydrophobicContact CG2-CG 4.38Å; T2325-F2327 HydrophobicContact CG2-CZ 3.39Å; F2327-F2428 HydrophobicContact CD1-CB 3.7Å; F2327-F2428 HydrophobicContact CE1-CB 4.06Å
2328	F	91.7	Very high	89.8	Confident	48 Å²	48	25.1 Å²	25.1	21%	0.211	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	146.9	172.7	65.9	-93.2	0	0	0	111.4	I2318 H2425 G2427 R2438	I2318-F2328 WeakPolarHBondContact O-CA 3.37Å; F2328-H2425 AromaticContact CE2-CD2 3.4Å; F2328-H2425 VanDerWaalsContact CE2-CD2 3.4Å; F2328-H2425 WeakPolarHBondContact CE2-CD2 3.38Å; F2328-H2425 AromaticContact CE2-NE2 3.62Å; F2328-G2427 WeakPolarHBondContact CD1-O 3.48Å; F2328-G2427 VanDerWaalsContact CE1-C 3.43Å; F2328-G2427 PolarHBondContact N-O 3.1Å; F2328-G2427 PolarHBondContact O-N 3.48Å; F2328-G2427 VanDerWaalsContact O-N 3.1Å; F2328-R2438 HydrophobicContact CE1-CG 4.46Å; F2328-R2438 HydrophobicContact CZ-CB 4.33Å; F2328-R2438 HydrophobicContact CZ-CG 3.79Å
2329	C	93.5	Very high	89.5	Confident	1 Å²	1	28.9 Å²	28.9	1%	0.007	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	128.4	171.6	-170.8	0	0	0	0	109.7	A2178 I2318 H2425	A2178-C2329 HydrophobicContact CB-CB 3.65Å; I2318-C2329 PolarHBondContact N-O 3.24Å; I2318-C2329 PolarHBondContact O-N 3.17Å; C2329-H2425 CarbonylContact C-O 3.46Å; C2329-H2425 WeakPolarHBondContact CA-O 3.39Å
2330	C	94.1	Very high	89.5	Confident	9 Å²	9	22 Å²	22	6%	0.061	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	110.7	167.9	-173.7	0	0	0	0	109.1	I2316 K2317 Y2332 F2424 H2425	I2316-C2330 CarbonylContact O-C 3.6Å; I2316-C2330 WeakPolarHBondContact O-CA 3.31Å; K2317-C2330 HydrophobicContact CG-CB 3.9Å; K2317-C2330 WeakPolarHBondContact CG-SG 3.37Å; C2330-Y2332 PolarHBondContact O-N 3.34Å; C2330-F2424 WeakPolarHBondContact O-CA 3.18Å; C2330-H2425 HydrophobicContact CB-CB 4.02Å; C2330-H2425 PolarHBondContact N-O 3.32Å; C2330-H2425 PolarHBondContact O-N 2.87Å
2331	V	94.4	Very high	89.5	Confident	0 Å²	0	20.2 Å²	20.2	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	109.7	171.6	-171.9	0	0	0	0	108.1	L2179 Y2184 H2315 I2316 A2334 F2424	L2179-V2331 HydrophobicContact CD2-CG2 4.05Å; Y2184-V2331 HydrophobicContact CD2-CG2 4.24Å; Y2184-V2331 HydrophobicContact CE2-CB 4.31Å; Y2184-V2331 HydrophobicContact CE2-CG1 4.2Å; Y2184-V2331 HydrophobicContact CE2-CG2 4.01Å; H2315-V2331 CarbonylContact C-O 3.6Å; H2315-V2331 VanDerWaalsContact CA-O 3.27Å; H2315-V2331 WeakPolarHBondContact CA-O 3.36Å; I2316-V2331 HydrophobicContact CB-CB 4.41Å; I2316-V2331 PolarHBondContact N-O 3.41Å; I2316-V2331 PolarHBondContact O-N 2.94Å; V2331-A2334 HydrophobicContact CB-CB 4.21Å; V2331-A2334 HydrophobicContact CG1-CB 3.83Å; V2331-F2424 HydrophobicContact CB-CD1 4.31Å; V2331-F2424 HydrophobicContact CB-CE1 4.29Å; V2331-F2424 HydrophobicContact CG1-CD1 4.22Å; V2331-F2424 HydrophobicContact CG1-CE1 3.79Å; V2331-F2424 HydrophobicContact CG2-CD1 3.98Å; V2331-F2424 HydrophobicContact CG2-CE1 3.94Å
2332	Y	93.9	Very high	89.4	Confident	35 Å²	35	22 Å²	22	14%	0.137	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.4	151.8	172.9	-65.7	-85.6	0	0	0	110.4	H2315 C2330 A2334 F2337 M2391 H2395 I2423 H2425	H2315-Y2332 AromaticContact CD2-CD1 3.54Å; H2315-Y2332 AromaticContact CE1-CD1 3.99Å; H2315-Y2332 AromaticContact CG-CD1 3.8Å; H2315-Y2332 AromaticContact NE2-CD1 3.69Å; C2330-Y2332 PolarHBondContact O-N 3.34Å; Y2332-A2334 VanDerWaalsContact C-N 3.26Å; Y2332-A2334 PolarHBondContact O-N 3.25Å; Y2332-A2334 VanDerWaalsContact O-N 3.14Å; Y2332-F2337 WeakPolarHBondContact O-CD2 3.48Å; Y2332-M2391 HydrophobicContact CD2-CE 4.14Å; Y2332-M2391 HydrophobicContact CD2-SD 4.44Å; Y2332-M2391 HydrophobicContact CE2-CE 3.51Å; Y2332-M2391 HydrophobicContact CE2-SD 4.1Å; Y2332-H2395 AromaticContact CD1-CE1 3.72Å; Y2332-H2395 AromaticContact CE1-CE1 3.85Å; Y2332-H2395 AromaticContact CE1-NE2 3.85Å; Y2332-I2423 HydrophobicContact CD2-CB 4.4Å; Y2332-I2423 HydrophobicContact CD2-CG2 3.78Å; Y2332-I2423 HydrophobicContact CE2-CG2 4.38Å; Y2332-I2423 HydrophobicContact CG-CG2 4.41Å; Y2332-I2423 PolarHBondContact N-O 2.95Å; Y2332-H2425 HydrophobicContact CE2-CB 3.72Å
2333	Y	93.4	Very high	89.3	Confident	16 Å²	16	23.6 Å²	23.6	6%	0.063	12%	0.119	C	C	.	.	T	Hydrogen-bonded Turn	trans	40.4	50.8	179	-61	-84.5	0	0	0	114	R2314 H2315 S2335 E2336 F2337 F2394 H2395 S2398 F2402	R2314-Y2333 WeakPolarHBondContact O-CA 3.09Å; R2314-Y2333 PolarHBondContact O-N 2.95Å; H2315-Y2333 AromaticContact CE1-CD2 3.91Å; H2315-Y2333 AromaticContact CE1-CE2 3.72Å; H2315-Y2333 AromaticContact CE1-CZ 3.82Å; H2315-Y2333 PolarHBondContact ND1-N 3.09Å; H2315-Y2333 VanDerWaalsContact ND1-N 3.15Å; Y2333-S2335 PolarHBondContact O-N 2.75Å; Y2333-E2336 WeakPolarHBondContact CA-OE2 3.25Å; Y2333-E2336 PolarHBondContact O-N 3.07Å; Y2333-F2337 WeakPolarHBondContact O-CD2 3.47Å; Y2333-F2337 PolarHBondContact O-N 3.32Å; Y2333-F2394 HydrophobicContact CD2-CD1 4.18Å; Y2333-F2394 AromaticContact CD2-CE1 3.66Å; Y2333-F2394 HydrophobicContact CD2-CE1 3.66Å; Y2333-F2394 AromaticContact CE2-CD1 3.96Å; Y2333-F2394 HydrophobicContact CE2-CD1 3.96Å; Y2333-F2394 AromaticContact CE2-CE1 3.84Å; Y2333-F2394 HydrophobicContact CE2-CE1 3.84Å; Y2333-F2394 HydrophobicContact CG-CE1 4.38Å; Y2333-H2395 AromaticContact CE2-CE1 3.95Å; Y2333-H2395 AromaticContact CE2-ND1 3.48Å; Y2333-H2395 WeakPolarHBondContact CE2-ND1 3.43Å; Y2333-H2395 AromaticContact CZ-ND1 3.6Å; Y2333-H2395 WeakPolarHBondContact OH-CA 3.24Å; Y2333-H2395 PolarHBondContact OH-ND1 3.17Å; Y2333-H2395 PolarHBondContact OH-O 2.77Å; Y2333-S2398 VanDerWaalsContact CE1-CB 3.49Å; Y2333-S2398 VanDerWaalsContact CE1-OG 3.3Å; Y2333-S2398 WeakPolarHBondContact CE1-OG 3.39Å; Y2333-S2398 VanDerWaalsContact CZ-CB 3.44Å; Y2333-S2398 PolarHBondContact OH-OG 3.36Å; Y2333-S2398 VanDerWaalsContact OH-OG 3.11Å; Y2333-F2402 HydrophobicContact CD1-CE2 4Å; Y2333-F2402 AromaticContact CG-CE2 3.93Å; Y2333-F2402 HydrophobicContact CG-CE2 3.93Å; Y2333-F2402 HydrophobicContact CG-CZ 4.36Å
2334	A	90.6	Very high	89.2	Confident	0 Å²	0	21.8 Å²	21.8	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-66.4	-39.3	-160.9	0	0	0	0	0	113.2	Y2184 L2188 L2191 R2314 I2316 V2331 Y2332 F2338	Y2184-A2334 HydrophobicContact CE2-CB 4.31Å; L2188-A2334 HydrophobicContact CD1-CB 4.08Å; L2188-A2334 WeakPolarHBondContact CD1-O 3.27Å; L2191-A2334 HydrophobicContact CD1-CB 4.44Å; R2314-A2334 PolarHBondContact O-N 3.01Å; I2316-A2334 HydrophobicContact CB-CB 4.16Å; I2316-A2334 HydrophobicContact CD1-CB 3.52Å; I2316-A2334 HydrophobicContact CG1-CB 3.68Å; V2331-A2334 HydrophobicContact CB-CB 4.21Å; V2331-A2334 HydrophobicContact CG1-CB 3.83Å; Y2332-A2334 VanDerWaalsContact C-N 3.26Å; Y2332-A2334 PolarHBondContact O-N 3.25Å; Y2332-A2334 VanDerWaalsContact O-N 3.14Å; A2334-F2338 WeakPolarHBondContact O-CB 3.49Å; A2334-F2338 PolarHBondContact O-N 2.9Å; A2334-F2338 VanDerWaalsContact O-N 3.09Å
2335	S	88.9	Confident	89.1	Confident	1 Å²	1	20.3 Å²	20.3	1%	0.007	10%	0.096	C	C	.	.	H	α-helix	trans	-75.8	-31.9	177.6	-176.5	0	0	0	0	112.1	Y2333 R2339	Y2333-S2335 PolarHBondContact O-N 2.75Å; S2335-R2339 WeakPolarHBondContact O-CB 3.37Å; S2335-R2339 WeakPolarHBondContact O-CG 3.44Å; S2335-R2339 PolarHBondContact O-N 2.83Å
2336	E	90.9	Very high	88	Confident	22 Å²	22	24 Å²	24	10%	0.103	12%	0.12	C	C	.	.	H	α-helix	trans	-74.7	-46.7	-179	-57.2	96.3	135.2	0	0	111.2	R2314 Y2333 R2339 L2340 F2402	R2314-E2336 WeakPolarHBondContact CD-OE1 3.26Å; R2314-E2336 IonicContact NH1-OE1 2.67Å; R2314-E2336 PolarHBondContact NH1-OE1 3.41Å; Y2333-E2336 WeakPolarHBondContact CA-OE2 3.25Å; Y2333-E2336 PolarHBondContact O-N 3.07Å; E2336-R2339 PolarHBondContact O-N 2.91Å; E2336-L2340 WeakPolarHBondContact O-CB 3.17Å; E2336-L2340 PolarHBondContact O-N 3.07Å; E2336-F2402 HydrophobicContact CB-CD1 4.07Å; E2336-F2402 HydrophobicContact CB-CD2 3.58Å; E2336-F2402 HydrophobicContact CB-CE1 3.91Å; E2336-F2402 HydrophobicContact CB-CE2 3.43Å; E2336-F2402 VanDerWaalsContact CB-CE2 3.43Å; E2336-F2402 HydrophobicContact CB-CG 3.94Å; E2336-F2402 HydrophobicContact CB-CZ 3.61Å; E2336-F2402 HydrophobicContact CG-CD2 4.05Å; E2336-F2402 HydrophobicContact CG-CE2 4.1Å
2337	F	93.4	Very high	87	Confident	0 Å²	0	25.5 Å²	25.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-66.1	-36.9	172.3	-79.2	-61	0	0	0	112.5	Y2332 Y2333 L2340 R2341 F2394 Y2401 F2402 I2420 L2421 I2423	Y2332-F2337 WeakPolarHBondContact O-CD2 3.48Å; Y2333-F2337 WeakPolarHBondContact O-CD2 3.47Å; Y2333-F2337 PolarHBondContact O-N 3.32Å; F2337-L2340 HydrophobicContact CD1-CD2 4.35Å; F2337-L2340 PolarHBondContact O-N 3.27Å; F2337-R2341 WeakPolarHBondContact O-CG 3.41Å; F2337-R2341 PolarHBondContact O-N 3.41Å; F2337-F2394 HydrophobicContact CE1-CZ 4.33Å; F2337-F2394 HydrophobicContact CE2-CE1 4.17Å; F2337-F2394 HydrophobicContact CE2-CZ 4.16Å; F2337-F2394 AromaticContact CZ-CE1 3.97Å; F2337-F2394 HydrophobicContact CZ-CE1 3.97Å; F2337-F2394 HydrophobicContact CZ-CE2 4.29Å; F2337-F2394 AromaticContact CZ-CZ 3.52Å; F2337-F2394 HydrophobicContact CZ-CZ 3.52Å; F2337-Y2401 HydrophobicContact CE1-CE1 4.26Å; F2337-F2402 AromaticContact CD1-CE1 3.64Å; F2337-F2402 HydrophobicContact CD1-CE1 3.64Å; F2337-F2402 AromaticContact CD1-CZ 3.9Å; F2337-F2402 HydrophobicContact CD1-CZ 3.9Å; F2337-F2402 HydrophobicContact CD2-CE1 4.45Å; F2337-F2402 AromaticContact CD2-CZ 3.91Å; F2337-F2402 HydrophobicContact CD2-CZ 3.91Å; F2337-F2402 AromaticContact CE1-CE1 3.78Å; F2337-F2402 HydrophobicContact CE1-CE1 3.78Å; F2337-F2402 AromaticContact CE1-CZ 3.87Å; F2337-F2402 HydrophobicContact CE1-CZ 3.87Å; F2337-F2402 AromaticContact CE2-CZ 3.9Å; F2337-F2402 HydrophobicContact CE2-CZ 3.9Å; F2337-F2402 AromaticContact CG-CE1 3.99Å; F2337-F2402 HydrophobicContact CG-CE1 3.99Å; F2337-F2402 AromaticContact CG-CZ 3.91Å; F2337-F2402 HydrophobicContact CG-CZ 3.91Å; F2337-F2402 HydrophobicContact CZ-CE1 4.26Å; F2337-F2402 AromaticContact CZ-CZ 3.88Å; F2337-F2402 HydrophobicContact CZ-CZ 3.88Å; F2337-I2420 HydrophobicContact CE1-CB 4.24Å; F2337-I2420 HydrophobicContact CE1-CG2 3.83Å; F2337-I2420 WeakPolarHBondContact CE1-O 3.49Å; F2337-I2420 HydrophobicContact CZ-CG2 3.82Å; F2337-L2421 VanDerWaalsContact CD1-C 3.47Å; F2337-L2421 WeakPolarHBondContact CD1-O 3.41Å; F2337-I2423 HydrophobicContact CE2-CB 4.19Å; F2337-I2423 HydrophobicContact CE2-CD1 4.31Å; F2337-I2423 HydrophobicContact CE2-CG1 4.01Å; F2337-I2423 HydrophobicContact CZ-CD1 4.02Å; F2337-I2423 HydrophobicContact CZ-CG1 3.86Å
2338	F	90.1	Very high	85.9	Confident	4 Å²	4	25.7 Å²	25.7	2%	0.018	13%	0.129	C	C	.	.	H	α-helix	trans	-60.7	-48.6	173	179	-90.9	0	0	0	111.2	L2041 Y2045 L2188 A2334 L2340 R2341 Q2342 D2349	L2041-F2338 HydrophobicContact CD1-CD1 3.94Å; L2041-F2338 HydrophobicContact CD1-CE1 3.85Å; L2041-F2338 HydrophobicContact CD2-CD1 4.13Å; L2041-F2338 HydrophobicContact CD2-CE1 3.87Å; L2041-F2338 HydrophobicContact CD2-CZ 4.41Å; L2041-F2338 HydrophobicContact CG-CD1 4.24Å; L2041-F2338 HydrophobicContact CG-CE1 3.76Å; Y2045-F2338 AromaticContact CE2-CZ 3.98Å; Y2045-F2338 HydrophobicContact CE2-CZ 3.98Å; L2188-F2338 HydrophobicContact CD1-CB 4.22Å; L2188-F2338 HydrophobicContact CD2-CB 4.27Å; L2188-F2338 HydrophobicContact CD2-CD1 4.22Å; L2188-F2338 HydrophobicContact CD2-CD2 3.57Å; L2188-F2338 HydrophobicContact CD2-CE1 4.43Å; L2188-F2338 HydrophobicContact CD2-CE2 3.8Å; L2188-F2338 HydrophobicContact CD2-CG 3.77Å; L2188-F2338 HydrophobicContact CD2-CZ 4.22Å; A2334-F2338 WeakPolarHBondContact O-CB 3.49Å; A2334-F2338 PolarHBondContact O-N 2.9Å; A2334-F2338 VanDerWaalsContact O-N 3.09Å; F2338-L2340 VanDerWaalsContact C-N 3.33Å; F2338-L2340 PolarHBondContact O-N 2.8Å; F2338-R2341 PolarHBondContact O-N 3.45Å; F2338-Q2342 HydrophobicContact CD1-CG 3.96Å; F2338-Q2342 HydrophobicContact CE1-CG 3.69Å; F2338-Q2342 HydrophobicContact CZ-CG 4.02Å; F2338-Q2342 VanDerWaalsContact O-CG 3.31Å; F2338-Q2342 WeakPolarHBondContact O-CG 3.36Å; F2338-Q2342 PolarHBondContact O-N 3.32Å; F2338-D2349 HydrophobicContact CD2-CB 4.41Å; F2338-D2349 WeakPolarHBondContact CD2-OD2 3.24Å; F2338-D2349 HydrophobicContact CE2-CB 4.18Å
2339	R	86.6	Confident	85.3	Confident	82 Å²	82	24 Å²	24	31%	0.309	12%	0.123	S	C	.	.	H	α-helix	trans	-58.2	-43.1	174.4	-84.1	177.9	156.4	-174.2	-9.5	112.4	L2039 H2192 S2335 E2336 Q2342 L2343	L2039-R2339 PolarHBondContact O-NE 3.31Å; L2039-R2339 PolarHBondContact O-NH2 2.7Å; H2192-R2339 PolarHBondContact CE1-NH2 2.83Å; S2335-R2339 WeakPolarHBondContact O-CB 3.37Å; S2335-R2339 WeakPolarHBondContact O-CG 3.44Å; S2335-R2339 PolarHBondContact O-N 2.83Å; E2336-R2339 PolarHBondContact O-N 2.91Å; R2339-Q2342 PolarHBondContact O-N 2.91Å; R2339-L2343 WeakPolarHBondContact O-CG 3.36Å; R2339-L2343 PolarHBondContact O-N 3.49Å
2340	L	89.4	Confident	84.7	Confident	1 Å²	1	28.6 Å²	28.6	1%	0.005	15%	0.146	C	C	.	.	H	α-helix	trans	-60.8	-47.8	176.1	-177.5	61.8	0	0	0	111.2	E2336 F2337 F2338 Q2342 L2343 I2344 Y2401 F2402 L2405 I2406	E2336-L2340 WeakPolarHBondContact O-CB 3.17Å; E2336-L2340 PolarHBondContact O-N 3.07Å; F2337-L2340 HydrophobicContact CD1-CD2 4.35Å; F2337-L2340 PolarHBondContact O-N 3.27Å; F2338-L2340 VanDerWaalsContact C-N 3.33Å; F2338-L2340 PolarHBondContact O-N 2.8Å; L2340-Q2342 PolarHBondContact O-N 3Å; L2340-L2343 PolarHBondContact O-N 3.14Å; L2340-I2344 HydrophobicContact CD1-CD1 4.1Å; L2340-I2344 HydrophobicContact CD1-CG2 4.24Å; L2340-I2344 HydrophobicContact CG-CD1 3.95Å; L2340-I2344 WeakPolarHBondContact O-CG1 3.36Å; L2340-I2344 PolarHBondContact O-N 2.82Å; L2340-Y2401 HydrophobicContact CD2-CE1 4.31Å; L2340-F2402 HydrophobicContact CD2-CD1 4.31Å; L2340-F2402 HydrophobicContact CD2-CE1 4.24Å; L2340-L2405 HydrophobicContact CD1-CB 4.21Å; L2340-L2405 HydrophobicContact CD2-CD1 4.31Å; L2340-I2406 HydrophobicContact CD1-CG1 4.44Å
2341	R	90.2	Very high	84.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.6	-40.5	177.1	-69.1	-166.8	-53.5	-86.9	2.3	112.2	F2337 F2338 L2343 I2344 M2345 D2349 L2421	F2337-R2341 WeakPolarHBondContact O-CG 3.41Å; F2337-R2341 PolarHBondContact O-N 3.41Å; F2338-R2341 PolarHBondContact O-N 3.45Å; R2341-L2343 VanDerWaalsContact C-N 3.31Å; R2341-L2343 PolarHBondContact O-N 3.33Å; R2341-I2344 PolarHBondContact O-N 3.04Å; R2341-M2345 HydrophobicContact CB-SD 4.07Å; R2341-M2345 HydrophobicContact CG-SD 4.01Å; R2341-M2345 WeakPolarHBondContact O-CA 3.43Å; R2341-M2345 WeakPolarHBondContact O-CB 3.32Å; R2341-M2345 WeakPolarHBondContact O-CG 3.34Å; R2341-M2345 PolarHBondContact O-N 2.89Å; R2341-D2349 IonicContact CZ-OD1 2.68Å; R2341-D2349 IonicContact CZ-OD2 3.38Å; R2341-D2349 IonicContact NE-OD1 2.79Å; R2341-D2349 PolarHBondContact NE-OD1 2.98Å; R2341-D2349 IonicContact NH2-OD1 2.81Å; R2341-D2349 PolarHBondContact NH2-OD1 2.98Å; R2341-D2349 IonicContact NH2-OD2 2.74Å; R2341-D2349 PolarHBondContact NH2-OD2 2.93Å; R2341-L2421 WeakPolarHBondContact CD-O 3.49Å; R2341-L2421 HydrophobicContact CG-CB 4.45Å; R2341-L2421 PolarHBondContact NH1-O 2.9Å
2342	Q	82.9	Confident	83.9	Confident	77 Å²	77	28.4 Å²	28.4	36%	0.36	15%	0.145	S	C	.	.	H	α-helix	trans	-63.1	-34.5	174.5	-67.1	-68.7	-6.7	0	0	112.9	F2338 R2339 L2340	F2338-Q2342 HydrophobicContact CD1-CG 3.96Å; F2338-Q2342 HydrophobicContact CE1-CG 3.69Å; F2338-Q2342 HydrophobicContact CZ-CG 4.02Å; F2338-Q2342 VanDerWaalsContact O-CG 3.31Å; F2338-Q2342 WeakPolarHBondContact O-CG 3.36Å; F2338-Q2342 PolarHBondContact O-N 3.32Å; R2339-Q2342 PolarHBondContact O-N 2.91Å; L2340-Q2342 PolarHBondContact O-N 3Å
2343	L	80.3	Confident	83.6	Confident	58 Å²	58	27 Å²	27	30%	0.304	14%	0.14	S	C	.	.	H	α-helix	trans	-75.3	-33.2	177.2	-75.9	168.1	0	0	0	113.7	L2039 R2339 L2340 R2341 I2406	L2039-L2343 HydrophobicContact CD2-CD1 4.43Å; L2039-L2343 HydrophobicContact CD2-CD2 4.3Å; L2039-L2343 HydrophobicContact CD2-CG 4.4Å; R2339-L2343 WeakPolarHBondContact O-CG 3.36Å; R2339-L2343 PolarHBondContact O-N 3.49Å; L2340-L2343 PolarHBondContact O-N 3.14Å; R2341-L2343 VanDerWaalsContact C-N 3.31Å; R2341-L2343 PolarHBondContact O-N 3.33Å; L2343-I2406 HydrophobicContact CD1-CB 4.47Å; L2343-I2406 HydrophobicContact CD1-CG1 4.04Å; L2343-I2406 HydrophobicContact CD1-CG2 3.95Å
2344	I	80.6	Confident	83.3	Confident	4 Å²	4	31.3 Å²	31.3	2%	0.021	16%	0.161	C	C	.	.	H	α-helix	trans	-112.4	-2	-172.5	76.7	-171.1	0	0	0	114.7	S1534 E1535 I1536 L2340 R2341 A2409 L2421	S1534-I2344 WeakPolarHBondContact O-CB 3.06Å; E1535-I2344 CarbonylContact C-O 3.51Å; E1535-I2344 WeakPolarHBondContact CA-O 3.26Å; I1536-I2344 HydrophobicContact CD1-CD1 4.08Å; I1536-I2344 HydrophobicContact CD1-CG1 4.12Å; I1536-I2344 HydrophobicContact CG1-CG1 4.49Å; I1536-I2344 PolarHBondContact N-O 2.8Å; L2340-I2344 HydrophobicContact CD1-CD1 4.1Å; L2340-I2344 HydrophobicContact CD1-CG2 4.24Å; L2340-I2344 HydrophobicContact CG-CD1 3.95Å; L2340-I2344 WeakPolarHBondContact O-CG1 3.36Å; L2340-I2344 PolarHBondContact O-N 2.82Å; R2341-I2344 PolarHBondContact O-N 3.04Å; I2344-A2409 HydrophobicContact CG2-CB 4.5Å; I2344-L2421 HydrophobicContact CD1-CD2 3.6Å
2345	M	80.4	Confident	83.2	Confident	3 Å²	3	31.6 Å²	31.6	2%	0.015	16%	0.163	C	C	.	.			trans	-123.7	107.5	178.1	-56.8	-174.7	55.1	0	0	110.3	I1536 R2341 N2347 G2348 S2351 F2352 F2381	I1536-M2345 HydrophobicContact CB-CG 4.29Å; I1536-M2345 HydrophobicContact CD1-CG 4.39Å; R2341-M2345 HydrophobicContact CB-SD 4.07Å; R2341-M2345 HydrophobicContact CG-SD 4.01Å; R2341-M2345 WeakPolarHBondContact O-CA 3.43Å; R2341-M2345 WeakPolarHBondContact O-CB 3.32Å; R2341-M2345 WeakPolarHBondContact O-CG 3.34Å; R2341-M2345 PolarHBondContact O-N 2.89Å; M2345-N2347 PolarHBondContact O-N 3.04Å; M2345-N2347 VanDerWaalsContact O-N 3.14Å; M2345-G2348 PolarHBondContact O-N 3.22Å; M2345-S2351 WeakPolarHBondContact CE-OG 3.28Å; M2345-F2352 HydrophobicContact CE-CB 3.82Å; M2345-F2352 HydrophobicContact SD-CB 4.15Å; M2345-F2352 HydrophobicContact SD-CD2 4.38Å; M2345-F2381 HydrophobicContact CE-CZ 3.86Å; M2345-F2381 HydrophobicContact SD-CZ 4.45Å
2346	P	63	Low	83.3	Confident	80 Å²	80	31.6 Å²	31.6	52%	0.519	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-18.6	-174	27.1	-34.8	0	0	0	114	I1536 R1537	I1536-P2346 WeakPolarHBondContact O-CD 3.44Å; R1537-P2346 HydrophobicContact CG-CG 4.35Å
2347	N	66.8	Low	83.1	Confident	88 Å²	88	32.1 Å²	32.1	47%	0.471	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-96.7	8	174.8	-64.5	59.3	0	0	0	112.7	V1538 M2345	V1538-N2347 HydrophobicContact CB-CB 4.28Å; V1538-N2347 HydrophobicContact CG2-CB 3.95Å; M2345-N2347 PolarHBondContact O-N 3.04Å; M2345-N2347 VanDerWaalsContact O-N 3.14Å
2348	G	68.5	Low	82.8	Confident	10 Å²	10	35.8 Å²	35.8	10%	0.103	18%	0.183	C	C	.	.	H	α-helix	trans	57.7	-164	178	0	0	0	0	0	114.9	M2345 L2350 S2351	M2345-G2348 PolarHBondContact O-N 3.22Å; G2348-L2350 VanDerWaalsContact C-N 3.33Å; G2348-L2350 PolarHBondContact O-N 3.33Å; G2348-S2351 PolarHBondContact O-N 3.22Å; G2348-S2351 PolarHBondContact O-OG 3.01Å
2349	D	80.7	Confident	82.8	Confident	14 Å²	14	36 Å²	36	8%	0.075	18%	0.184	C	C	.	.	H	α-helix	trans	-67.1	-29.5	-168.3	-148.9	13.9	0	0	0	114.1	F2338 R2341 S2351 F2352 I2353	F2338-D2349 HydrophobicContact CD2-CB 4.41Å; F2338-D2349 WeakPolarHBondContact CD2-OD2 3.24Å; F2338-D2349 HydrophobicContact CE2-CB 4.18Å; R2341-D2349 IonicContact CZ-OD1 2.68Å; R2341-D2349 IonicContact CZ-OD2 3.38Å; R2341-D2349 IonicContact NE-OD1 2.79Å; R2341-D2349 PolarHBondContact NE-OD1 2.98Å; R2341-D2349 IonicContact NH2-OD1 2.81Å; R2341-D2349 PolarHBondContact NH2-OD1 2.98Å; R2341-D2349 IonicContact NH2-OD2 2.74Å; R2341-D2349 PolarHBondContact NH2-OD2 2.93Å; D2349-S2351 PolarHBondContact O-N 2.98Å; D2349-F2352 WeakPolarHBondContact O-CB 3.43Å; D2349-F2352 PolarHBondContact O-N 3.27Å; D2349-I2353 WeakPolarHBondContact O-CG1 3.32Å; D2349-I2353 PolarHBondContact O-N 3.19Å
2350	L	80.4	Confident	82.8	Confident	96 Å²	96	36.3 Å²	36.3	50%	0.503	19%	0.186	S	C	.	.	H	α-helix	trans	-57.1	-37.5	177.5	-67.2	175	0	0	0	112.1	G2348 Q2354	G2348-L2350 VanDerWaalsContact C-N 3.33Å; G2348-L2350 PolarHBondContact O-N 3.33Å; L2350-Q2354 WeakPolarHBondContact O-CB 3.22Å; L2350-Q2354 VanDerWaalsContact O-CG 3.28Å; L2350-Q2354 WeakPolarHBondContact O-CG 3.28Å; L2350-Q2354 PolarHBondContact O-N 3.09Å
2351	S	80.8	Confident	82.6	Confident	5 Å²	5	43.1 Å²	43.1	4%	0.035	22%	0.218	C	C	.	.	H	α-helix	trans	-72.9	-27.8	178.5	69.2	0	0	0	0	113.5	M2345 G2348 D2349 S2355	M2345-S2351 WeakPolarHBondContact CE-OG 3.28Å; G2348-S2351 PolarHBondContact O-N 3.22Å; G2348-S2351 PolarHBondContact O-OG 3.01Å; D2349-S2351 PolarHBondContact O-N 2.98Å; S2351-S2355 PolarHBondContact O-N 2.76Å; S2351-S2355 PolarHBondContact O-OG 2.79Å
2352	F	89.8	Confident	82.1	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-70.8	-47.4	173	177.2	-107	0	0	0	110.9	L2179 M2345 D2349 Q2354 S2355 L2356 F2381 L2421 F2424 V2443	L2179-F2352 HydrophobicContact CD1-CD1 4.17Å; L2179-F2352 HydrophobicContact CD1-CE1 3.91Å; M2345-F2352 HydrophobicContact CE-CB 3.82Å; M2345-F2352 HydrophobicContact SD-CB 4.15Å; M2345-F2352 HydrophobicContact SD-CD2 4.38Å; D2349-F2352 WeakPolarHBondContact O-CB 3.43Å; D2349-F2352 PolarHBondContact O-N 3.27Å; F2352-Q2354 PolarHBondContact O-N 2.6Å; F2352-S2355 PolarHBondContact O-N 3.47Å; F2352-L2356 HydrophobicContact CD1-CD1 4.05Å; F2352-L2356 HydrophobicContact CE1-CD1 3.57Å; F2352-L2356 HydrophobicContact CE2-CD1 4.27Å; F2352-L2356 HydrophobicContact CZ-CD1 3.7Å; F2352-L2356 PolarHBondContact O-N 3.07Å; F2352-L2356 VanDerWaalsContact O-N 3.14Å; F2352-F2381 HydrophobicContact CD2-CD2 4.26Å; F2352-F2381 AromaticContact CD2-CE2 3.74Å; F2352-F2381 HydrophobicContact CD2-CE2 3.74Å; F2352-F2381 AromaticContact CD2-CZ 3.9Å; F2352-F2381 HydrophobicContact CD2-CZ 3.9Å; F2352-F2381 HydrophobicContact CE2-CE2 4.44Å; F2352-L2421 HydrophobicContact CD2-CB 4.43Å; F2352-L2421 HydrophobicContact CE2-CB 3.71Å; F2352-L2421 HydrophobicContact CE2-CD1 4.33Å; F2352-L2421 HydrophobicContact CZ-CB 4.31Å; F2352-F2424 HydrophobicContact CE1-CZ 4.02Å; F2352-F2424 HydrophobicContact CZ-CE2 4.28Å; F2352-F2424 HydrophobicContact CZ-CZ 4.18Å; F2352-V2443 HydrophobicContact CE2-CB 4.28Å; F2352-V2443 HydrophobicContact CE2-CG1 3.68Å; F2352-V2443 HydrophobicContact CZ-CB 4.17Å; F2352-V2443 HydrophobicContact CZ-CG1 4.02Å; F2352-V2443 HydrophobicContact CZ-CG2 4.49Å
2353	I	89.2	Confident	81.5	Confident	5 Å²	5	46.1 Å²	46.1	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-46.1	176.3	-66.5	168.9	0	0	0	111.3	P2162 V2164 A2176 L2179 T2180 D2349 S2355 L2356 S2357	P2162-I2353 HydrophobicContact CG-CG2 4.27Å; V2164-I2353 HydrophobicContact CG2-CG2 4.33Å; A2176-I2353 HydrophobicContact CB-CG2 4.27Å; L2179-I2353 HydrophobicContact CB-CD1 3.75Å; L2179-I2353 HydrophobicContact CB-CG1 3.7Å; L2179-I2353 HydrophobicContact CD1-CG1 4.07Å; T2180-I2353 HydrophobicContact CG2-CG2 3.58Å; D2349-I2353 WeakPolarHBondContact O-CG1 3.32Å; D2349-I2353 PolarHBondContact O-N 3.19Å; I2353-S2355 PolarHBondContact O-N 3.2Å; I2353-L2356 PolarHBondContact O-N 3.11Å; I2353-S2357 PolarHBondContact O-N 3.34Å; I2353-S2357 VanDerWaalsContact O-N 3.14Å
2354	Q	85.7	Confident	80.8	Confident	108 Å²	108	44.8 Å²	44.8	51%	0.505	23%	0.23	S	C	.	.	H	α-helix	trans	-60.2	-44.2	178.1	-78.2	175.1	-1.3	0	0	112.4	P2162 L2350 F2352 L2356 S2357	P2162-Q2354 HydrophobicContact CB-CG 3.93Å; P2162-Q2354 HydrophobicContact CG-CG 4.14Å; L2350-Q2354 WeakPolarHBondContact O-CB 3.22Å; L2350-Q2354 VanDerWaalsContact O-CG 3.28Å; L2350-Q2354 WeakPolarHBondContact O-CG 3.28Å; L2350-Q2354 PolarHBondContact O-N 3.09Å; F2352-Q2354 PolarHBondContact O-N 2.6Å; Q2354-L2356 PolarHBondContact O-N 2.84Å; Q2354-S2357 WeakPolarHBondContact O-CB 3.18Å; Q2354-S2357 PolarHBondContact O-N 2.63Å; Q2354-S2357 PolarHBondContact O-OG 2.56Å
2355	S	89.3	Confident	79.6	Confident	6 Å²	6	52.6 Å²	52.6	4%	0.042	26%	0.259	C	S	.	.	H	α-helix	trans	-62.7	-39.9	176	-61.1	0	0	0	0	112.1	S2351 F2352 I2353 S2357 T2376 D2378 R2380	S2351-S2355 PolarHBondContact O-N 2.76Å; S2351-S2355 PolarHBondContact O-OG 2.79Å; F2352-S2355 PolarHBondContact O-N 3.47Å; I2353-S2355 PolarHBondContact O-N 3.2Å; S2355-S2357 VanDerWaalsContact C-N 3.3Å; S2355-S2357 PolarHBondContact O-N 3.07Å; S2355-T2376 VanDerWaalsContact O-CB 3.25Å; S2355-T2376 WeakPolarHBondContact O-CB 3.42Å; S2355-T2376 WeakPolarHBondContact O-CG2 3.42Å; S2355-D2378 WeakPolarHBondContact CB-OD2 3.35Å; S2355-D2378 PolarHBondContact OG-OD2 3.42Å; S2355-R2380 PolarHBondContact OG-NH1 3.5Å
2356	L	90.8	Very high	78.3	Confident	0 Å²	0	55.1 Å²	55.1	0%	0	29%	0.286	C	S	.	.	H	α-helix	trans	-70.4	-21.4	-180	-73.8	177	0	0	0	114.6	T2172 I2175 A2176 L2179 F2352 I2353 Q2354 R2358 T2376 I2383 V2443	T2172-L2356 CarbonylContact C-O 3.56Å; T2172-L2356 WeakPolarHBondContact CB-O 3.36Å; T2172-L2356 PolarHBondContact OG1-O 3.27Å; I2175-L2356 HydrophobicContact CG2-CD1 4.18Å; A2176-L2356 HydrophobicContact CB-CB 4.03Å; L2179-L2356 HydrophobicContact CD1-CD1 4.4Å; F2352-L2356 HydrophobicContact CD1-CD1 4.05Å; F2352-L2356 HydrophobicContact CE1-CD1 3.57Å; F2352-L2356 HydrophobicContact CE2-CD1 4.27Å; F2352-L2356 HydrophobicContact CZ-CD1 3.7Å; F2352-L2356 PolarHBondContact O-N 3.07Å; F2352-L2356 VanDerWaalsContact O-N 3.14Å; I2353-L2356 PolarHBondContact O-N 3.11Å; Q2354-L2356 PolarHBondContact O-N 2.84Å; L2356-R2358 PolarHBondContact O-N 2.93Å; L2356-R2358 VanDerWaalsContact O-N 3.08Å; L2356-T2376 HydrophobicContact CD2-CG2 4.19Å; L2356-I2383 HydrophobicContact CD2-CD1 4.4Å; L2356-I2383 HydrophobicContact CD2-CG1 4.22Å; L2356-V2443 HydrophobicContact CD1-CG2 4.45Å; L2356-V2443 HydrophobicContact CD2-CG1 4.07Å; L2356-V2443 HydrophobicContact CD2-CG2 3.94Å
2357	S	87.4	Confident	77.8	Confident	34 Å²	34	53.9 Å²	53.9	24%	0.238	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-26.2	-177.8	70.5	0	0	0	0	114.5	I2353 Q2354 S2355	I2353-S2357 PolarHBondContact O-N 3.34Å; I2353-S2357 VanDerWaalsContact O-N 3.14Å; Q2354-S2357 WeakPolarHBondContact O-CB 3.18Å; Q2354-S2357 PolarHBondContact O-N 2.63Å; Q2354-S2357 PolarHBondContact O-OG 2.56Å; S2355-S2357 VanDerWaalsContact C-N 3.3Å; S2355-S2357 PolarHBondContact O-N 3.07Å
2358	R	87.1	Confident	77.2	Confident	77 Å²	77	58.5 Å²	58.5	29%	0.291	30%	0.303	S	S	.	.	S	Bend	trans	-140.1	128.6	175.5	-68.9	-62.6	-169.1	138.7	8	111.4	E2170 L2356 R2377	E2170-R2358 WeakPolarHBondContact OE1-CD 3.19Å; E2170-R2358 IonicContact OE1-CZ 3.73Å; E2170-R2358 IonicContact OE1-NE 2.77Å; E2170-R2358 IonicContact OE1-NH1 2.82Å; E2170-R2358 PolarHBondContact OE1-NH1 3.24Å; E2170-R2358 WeakPolarHBondContact OE2-CA 3.4Å; E2170-R2358 WeakPolarHBondContact OE2-CD 3.21Å; L2356-R2358 PolarHBondContact O-N 2.93Å; L2356-R2358 VanDerWaalsContact O-N 3.08Å; R2358-R2377 HydrophobicContact CB-CB 3.79Å; R2358-R2377 WeakPolarHBondContact O-CB 3.34Å; R2358-R2377 PolarHBondContact O-N 2.85Å
2359	C	88.7	Confident	76.6	Confident	8 Å²	8	61.9 Å²	61.9	5%	0.054	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.9	155.5	179.9	-68.8	0	0	0	0	111.7	E2170 T2172 M2374 K2375	E2170-C2359 PolarHBondContact OE2-N 3.42Å; T2172-C2359 HydrophobicContact CG2-CB 3.96Å; T2172-C2359 WeakPolarHBondContact OG1-CB 3.28Å; T2172-C2359 PolarHBondContact OG1-SG 3.19Å; C2359-M2374 HydrophobicContact CB-CE 3.82Å; C2359-K2375 CarbonylContact C-O 3.58Å; C2359-K2375 WeakPolarHBondContact CA-O 3.4Å; C2359-K2375 WeakPolarHBondContact CB-O 3.44Å
2360	Y	87.5	Confident	75.9	Confident	89 Å²	89	65 Å²	65	35%	0.349	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	145.5	175.2	69.4	-79.5	0	0	0	110.7	W2362 M2374 K2375 E2379	Y2360-W2362 PolarHBondContact O-N 3.46Å; Y2360-M2374 CarbonylContact O-C 3.6Å; Y2360-M2374 WeakPolarHBondContact O-CA 3.47Å; Y2360-M2374 VanDerWaalsContact O-CB 3.32Å; Y2360-M2374 WeakPolarHBondContact O-CB 3.19Å; Y2360-K2375 HydrophobicContact CD1-CB 4.18Å; Y2360-K2375 WeakPolarHBondContact CD1-O 3.24Å; Y2360-K2375 HydrophobicContact CE1-CB 3.51Å; Y2360-K2375 HydrophobicContact CE2-CB 4.42Å; Y2360-K2375 PolarHBondContact N-O 3.38Å; Y2360-K2375 PolarHBondContact O-N 2.8Å; Y2360-K2375 WeakPolarHBondContact OH-CD 3.4Å; Y2360-E2379 HydrophobicContact CE1-CG 4.47Å
2361	Q	83.9	Confident	75.9	Confident	144 Å²	144	61.5 Å²	61.5	67%	0.673	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.4	133	174.2	-178.3	172.4	0.7	0	0	110.1	L2372	Q2361-L2372 HydrophobicContact CG-CD1 3.74Å
2362	W	80.8	Confident	76	Confident	58 Å²	58	63.2 Å²	63.2	22%	0.22	35%	0.352	C	S	.	.			trans	-116.4	112.3	-178.9	175.9	37.9	0	0	0	109.9	Y2360 A2364 F2373 K2375 V2382	Y2360-W2362 PolarHBondContact O-N 3.46Å; W2362-A2364 PolarHBondContact O-N 3.37Å; W2362-F2373 PolarHBondContact N-O 2.85Å; W2362-K2375 HydrophobicContact CB-CD 4.38Å; W2362-K2375 HydrophobicContact CB-CG 4.37Å; W2362-K2375 HydrophobicContact CD2-CD 3.86Å; W2362-K2375 HydrophobicContact CD2-CG 4.3Å; W2362-K2375 HydrophobicContact CE3-CD 3.96Å; W2362-K2375 HydrophobicContact CE3-CG 4.02Å; W2362-K2375 HydrophobicContact CG-CD 4.03Å; W2362-K2375 HydrophobicContact CG-CG 4.45Å; W2362-K2375 VanDerWaalsContact CZ2-NZ 3.27Å; W2362-V2382 HydrophobicContact CE3-CG1 4.43Å; W2362-V2382 HydrophobicContact CZ3-CG1 4.29Å; W2362-V2382 HydrophobicContact CZ3-CG2 4.11Å
2363	D	69.1	Low	76	Confident	82 Å²	82	65.2 Å²	65.2	44%	0.439	36%	0.361	S	S	.	.			trans	-69.2	88.1	175.4	-176.1	3	0	0	0	110.6	R2365	D2363-R2365 PolarHBondContact O-N 3.05Å; D2363-R2365 WeakPolarHBondContact OD1-CG 3.21Å; D2363-R2365 IonicContact OD1-NE 3.96Å; D2363-R2365 IonicContact OD2-CZ 2.72Å; D2363-R2365 IonicContact OD2-NE 3.17Å; D2363-R2365 PolarHBondContact OD2-NE 2.89Å; D2363-R2365 IonicContact OD2-NH2 3.89Å; D2363-R2365 PolarHBondContact OD2-NH2 3.17Å
2364	A	65.7	Low	76	Confident	30 Å²	30	65.6 Å²	65.6	25%	0.248	36%	0.363	C	S	.	.			trans	-78	62.9	-179.6	0	0	0	0	0	111.9	W2362 G2366 G2367 F2373	W2362-A2364 PolarHBondContact O-N 3.37Å; A2364-G2366 PolarHBondContact O-N 2.83Å; A2364-G2367 PolarHBondContact O-N 2.81Å; A2364-F2373 HydrophobicContact CB-CB 4.31Å; A2364-F2373 HydrophobicContact CB-CD2 3.91Å; A2364-F2373 HydrophobicContact CB-CE2 4.42Å; A2364-F2373 HydrophobicContact CB-CG 4.12Å
2365	R	55.5	Low	76.2	Confident	168 Å²	168	61.4 Å²	61.4	63%	0.634	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.2	108.5	-179.7	-64.1	-168.6	-177.8	-172.6	0.5	111.7	D2363	D2363-R2365 PolarHBondContact O-N 3.05Å; D2363-R2365 WeakPolarHBondContact OD1-CG 3.21Å; D2363-R2365 IonicContact OD1-NE 3.96Å; D2363-R2365 IonicContact OD2-CZ 2.72Å; D2363-R2365 IonicContact OD2-NE 3.17Å; D2363-R2365 PolarHBondContact OD2-NE 2.89Å; D2363-R2365 IonicContact OD2-NH2 3.89Å; D2363-R2365 PolarHBondContact OD2-NH2 3.17Å
2366	G	54.8	Low	76.4	Confident	56 Å²	56	61.1 Å²	61.1	58%	0.577	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	145	-25.2	-176.3	0	0	0	0	0	113.4	A2364	A2364-G2366 PolarHBondContact O-N 2.83Å
2367	G	52.2	Low	76.1	Confident	53 Å²	53	69.7 Å²	69.7	55%	0.546	37%	0.373	S	S	.	.			trans	-71.2	135.3	179	0	0	0	0	0	114.3	A2364	A2364-G2367 PolarHBondContact O-N 2.81Å
2368	K	54.1	Low	76	Confident	185 Å²	185	69.7 Å²	69.7	80%	0.804	37%	0.371	S	S	*	.	S	Bend	trans	-87.5	-6.2	170.1	-69.7	176.4	-178	164.9	0	113.7
2369	S	54.7	Low	76.1	Confident	82 Å²	82	68.6 Å²	68.6	57%	0.573	37%	0.369	S	S	*	.	S	Bend	trans	-85.9	-22.6	-167.1	49.2	0	0	0	0	114.6	S2371	S2369-S2371 PolarHBondContact O-N 3.14Å; S2369-S2371 PolarHBondContact OG-OG 3.07Å
2370	G	66.3	Low	75.9	Confident	79 Å²	79	68.8 Å²	68.8	81%	0.814	37%	0.369	S	S	*	.			trans	68.5	-8.9	-173.8	0	0	0	0	0	115.5
2371	S	79.8	Confident	76.2	Confident	22 Å²	22	64.5 Å²	64.5	15%	0.154	35%	0.352	C	S	.	.			trans	-55.3	134.9	178.3	53.7	0	0	0	0	112.7	S2369 F2373	S2369-S2371 PolarHBondContact O-N 3.14Å; S2369-S2371 PolarHBondContact OG-OG 3.07Å; S2371-F2373 VanDerWaalsContact O-CD2 3.23Å; S2371-F2373 WeakPolarHBondContact O-CD2 3.41Å; S2371-F2373 PolarHBondContact O-N 3.32Å; S2371-F2373 WeakPolarHBondContact OG-CE2 3.3Å
2372	L	84	Confident	76.6	Confident	41 Å²	41	58.1 Å²	58.1	22%	0.215	32%	0.323	C	S	.	.			trans	-62.3	130.8	177	-179.9	63.2	0	0	0	111.6	F2171 Q2361 M2374 E2385	F2171-L2372 HydrophobicContact CE1-CD2 3.86Å; F2171-L2372 HydrophobicContact CZ-CD2 4.28Å; Q2361-L2372 HydrophobicContact CG-CD1 3.74Å; L2372-M2374 HydrophobicContact CG-CG 4.37Å; L2372-E2385 HydrophobicContact CB-CB 4.03Å; L2372-E2385 WeakPolarHBondContact CB-OE2 3.42Å; L2372-E2385 PolarHBondContact N-OE2 2.67Å; L2372-E2385 PolarHBondContact O-N 2.97Å
2373	F	89.4	Confident	77.2	Confident	42 Å²	42	55.5 Å²	55.5	18%	0.184	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	139.4	169.4	-74.4	-88.6	0	0	0	110.3	W2362 A2364 S2371 V2382 I2383 K2384	W2362-F2373 PolarHBondContact N-O 2.85Å; A2364-F2373 HydrophobicContact CB-CB 4.31Å; A2364-F2373 HydrophobicContact CB-CD2 3.91Å; A2364-F2373 HydrophobicContact CB-CE2 4.42Å; A2364-F2373 HydrophobicContact CB-CG 4.12Å; S2371-F2373 VanDerWaalsContact O-CD2 3.23Å; S2371-F2373 WeakPolarHBondContact O-CD2 3.41Å; S2371-F2373 PolarHBondContact O-N 3.32Å; S2371-F2373 WeakPolarHBondContact OG-CE2 3.3Å; F2373-V2382 HydrophobicContact CD1-CG1 3.96Å; F2373-I2383 WeakPolarHBondContact CA-O 3.41Å; F2373-K2384 HydrophobicContact CD1-CB 3.96Å; F2373-K2384 HydrophobicContact CD1-CG 4.25Å; F2373-K2384 HydrophobicContact CE1-CB 3.77Å; F2373-K2384 HydrophobicContact CE1-CD 3.72Å; F2373-K2384 HydrophobicContact CE1-CG 3.72Å; F2373-K2384 HydrophobicContact CZ-CD 3.8Å; F2373-K2384 HydrophobicContact CZ-CG 3.97Å
2374	M	89.4	Confident	78.4	Confident	13 Å²	13	52.2 Å²	52.2	6%	0.064	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	163	170.8	-52.7	-179.9	78.5	0	0	110.3	F2171 T2172 C2359 Y2360 L2372 V2382 I2383	F2171-M2374 HydrophobicContact CD1-SD 4.42Å; F2171-M2374 HydrophobicContact CE1-SD 3.58Å; F2171-M2374 VanDerWaalsContact CE1-SD 3.58Å; F2171-M2374 HydrophobicContact CE2-SD 4.2Å; F2171-M2374 HydrophobicContact CZ-SD 3.44Å; F2171-M2374 WeakPolarHBondContact CZ-SD 3.24Å; T2172-M2374 HydrophobicContact CG2-SD 4.26Å; C2359-M2374 HydrophobicContact CB-CE 3.82Å; Y2360-M2374 CarbonylContact O-C 3.6Å; Y2360-M2374 WeakPolarHBondContact O-CA 3.47Å; Y2360-M2374 VanDerWaalsContact O-CB 3.32Å; Y2360-M2374 WeakPolarHBondContact O-CB 3.19Å; L2372-M2374 HydrophobicContact CG-CG 4.37Å; M2374-V2382 WeakPolarHBondContact O-CA 3.33Å; M2374-I2383 HydrophobicContact CB-CB 4.23Å; M2374-I2383 HydrophobicContact CB-CD1 4.29Å; M2374-I2383 PolarHBondContact N-O 2.88Å; M2374-I2383 PolarHBondContact O-N 3Å
2375	K	90.6	Very high	79.6	Confident	20 Å²	20	53.9 Å²	53.9	9%	0.087	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	148.7	167.1	-84.2	172.2	172.2	163.3	0	110.1	C2359 Y2360 W2362 F2381 V2382	C2359-K2375 CarbonylContact C-O 3.58Å; C2359-K2375 WeakPolarHBondContact CA-O 3.4Å; C2359-K2375 WeakPolarHBondContact CB-O 3.44Å; Y2360-K2375 HydrophobicContact CD1-CB 4.18Å; Y2360-K2375 WeakPolarHBondContact CD1-O 3.24Å; Y2360-K2375 HydrophobicContact CE1-CB 3.51Å; Y2360-K2375 HydrophobicContact CE2-CB 4.42Å; Y2360-K2375 PolarHBondContact N-O 3.38Å; Y2360-K2375 PolarHBondContact O-N 2.8Å; Y2360-K2375 WeakPolarHBondContact OH-CD 3.4Å; W2362-K2375 HydrophobicContact CB-CD 4.38Å; W2362-K2375 HydrophobicContact CB-CG 4.37Å; W2362-K2375 HydrophobicContact CD2-CD 3.86Å; W2362-K2375 HydrophobicContact CD2-CG 4.3Å; W2362-K2375 HydrophobicContact CE3-CD 3.96Å; W2362-K2375 HydrophobicContact CE3-CG 4.02Å; W2362-K2375 HydrophobicContact CG-CD 4.03Å; W2362-K2375 HydrophobicContact CG-CG 4.45Å; W2362-K2375 VanDerWaalsContact CZ2-NZ 3.27Å; K2375-F2381 WeakPolarHBondContact CA-O 3.45Å; K2375-V2382 HydrophobicContact CG-CG2 4.2Å
2376	T	91.7	Very high	81.3	Confident	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	152.5	166.9	54.3	0	0	0	0	110.7	S2355 L2356 D2378 E2379 R2380 F2381 I2383	S2355-T2376 VanDerWaalsContact O-CB 3.25Å; S2355-T2376 WeakPolarHBondContact O-CB 3.42Å; S2355-T2376 WeakPolarHBondContact O-CG2 3.42Å; L2356-T2376 HydrophobicContact CD2-CG2 4.19Å; T2376-D2378 WeakPolarHBondContact CB-OD1 3.22Å; T2376-D2378 PolarHBondContact O-N 2.83Å; T2376-D2378 PolarHBondContact OG1-OD1 2.79Å; T2376-E2379 WeakPolarHBondContact O-CA 3.33Å; T2376-E2379 PolarHBondContact O-N 3.12Å; T2376-R2380 PolarHBondContact OG1-N 2.87Å; T2376-R2380 VanDerWaalsContact OG1-N 3.11Å; T2376-F2381 HydrophobicContact CG2-CB 3.87Å; T2376-F2381 HydrophobicContact CG2-CD2 4.08Å; T2376-F2381 HydrophobicContact CG2-CG 4.47Å; T2376-F2381 PolarHBondContact N-O 2.71Å; T2376-F2381 PolarHBondContact OG1-N 3.47Å; T2376-I2383 HydrophobicContact CG2-CD1 3.99Å
2377	R	86.2	Confident	82.9	Confident	180 Å²	180	46 Å²	46	68%	0.679	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-24.1	-177.2	-177.4	176.1	176.3	-174.8	0.1	113.4	R2358 E2379	R2358-R2377 HydrophobicContact CB-CB 3.79Å; R2358-R2377 WeakPolarHBondContact O-CB 3.34Å; R2358-R2377 PolarHBondContact O-N 2.85Å; R2377-E2379 VanDerWaalsContact C-N 3.27Å
2378	D	85.3	Confident	84.6	Confident	34 Å²	34	48.4 Å²	48.4	18%	0.182	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	3.6	171.6	67.8	-10.7	0	0	0	113.6	V1541 S2355 T2376 R2380 Y2449	V1541-D2378 HydrophobicContact CG2-CB 4.36Å; S2355-D2378 WeakPolarHBondContact CB-OD2 3.35Å; S2355-D2378 PolarHBondContact OG-OD2 3.42Å; T2376-D2378 WeakPolarHBondContact CB-OD1 3.22Å; T2376-D2378 PolarHBondContact O-N 2.83Å; T2376-D2378 PolarHBondContact OG1-OD1 2.79Å; D2378-R2380 PolarHBondContact O-N 3.23Å; D2378-R2380 VanDerWaalsContact OD1-CB 3.28Å; D2378-R2380 WeakPolarHBondContact OD1-CB 3.43Å; D2378-R2380 PolarHBondContact OD1-N 3.45Å; D2378-R2380 VanDerWaalsContact OD1-N 3.07Å; D2378-R2380 WeakPolarHBondContact OD2-CB 3.36Å; D2378-R2380 IonicContact OD2-CZ 2.71Å; D2378-R2380 IonicContact OD2-NE 2.74Å; D2378-R2380 IonicContact OD2-NH1 2.66Å; D2378-R2380 PolarHBondContact OD2-NH1 2.84Å; D2378-R2380 IonicContact OD2-NH2 3.77Å; D2378-Y2449 VanDerWaalsContact O-CE2 3.24Å; D2378-Y2449 WeakPolarHBondContact O-CE2 3.28Å
2379	E	88.1	Confident	86.2	Confident	54 Å²	54	42.4 Å²	42.4	25%	0.252	24%	0.243	S	C	.	.	S	Bend	trans	57.7	18.5	-174.2	-56.2	-175.9	171.2	0	0	114.3	Y2360 T2376 R2377 N2446 K2532	Y2360-E2379 HydrophobicContact CE1-CG 4.47Å; T2376-E2379 WeakPolarHBondContact O-CA 3.33Å; T2376-E2379 PolarHBondContact O-N 3.12Å; R2377-E2379 VanDerWaalsContact C-N 3.27Å; E2379-N2446 WeakPolarHBondContact O-CB 3.45Å; E2379-N2446 PolarHBondContact O-ND2 3.26Å; E2379-K2532 VanDerWaalsContact CD-NZ 3.33Å; E2379-K2532 IonicContact OE1-NZ 3.29Å; E2379-K2532 PolarHBondContact OE1-NZ 2.97Å; E2379-K2532 IonicContact OE2-NZ 3.39Å; E2379-K2532 PolarHBondContact OE2-NZ 3.4Å
2380	R	85.6	Confident	87.9	Confident	12 Å²	12	39.8 Å²	39.8	5%	0.045	22%	0.222	C	C	.	.			trans	-79.1	-40.4	-176.7	-175.2	178.9	-69.5	139.3	6	115	S2355 T2376 D2378 N2446 Y2449	S2355-R2380 PolarHBondContact OG-NH1 3.5Å; T2376-R2380 PolarHBondContact OG1-N 2.87Å; T2376-R2380 VanDerWaalsContact OG1-N 3.11Å; D2378-R2380 PolarHBondContact O-N 3.23Å; D2378-R2380 VanDerWaalsContact OD1-CB 3.28Å; D2378-R2380 WeakPolarHBondContact OD1-CB 3.43Å; D2378-R2380 PolarHBondContact OD1-N 3.45Å; D2378-R2380 VanDerWaalsContact OD1-N 3.07Å; D2378-R2380 WeakPolarHBondContact OD2-CB 3.36Å; D2378-R2380 IonicContact OD2-CZ 2.71Å; D2378-R2380 IonicContact OD2-NE 2.74Å; D2378-R2380 IonicContact OD2-NH1 2.66Å; D2378-R2380 PolarHBondContact OD2-NH1 2.84Å; D2378-R2380 IonicContact OD2-NH2 3.77Å; R2380-N2446 VanDerWaalsContact O-CB 3.22Å; R2380-N2446 WeakPolarHBondContact O-CB 3.47Å; R2380-N2446 PolarHBondContact O-N 3.18Å; R2380-Y2449 HydrophobicContact CB-CD2 3.93Å; R2380-Y2449 HydrophobicContact CB-CE2 3.99Å; R2380-Y2449 HydrophobicContact CB-CG 4.28Å; R2380-Y2449 HydrophobicContact CG-CD1 4.28Å; R2380-Y2449 HydrophobicContact CG-CD2 4.44Å; R2380-Y2449 HydrophobicContact CG-CE1 4.35Å; R2380-Y2449 HydrophobicContact CG-CG 4.33Å; R2380-Y2449 PolarHBondContact NH2-OH 3.09Å
2381	F	93.3	Very high	89.1	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	145.7	-176.5	-54.5	-58.1	0	0	0	111.3	M2345 F2352 K2375 T2376 L2421 V2443 M2444	M2345-F2381 HydrophobicContact CE-CZ 3.86Å; M2345-F2381 HydrophobicContact SD-CZ 4.45Å; F2352-F2381 HydrophobicContact CD2-CD2 4.26Å; F2352-F2381 AromaticContact CD2-CE2 3.74Å; F2352-F2381 HydrophobicContact CD2-CE2 3.74Å; F2352-F2381 AromaticContact CD2-CZ 3.9Å; F2352-F2381 HydrophobicContact CD2-CZ 3.9Å; F2352-F2381 HydrophobicContact CE2-CE2 4.44Å; K2375-F2381 WeakPolarHBondContact CA-O 3.45Å; T2376-F2381 HydrophobicContact CG2-CB 3.87Å; T2376-F2381 HydrophobicContact CG2-CD2 4.08Å; T2376-F2381 HydrophobicContact CG2-CG 4.47Å; T2376-F2381 PolarHBondContact N-O 2.71Å; T2376-F2381 PolarHBondContact OG1-N 3.47Å; F2381-L2421 HydrophobicContact CD1-CD1 3.5Å; F2381-L2421 VanDerWaalsContact CD1-CD1 3.5Å; F2381-L2421 HydrophobicContact CE1-CD1 3.2Å; F2381-L2421 HydrophobicContact CZ-CD1 4.06Å; F2381-V2443 HydrophobicContact CB-CG1 3.83Å; F2381-V2443 HydrophobicContact CG-CG1 4.14Å; F2381-M2444 WeakPolarHBondContact CA-O 3.23Å; F2381-M2444 WeakPolarHBondContact CB-O 3.38Å
2382	V	92.3	Very high	89.6	Confident	10 Å²	10	41.5 Å²	41.5	6%	0.061	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	133.9	166.6	178.5	0	0	0	0	107.7	W2362 F2373 M2374 K2375 M2444 N2446	W2362-V2382 HydrophobicContact CE3-CG1 4.43Å; W2362-V2382 HydrophobicContact CZ3-CG1 4.29Å; W2362-V2382 HydrophobicContact CZ3-CG2 4.11Å; F2373-V2382 HydrophobicContact CD1-CG1 3.96Å; M2374-V2382 WeakPolarHBondContact O-CA 3.33Å; K2375-V2382 HydrophobicContact CG-CG2 4.2Å; V2382-M2444 HydrophobicContact CB-CG 3.96Å; V2382-M2444 HydrophobicContact CG1-CG 4.48Å; V2382-M2444 PolarHBondContact N-O 3.02Å; V2382-M2444 WeakPolarHBondContact O-CG 3.45Å; V2382-M2444 PolarHBondContact O-N 2.9Å; V2382-N2446 HydrophobicContact CG2-CB 3.95Å
2383	I	93.8	Very high	90	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.01	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	127.2	171.3	-53	86.7	0	0	0	106.7	T2172 L2356 F2373 M2374 T2376 V2441 L2442 V2443	T2172-I2383 HydrophobicContact CG2-CD1 4.45Å; T2172-I2383 HydrophobicContact CG2-CG1 4.23Å; L2356-I2383 HydrophobicContact CD2-CD1 4.4Å; L2356-I2383 HydrophobicContact CD2-CG1 4.22Å; F2373-I2383 WeakPolarHBondContact CA-O 3.41Å; M2374-I2383 HydrophobicContact CB-CB 4.23Å; M2374-I2383 HydrophobicContact CB-CD1 4.29Å; M2374-I2383 PolarHBondContact N-O 2.88Å; M2374-I2383 PolarHBondContact O-N 3Å; T2376-I2383 HydrophobicContact CG2-CD1 3.99Å; I2383-V2441 HydrophobicContact CG2-CB 3.81Å; I2383-V2441 HydrophobicContact CG2-CG1 4.24Å; I2383-V2441 HydrophobicContact CG2-CG2 4.18Å; I2383-L2442 WeakPolarHBondContact CA-O 3.14Å; I2383-V2443 HydrophobicContact CG1-CG2 4.14Å
2384	K	92.8	Very high	90.2	Very high	13 Å²	13	37.8 Å²	37.8	6%	0.057	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	132.4	177.6	171	-177.1	170.1	-165	0	109.2	F2373 L2386 E2390 V2441 L2442 D2600	F2373-K2384 HydrophobicContact CD1-CB 3.96Å; F2373-K2384 HydrophobicContact CD1-CG 4.25Å; F2373-K2384 HydrophobicContact CE1-CB 3.77Å; F2373-K2384 HydrophobicContact CE1-CD 3.72Å; F2373-K2384 HydrophobicContact CE1-CG 3.72Å; F2373-K2384 HydrophobicContact CZ-CD 3.8Å; F2373-K2384 HydrophobicContact CZ-CG 3.97Å; K2384-L2386 PolarHBondContact O-N 3.22Å; K2384-E2390 WeakPolarHBondContact CE-OE1 3.3Å; K2384-E2390 IonicContact NZ-OE1 2.96Å; K2384-E2390 PolarHBondContact NZ-OE1 2.9Å; K2384-V2441 WeakPolarHBondContact O-CA 3.3Å; K2384-L2442 HydrophobicContact CB-CD1 4.28Å; K2384-L2442 HydrophobicContact CB-CD2 4.19Å; K2384-L2442 HydrophobicContact CB-CG 3.99Å; K2384-L2442 HydrophobicContact CD-CD2 4.16Å; K2384-L2442 HydrophobicContact CG-CD2 4.33Å; K2384-L2442 PolarHBondContact N-O 3.49Å; K2384-L2442 PolarHBondContact O-N 3.05Å; K2384-D2600 IonicContact NZ-OD1 2.93Å; K2384-D2600 PolarHBondContact NZ-OD1 3.27Å
2385	E	91.6	Very high	90.3	Very high	66 Å²	66	40.1 Å²	40.1	31%	0.308	20%	0.197	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.7	125.8	167.7	-177.9	-178.8	-154.7	0	0	110.6	L2372 D2440	L2372-E2385 HydrophobicContact CB-CB 4.03Å; L2372-E2385 WeakPolarHBondContact CB-OE2 3.42Å; L2372-E2385 PolarHBondContact N-OE2 2.67Å; L2372-E2385 PolarHBondContact O-N 2.97Å; E2385-D2440 WeakPolarHBondContact CA-O 3.16Å
2386	L	90.8	Very high	90.3	Very high	9 Å²	9	43.7 Å²	43.7	5%	0.047	21%	0.214	C	C	.	.	P	Polyproline II helix	trans	-87	127.4	178	-82.2	168.1	0	0	0	110.4	K2384 E2390 M2391 I2423 D2440 L2442 L2602	K2384-L2386 PolarHBondContact O-N 3.22Å; L2386-E2390 HydrophobicContact CD2-CB 3.59Å; L2386-M2391 HydrophobicContact CD1-CE 3.64Å; L2386-M2391 HydrophobicContact CD1-SD 4.23Å; L2386-I2423 HydrophobicContact CD1-CD1 4.41Å; L2386-I2423 HydrophobicContact CD1-CG1 4.45Å; L2386-I2423 HydrophobicContact CD1-CG2 3.47Å; L2386-I2423 VanDerWaalsContact CD1-CG2 3.47Å; L2386-D2440 HydrophobicContact CB-CB 4.08Å; L2386-D2440 PolarHBondContact N-O 2.76Å; L2386-L2442 HydrophobicContact CD1-CB 4.04Å; L2386-L2442 HydrophobicContact CD2-CB 4.36Å; L2386-L2442 HydrophobicContact CD2-CD2 3.6Å; L2386-L2442 HydrophobicContact CG-CB 4.06Å; L2386-L2442 HydrophobicContact CG-CD2 4Å; L2386-L2442 HydrophobicContact CG-CG 4.43Å; L2386-L2602 HydrophobicContact CD2-CD1 3.84Å
2387	S	89.9	Confident	90.3	Very high	50 Å²	50	43.9 Å²	43.9	35%	0.35	22%	0.215	S	C	.	.	P	Polyproline II helix	trans	-69.8	153.1	161.5	65.3	0	0	0	0	111	I2389 E2390 M2391	S2387-I2389 PolarHBondContact O-N 2.83Å; S2387-I2389 VanDerWaalsContact O-N 3.11Å; S2387-I2389 VanDerWaalsContact OG-CG2 3.29Å; S2387-I2389 WeakPolarHBondContact OG-CG2 3.34Å; S2387-E2390 WeakPolarHBondContact CB-OE2 3.36Å; S2387-E2390 PolarHBondContact N-OE2 3.28Å; S2387-E2390 PolarHBondContact O-N 3.04Å; S2387-E2390 WeakPolarHBondContact OG-CG 2.91Å; S2387-E2390 PolarHBondContact OG-N 3.41Å; S2387-E2390 PolarHBondContact OG-OE2 3.48Å; S2387-M2391 PolarHBondContact O-N 3.39Å
2388	S	87.6	Confident	90.6	Very high	103 Å²	103	35.7 Å²	35.7	72%	0.72	19%	0.186	S	C	*	.	H	α-helix	trans	-57.7	-27.6	178.9	56.4	0	0	0	0	113.7	K2392	S2388-K2392 WeakPolarHBondContact O-CB 3.48Å; S2388-K2392 PolarHBondContact O-N 3.17Å
2389	I	87.1	Confident	90.9	Very high	59 Å²	59	37.6 Å²	37.6	30%	0.303	19%	0.194	S	C	.	.	H	α-helix	trans	-75.7	-34.5	174.2	-175	59.5	0	0	0	112.8	S2387 T2393	S2387-I2389 PolarHBondContact O-N 2.83Å; S2387-I2389 VanDerWaalsContact O-N 3.11Å; S2387-I2389 VanDerWaalsContact OG-CG2 3.29Å; S2387-I2389 WeakPolarHBondContact OG-CG2 3.34Å; I2389-T2393 VanDerWaalsContact O-CB 3.3Å; I2389-T2393 WeakPolarHBondContact O-CB 3.31Å; I2389-T2393 PolarHBondContact O-N 3.4Å; I2389-T2393 PolarHBondContact O-OG1 3.46Å
2390	E	91.3	Very high	91.1	Very high	27 Å²	27	38.7 Å²	38.7	13%	0.126	20%	0.201	C	C	.	.	H	α-helix	trans	-70.7	-40.9	173	-70.6	164.6	120	0	0	110.8	K2384 L2386 S2387 T2393 F2394 L2602	K2384-E2390 WeakPolarHBondContact CE-OE1 3.3Å; K2384-E2390 IonicContact NZ-OE1 2.96Å; K2384-E2390 PolarHBondContact NZ-OE1 2.9Å; L2386-E2390 HydrophobicContact CD2-CB 3.59Å; S2387-E2390 WeakPolarHBondContact CB-OE2 3.36Å; S2387-E2390 PolarHBondContact N-OE2 3.28Å; S2387-E2390 PolarHBondContact O-N 3.04Å; S2387-E2390 WeakPolarHBondContact OG-CG 2.91Å; S2387-E2390 PolarHBondContact OG-N 3.41Å; S2387-E2390 PolarHBondContact OG-OE2 3.48Å; E2390-T2393 PolarHBondContact O-N 3.39Å; E2390-F2394 PolarHBondContact O-N 3.48Å; E2390-L2602 HydrophobicContact CB-CB 3.99Å; E2390-L2602 HydrophobicContact CB-CD1 4.44Å; E2390-L2602 HydrophobicContact CG-CB 4Å
2391	M	91.1	Very high	91.6	Very high	14 Å²	14	38.2 Å²	38.2	7%	0.069	20%	0.199	C	C	.	.	H	α-helix	trans	-59.2	-50.7	173.4	-176.8	64.9	81.5	0	0	111.4	Y2332 L2386 S2387 T2393 F2394 H2395 I2423 D2440	Y2332-M2391 HydrophobicContact CD2-CE 4.14Å; Y2332-M2391 HydrophobicContact CD2-SD 4.44Å; Y2332-M2391 HydrophobicContact CE2-CE 3.51Å; Y2332-M2391 HydrophobicContact CE2-SD 4.1Å; L2386-M2391 HydrophobicContact CD1-CE 3.64Å; L2386-M2391 HydrophobicContact CD1-SD 4.23Å; S2387-M2391 PolarHBondContact O-N 3.39Å; M2391-T2393 VanDerWaalsContact C-N 3.32Å; M2391-T2393 PolarHBondContact O-N 3.07Å; M2391-F2394 PolarHBondContact O-N 3.31Å; M2391-H2395 PolarHBondContact O-CD2 3.37Å; M2391-H2395 PolarHBondContact O-N 3.21Å; M2391-I2423 HydrophobicContact CE-CG2 3.63Å; M2391-I2423 HydrophobicContact SD-CG2 3.95Å; M2391-D2440 HydrophobicContact CE-CB 3.68Å; M2391-D2440 VanDerWaalsContact CE-OD1 3.27Å; M2391-D2440 WeakPolarHBondContact CE-OD1 3.14Å
2392	K	90.7	Very high	91.6	Very high	122 Å²	122	38.4 Å²	38.4	53%	0.53	20%	0.2	S	C	.	.	H	α-helix	trans	-58	-44.5	174.4	177.6	173.5	171.5	174.6	0	111.6	S2388 F2394 H2395 E2396	S2388-K2392 WeakPolarHBondContact O-CB 3.48Å; S2388-K2392 PolarHBondContact O-N 3.17Å; K2392-F2394 VanDerWaalsContact C-N 3.34Å; K2392-F2394 PolarHBondContact O-N 3.34Å; K2392-H2395 PolarHBondContact O-N 3.23Å; K2392-E2396 WeakPolarHBondContact CE-OE1 3.42Å; K2392-E2396 IonicContact NZ-OE1 3Å; K2392-E2396 WeakPolarHBondContact O-CG 3.46Å; K2392-E2396 PolarHBondContact O-N 2.89Å
2393	T	91.7	Very high	91.5	Very high	4 Å²	4	42.7 Å²	42.7	3%	0.025	22%	0.223	C	C	.	.	H	α-helix	trans	-61.2	-42.9	178.8	-60.7	0	0	0	0	111.4	I2389 E2390 M2391 E2396 I2397 L2602 K2604	I2389-T2393 VanDerWaalsContact O-CB 3.3Å; I2389-T2393 WeakPolarHBondContact O-CB 3.31Å; I2389-T2393 PolarHBondContact O-N 3.4Å; I2389-T2393 PolarHBondContact O-OG1 3.46Å; E2390-T2393 PolarHBondContact O-N 3.39Å; M2391-T2393 VanDerWaalsContact C-N 3.32Å; M2391-T2393 PolarHBondContact O-N 3.07Å; T2393-E2396 PolarHBondContact O-N 3.22Å; T2393-I2397 HydrophobicContact CG2-CD1 4.49Å; T2393-I2397 WeakPolarHBondContact O-CG1 3.45Å; T2393-I2397 PolarHBondContact O-N 3.38Å; T2393-L2602 WeakPolarHBondContact CB-O 3.43Å; T2393-L2602 PolarHBondContact OG1-O 2.88Å; T2393-K2604 HydrophobicContact CG2-CD 4.42Å; T2393-K2604 HydrophobicContact CG2-CG 3.96Å
2394	F	93.4	Very high	91.5	Very high	1 Å²	1	44.2 Å²	44.2	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-62.7	-44.1	176.9	-172.5	-90.3	0	0	0	112	Y2333 F2337 E2390 M2391 K2392 E2396 I2397 S2398 Y2401 F2402 I2420 I2423 L2602	Y2333-F2394 HydrophobicContact CD2-CD1 4.18Å; Y2333-F2394 AromaticContact CD2-CE1 3.66Å; Y2333-F2394 HydrophobicContact CD2-CE1 3.66Å; Y2333-F2394 AromaticContact CE2-CD1 3.96Å; Y2333-F2394 HydrophobicContact CE2-CD1 3.96Å; Y2333-F2394 AromaticContact CE2-CE1 3.84Å; Y2333-F2394 HydrophobicContact CE2-CE1 3.84Å; Y2333-F2394 HydrophobicContact CG-CE1 4.38Å; F2337-F2394 HydrophobicContact CE1-CZ 4.33Å; F2337-F2394 HydrophobicContact CE2-CE1 4.17Å; F2337-F2394 HydrophobicContact CE2-CZ 4.16Å; F2337-F2394 AromaticContact CZ-CE1 3.97Å; F2337-F2394 HydrophobicContact CZ-CE1 3.97Å; F2337-F2394 HydrophobicContact CZ-CE2 4.29Å; F2337-F2394 AromaticContact CZ-CZ 3.52Å; F2337-F2394 HydrophobicContact CZ-CZ 3.52Å; E2390-F2394 PolarHBondContact O-N 3.48Å; M2391-F2394 PolarHBondContact O-N 3.31Å; K2392-F2394 VanDerWaalsContact C-N 3.34Å; K2392-F2394 PolarHBondContact O-N 3.34Å; F2394-E2396 VanDerWaalsContact C-N 3.27Å; F2394-E2396 PolarHBondContact O-N 2.72Å; F2394-I2397 PolarHBondContact O-N 3.29Å; F2394-I2397 VanDerWaalsContact O-N 3.14Å; F2394-S2398 WeakPolarHBondContact O-CA 3.44Å; F2394-S2398 WeakPolarHBondContact O-CB 3.16Å; F2394-S2398 PolarHBondContact O-N 2.93Å; F2394-Y2401 AromaticContact CE2-CD1 3.81Å; F2394-Y2401 HydrophobicContact CE2-CD1 3.81Å; F2394-Y2401 HydrophobicContact CE2-CE1 4.06Å; F2394-Y2401 HydrophobicContact CE2-CG 4.06Å; F2394-Y2401 AromaticContact CZ-CD1 3.89Å; F2394-Y2401 HydrophobicContact CZ-CD1 3.89Å; F2394-Y2401 HydrophobicContact CZ-CE1 4.2Å; F2394-Y2401 HydrophobicContact CZ-CG 4.5Å; F2394-F2402 HydrophobicContact CZ-CE2 4.43Å; F2394-F2402 HydrophobicContact CZ-CZ 4.19Å; F2394-I2420 HydrophobicContact CD2-CD1 3.98Å; F2394-I2420 HydrophobicContact CE2-CD1 3.91Å; F2394-I2423 HydrophobicContact CB-CD1 4.25Å; F2394-I2423 HydrophobicContact CD1-CD1 3.46Å; F2394-I2423 VanDerWaalsContact CD1-CD1 3.46Å; F2394-I2423 HydrophobicContact CD2-CD1 3.81Å; F2394-I2423 HydrophobicContact CE1-CD1 3.71Å; F2394-I2423 HydrophobicContact CE2-CD1 4.04Å; F2394-I2423 HydrophobicContact CG-CD1 3.52Å; F2394-I2423 HydrophobicContact CZ-CD1 4Å; F2394-L2602 HydrophobicContact CB-CD2 4.39Å; F2394-L2602 HydrophobicContact CD2-CD2 3.92Å
2395	H	91.7	Very high	91.4	Very high	62 Å²	62	43.9 Å²	43.9	29%	0.287	23%	0.228	S	C	.	.	H	α-helix	trans	-54.1	-45.8	176.4	-79.1	-65.1	0	0	0	112	H2315 Y2332 Y2333 M2391 K2392 I2397 S2398	H2315-H2395 AromaticContact NE2-CE1 3.56Å; Y2332-H2395 AromaticContact CD1-CE1 3.72Å; Y2332-H2395 AromaticContact CE1-CE1 3.85Å; Y2332-H2395 AromaticContact CE1-NE2 3.85Å; Y2333-H2395 AromaticContact CE2-CE1 3.95Å; Y2333-H2395 AromaticContact CE2-ND1 3.48Å; Y2333-H2395 WeakPolarHBondContact CE2-ND1 3.43Å; Y2333-H2395 AromaticContact CZ-ND1 3.6Å; Y2333-H2395 WeakPolarHBondContact OH-CA 3.24Å; Y2333-H2395 PolarHBondContact OH-ND1 3.17Å; Y2333-H2395 PolarHBondContact OH-O 2.77Å; M2391-H2395 PolarHBondContact O-CD2 3.37Å; M2391-H2395 PolarHBondContact O-N 3.21Å; K2392-H2395 PolarHBondContact O-N 3.23Å; H2395-I2397 VanDerWaalsContact C-N 3.31Å; H2395-I2397 PolarHBondContact O-N 3.29Å; H2395-S2398 PolarHBondContact O-OG 3.44Å
2396	E	90.5	Very high	91.2	Very high	96 Å²	96	42.7 Å²	42.7	45%	0.449	22%	0.223	S	C	.	.	H	α-helix	trans	-71.2	-12.4	-179.3	-65.3	176.9	-168.7	0	0	115.7	K2392 T2393 F2394 K2604	K2392-E2396 WeakPolarHBondContact CE-OE1 3.42Å; K2392-E2396 IonicContact NZ-OE1 3Å; K2392-E2396 WeakPolarHBondContact O-CG 3.46Å; K2392-E2396 PolarHBondContact O-N 2.89Å; T2393-E2396 PolarHBondContact O-N 3.22Å; F2394-E2396 VanDerWaalsContact C-N 3.27Å; F2394-E2396 PolarHBondContact O-N 2.72Å; E2396-K2604 VanDerWaalsContact CB-NZ 3.28Å; E2396-K2604 WeakPolarHBondContact OE2-CD 3.43Å; E2396-K2604 IonicContact OE2-NZ 3.8Å; E2396-K2604 PolarHBondContact OE2-NZ 2.92Å
2397	I	92.6	Very high	90.9	Very high	3 Å²	3	45.2 Å²	45.2	2%	0.015	24%	0.238	C	C	.	.	H	α-helix	trans	-121.7	3.5	179.7	70.2	-179.1	0	0	0	113	T2393 F2394 H2395 Q2399 D2400 Y2401 L2576 I2578 L2602	T2393-I2397 HydrophobicContact CG2-CD1 4.49Å; T2393-I2397 WeakPolarHBondContact O-CG1 3.45Å; T2393-I2397 PolarHBondContact O-N 3.38Å; F2394-I2397 PolarHBondContact O-N 3.29Å; F2394-I2397 VanDerWaalsContact O-N 3.14Å; H2395-I2397 VanDerWaalsContact C-N 3.31Å; H2395-I2397 PolarHBondContact O-N 3.29Å; I2397-Q2399 VanDerWaalsContact C-N 3.31Å; I2397-Q2399 PolarHBondContact O-N 2.95Å; I2397-D2400 PolarHBondContact O-N 2.83Å; I2397-Y2401 WeakPolarHBondContact O-CB 3.39Å; I2397-Y2401 PolarHBondContact O-N 3.24Å; I2397-L2576 HydrophobicContact CB-CD1 4.23Å; I2397-L2576 HydrophobicContact CG2-CB 4.39Å; I2397-L2576 HydrophobicContact CG2-CD1 4.35Å; I2397-L2576 HydrophobicContact CG2-CD2 4.5Å; I2397-I2578 HydrophobicContact CD1-CD1 3.63Å; I2397-I2578 HydrophobicContact CG2-CD1 4.34Å; I2397-L2602 HydrophobicContact CD1-CD2 4.22Å
2398	S	92.3	Very high	90.5	Very high	8 Å²	8	43.1 Å²	43.1	6%	0.056	22%	0.224	C	C	.	.	H	α-helix	trans	-57.3	-39.5	-167.2	51.2	0	0	0	0	113.3	Y2333 F2394 H2395 F2402	Y2333-S2398 VanDerWaalsContact CE1-CB 3.49Å; Y2333-S2398 VanDerWaalsContact CE1-OG 3.3Å; Y2333-S2398 WeakPolarHBondContact CE1-OG 3.39Å; Y2333-S2398 VanDerWaalsContact CZ-CB 3.44Å; Y2333-S2398 PolarHBondContact OH-OG 3.36Å; Y2333-S2398 VanDerWaalsContact OH-OG 3.11Å; F2394-S2398 WeakPolarHBondContact O-CA 3.44Å; F2394-S2398 WeakPolarHBondContact O-CB 3.16Å; F2394-S2398 PolarHBondContact O-N 2.93Å; H2395-S2398 PolarHBondContact O-OG 3.44Å; S2398-F2402 WeakPolarHBondContact O-CD2 3.42Å; S2398-F2402 PolarHBondContact O-N 3.16Å; S2398-F2402 VanDerWaalsContact O-N 3.15Å
2399	Q	91.3	Very high	90.1	Very high	75 Å²	75	39 Å²	39	35%	0.35	20%	0.197	S	C	.	.	H	α-helix	trans	-69.2	-53.7	177.9	-57.1	-61.3	-112	0	0	111.7	I2397 Y2401 F2402 D2403	I2397-Q2399 VanDerWaalsContact C-N 3.31Å; I2397-Q2399 PolarHBondContact O-N 2.95Å; Q2399-Y2401 PolarHBondContact O-N 2.88Å; Q2399-F2402 PolarHBondContact O-N 3.25Å; Q2399-D2403 WeakPolarHBondContact O-CB 3.29Å; Q2399-D2403 PolarHBondContact O-N 3.43Å
2400	D	92.8	Very high	89.5	Confident	77 Å²	77	41.9 Å²	41.9	41%	0.412	21%	0.212	S	C	.	.	H	α-helix	trans	-55.6	-37.5	178	-50	-95.1	0	0	0	112	I2397 Y2404 F2572 L2576	I2397-D2400 PolarHBondContact O-N 2.83Å; D2400-Y2404 WeakPolarHBondContact O-CB 3.21Å; D2400-Y2404 PolarHBondContact O-N 2.96Å; D2400-F2572 HydrophobicContact CB-CE2 3.98Å; D2400-F2572 HydrophobicContact CB-CZ 4.37Å; D2400-F2572 WeakPolarHBondContact O-CE2 3.28Å; D2400-F2572 WeakPolarHBondContact O-CZ 3.36Å; D2400-L2576 HydrophobicContact CB-CD1 4.03Å; D2400-L2576 HydrophobicContact CB-CD2 3.74Å; D2400-L2576 HydrophobicContact CB-CG 4.48Å
2401	Y	94.9	Very high	88.7	Confident	1 Å²	1	45.9 Å²	45.9	0%	0.004	23%	0.231	C	C	.	.	H	α-helix	trans	-63	-50.1	174.3	174	-94.7	0	0	0	112.9	F2337 L2340 F2394 I2397 Q2399 L2405 I2420 Y2601	F2337-Y2401 HydrophobicContact CE1-CE1 4.26Å; L2340-Y2401 HydrophobicContact CD2-CE1 4.31Å; F2394-Y2401 AromaticContact CE2-CD1 3.81Å; F2394-Y2401 HydrophobicContact CE2-CD1 3.81Å; F2394-Y2401 HydrophobicContact CE2-CE1 4.06Å; F2394-Y2401 HydrophobicContact CE2-CG 4.06Å; F2394-Y2401 AromaticContact CZ-CD1 3.89Å; F2394-Y2401 HydrophobicContact CZ-CD1 3.89Å; F2394-Y2401 HydrophobicContact CZ-CE1 4.2Å; F2394-Y2401 HydrophobicContact CZ-CG 4.5Å; I2397-Y2401 WeakPolarHBondContact O-CB 3.39Å; I2397-Y2401 PolarHBondContact O-N 3.24Å; Q2399-Y2401 PolarHBondContact O-N 2.88Å; Y2401-L2405 HydrophobicContact CD2-CD1 4.28Å; Y2401-L2405 HydrophobicContact CE1-CD1 3.89Å; Y2401-L2405 HydrophobicContact CE2-CD1 3.58Å; Y2401-L2405 HydrophobicContact CE2-CG 4.42Å; Y2401-L2405 PolarHBondContact O-N 3.48Å; Y2401-L2405 WeakPolarHBondContact OH-CD1 3.39Å; Y2401-I2420 HydrophobicContact CE2-CD1 4.49Å; Y2401-I2420 WeakPolarHBondContact OH-CA 3.3Å; Y2401-I2420 WeakPolarHBondContact OH-CB 3.42Å; Y2401-I2420 PolarHBondContact OH-N 3.41Å; Y2401-I2420 PolarHBondContact OH-O 2.81Å; Y2401-Y2601 HydrophobicContact CD2-CE2 4.44Å; Y2401-Y2601 HydrophobicContact CE2-CE2 4.17Å
2402	F	94.1	Very high	87.8	Confident	5 Å²	5	50.3 Å²	50.3	2%	0.022	25%	0.251	C	S	.	.	H	α-helix	trans	-67.3	-45.3	178.8	-70.4	-56.1	0	0	0	111.5	Y2333 E2336 F2337 L2340 F2394 S2398 Q2399 Y2404 L2405 I2406	Y2333-F2402 HydrophobicContact CD1-CE2 4Å; Y2333-F2402 AromaticContact CG-CE2 3.93Å; Y2333-F2402 HydrophobicContact CG-CE2 3.93Å; Y2333-F2402 HydrophobicContact CG-CZ 4.36Å; E2336-F2402 HydrophobicContact CB-CD1 4.07Å; E2336-F2402 HydrophobicContact CB-CD2 3.58Å; E2336-F2402 HydrophobicContact CB-CE1 3.91Å; E2336-F2402 HydrophobicContact CB-CE2 3.43Å; E2336-F2402 VanDerWaalsContact CB-CE2 3.43Å; E2336-F2402 HydrophobicContact CB-CG 3.94Å; E2336-F2402 HydrophobicContact CB-CZ 3.61Å; E2336-F2402 HydrophobicContact CG-CD2 4.05Å; E2336-F2402 HydrophobicContact CG-CE2 4.1Å; F2337-F2402 AromaticContact CD1-CE1 3.64Å; F2337-F2402 HydrophobicContact CD1-CE1 3.64Å; F2337-F2402 AromaticContact CD1-CZ 3.9Å; F2337-F2402 HydrophobicContact CD1-CZ 3.9Å; F2337-F2402 HydrophobicContact CD2-CE1 4.45Å; F2337-F2402 AromaticContact CD2-CZ 3.91Å; F2337-F2402 HydrophobicContact CD2-CZ 3.91Å; F2337-F2402 AromaticContact CE1-CE1 3.78Å; F2337-F2402 HydrophobicContact CE1-CE1 3.78Å; F2337-F2402 AromaticContact CE1-CZ 3.87Å; F2337-F2402 HydrophobicContact CE1-CZ 3.87Å; F2337-F2402 AromaticContact CE2-CZ 3.9Å; F2337-F2402 HydrophobicContact CE2-CZ 3.9Å; F2337-F2402 AromaticContact CG-CE1 3.99Å; F2337-F2402 HydrophobicContact CG-CE1 3.99Å; F2337-F2402 AromaticContact CG-CZ 3.91Å; F2337-F2402 HydrophobicContact CG-CZ 3.91Å; F2337-F2402 HydrophobicContact CZ-CE1 4.26Å; F2337-F2402 AromaticContact CZ-CZ 3.88Å; F2337-F2402 HydrophobicContact CZ-CZ 3.88Å; L2340-F2402 HydrophobicContact CD2-CD1 4.31Å; L2340-F2402 HydrophobicContact CD2-CE1 4.24Å; F2394-F2402 HydrophobicContact CZ-CE2 4.43Å; F2394-F2402 HydrophobicContact CZ-CZ 4.19Å; S2398-F2402 WeakPolarHBondContact O-CD2 3.42Å; S2398-F2402 PolarHBondContact O-N 3.16Å; S2398-F2402 VanDerWaalsContact O-N 3.15Å; Q2399-F2402 PolarHBondContact O-N 3.25Å; F2402-Y2404 PolarHBondContact O-N 3.3Å; F2402-L2405 PolarHBondContact O-N 3.05Å; F2402-I2406 HydrophobicContact CB-CD1 4.3Å; F2402-I2406 VanDerWaalsContact O-CB 3.25Å; F2402-I2406 WeakPolarHBondContact O-CB 3.49Å; F2402-I2406 VanDerWaalsContact O-CG1 3.22Å; F2402-I2406 WeakPolarHBondContact O-CG1 3.19Å; F2402-I2406 PolarHBondContact O-N 3.31Å
2403	D	90.7	Very high	87.3	Confident	100 Å²	100	46.8 Å²	46.8	54%	0.535	23%	0.234	S	C	.	.	H	α-helix	trans	-62.6	-42.6	179.8	-68.6	-22.5	0	0	0	111.2	Q2399 T2407	Q2399-D2403 WeakPolarHBondContact O-CB 3.29Å; Q2399-D2403 PolarHBondContact O-N 3.43Å; D2403-T2407 WeakPolarHBondContact O-CB 3.44Å; D2403-T2407 PolarHBondContact O-N 3.32Å; D2403-T2407 PolarHBondContact O-OG1 3.17Å
2404	Y	93.3	Very high	86.9	Confident	33 Å²	33	47.6 Å²	47.6	13%	0.129	24%	0.239	C	C	.	.	H	α-helix	trans	-63.8	-43.2	178.2	-173	-98.6	0	0	0	112.9	D2400 F2402 A2408 R2413 L2417 D2569 F2572	D2400-Y2404 WeakPolarHBondContact O-CB 3.21Å; D2400-Y2404 PolarHBondContact O-N 2.96Å; F2402-Y2404 PolarHBondContact O-N 3.3Å; Y2404-A2408 VanDerWaalsContact O-CB 3.28Å; Y2404-A2408 WeakPolarHBondContact O-CB 3.16Å; Y2404-A2408 PolarHBondContact O-N 2.93Å; Y2404-R2413 VanDerWaalsContact CZ-NH1 3.35Å; Y2404-R2413 PolarHBondContact O-NH2 2.63Å; Y2404-R2413 PolarHBondContact OH-NH1 2.88Å; Y2404-L2417 HydrophobicContact CD1-CD1 3.96Å; Y2404-L2417 HydrophobicContact CE1-CD1 3.83Å; Y2404-D2569 WeakPolarHBondContact CE1-OD1 3.23Å; Y2404-D2569 WeakPolarHBondContact OH-CA 3.46Å; Y2404-D2569 PolarHBondContact OH-N 3.48Å; Y2404-D2569 PolarHBondContact OH-OD1 3.38Å; Y2404-F2572 HydrophobicContact CD1-CD1 4.07Å; Y2404-F2572 HydrophobicContact CD1-CD2 4.42Å; Y2404-F2572 HydrophobicContact CD1-CE1 4.16Å; Y2404-F2572 HydrophobicContact CD1-CE2 4.5Å; Y2404-F2572 HydrophobicContact CD1-CG 4.2Å; Y2404-F2572 HydrophobicContact CD1-CZ 4.38Å; Y2404-F2572 HydrophobicContact CD2-CB 4.09Å; Y2404-F2572 HydrophobicContact CD2-CD1 4.43Å; Y2404-F2572 AromaticContact CD2-CD2 3.5Å; Y2404-F2572 HydrophobicContact CD2-CD2 3.5Å; Y2404-F2572 VanDerWaalsContact CD2-CD2 3.5Å; Y2404-F2572 AromaticContact CD2-CE2 3.99Å; Y2404-F2572 HydrophobicContact CD2-CE2 3.99Å; Y2404-F2572 AromaticContact CD2-CG 3.75Å; Y2404-F2572 HydrophobicContact CD2-CG 3.75Å; Y2404-F2572 HydrophobicContact CE1-CD1 4.23Å; Y2404-F2572 HydrophobicContact CE1-CG 4.31Å; Y2404-F2572 HydrophobicContact CE2-CB 3.72Å; Y2404-F2572 HydrophobicContact CE2-CD2 4.05Å; Y2404-F2572 AromaticContact CE2-CG 3.88Å; Y2404-F2572 HydrophobicContact CE2-CG 3.88Å; Y2404-F2572 HydrophobicContact CG-CD1 4.17Å; Y2404-F2572 AromaticContact CG-CD2 3.71Å; Y2404-F2572 HydrophobicContact CG-CD2 3.71Å; Y2404-F2572 HydrophobicContact CG-CE1 4.23Å; Y2404-F2572 AromaticContact CG-CE2 3.76Å; Y2404-F2572 HydrophobicContact CG-CE2 3.76Å; Y2404-F2572 AromaticContact CG-CG 3.92Å; Y2404-F2572 HydrophobicContact CG-CG 3.92Å; Y2404-F2572 HydrophobicContact CG-CZ 4.03Å
2405	L	91	Very high	86.6	Confident	7 Å²	7	47.9 Å²	47.9	4%	0.037	24%	0.241	C	C	.	.	H	α-helix	trans	-77.5	-39.1	-179.6	-70.9	-175.2	0	0	0	113.3	L2340 Y2401 F2402 A2408 A2409 L2417 R2419	L2340-L2405 HydrophobicContact CD1-CB 4.21Å; L2340-L2405 HydrophobicContact CD2-CD1 4.31Å; Y2401-L2405 HydrophobicContact CD2-CD1 4.28Å; Y2401-L2405 HydrophobicContact CE1-CD1 3.89Å; Y2401-L2405 HydrophobicContact CE2-CD1 3.58Å; Y2401-L2405 HydrophobicContact CE2-CG 4.42Å; Y2401-L2405 PolarHBondContact O-N 3.48Å; Y2401-L2405 WeakPolarHBondContact OH-CD1 3.39Å; F2402-L2405 PolarHBondContact O-N 3.05Å; L2405-A2408 PolarHBondContact O-N 3.23Å; L2405-A2409 WeakPolarHBondContact O-CB 3.45Å; L2405-A2409 PolarHBondContact O-N 2.82Å; L2405-L2417 HydrophobicContact CD2-CD1 4.42Å; L2405-R2419 HydrophobicContact CD1-CG 4.18Å
2406	I	87.6	Confident	86.6	Confident	40 Å²	40	44.9 Å²	44.9	21%	0.205	23%	0.227	C	C	.	.	H	α-helix	trans	-66.3	-44	176.2	-68.4	170.1	0	0	0	109.4	L2340 L2343 F2402 A2408 A2409 L2410	L2340-I2406 HydrophobicContact CD1-CG1 4.44Å; L2343-I2406 HydrophobicContact CD1-CB 4.47Å; L2343-I2406 HydrophobicContact CD1-CG1 4.04Å; L2343-I2406 HydrophobicContact CD1-CG2 3.95Å; F2402-I2406 HydrophobicContact CB-CD1 4.3Å; F2402-I2406 VanDerWaalsContact O-CB 3.25Å; F2402-I2406 WeakPolarHBondContact O-CB 3.49Å; F2402-I2406 VanDerWaalsContact O-CG1 3.22Å; F2402-I2406 WeakPolarHBondContact O-CG1 3.19Å; F2402-I2406 PolarHBondContact O-N 3.31Å; I2406-A2408 PolarHBondContact O-N 2.86Å; I2406-A2409 PolarHBondContact O-N 3.41Å; I2406-L2410 HydrophobicContact CG2-CD1 3.8Å; I2406-L2410 HydrophobicContact CG2-CG 4.36Å; I2406-L2410 WeakPolarHBondContact O-CB 3.49Å; I2406-L2410 VanDerWaalsContact O-CG 3.27Å; I2406-L2410 WeakPolarHBondContact O-CG 3.49Å; I2406-L2410 PolarHBondContact O-N 3.06Å
2407	T	82.6	Confident	86.7	Confident	62 Å²	62	40.3 Å²	40.3	38%	0.38	21%	0.206	S	C	.	.	H	α-helix	trans	-60.8	-43.9	172.4	-57.8	0	0	0	0	111	D2403 A2409 L2410 E2411	D2403-T2407 WeakPolarHBondContact O-CB 3.44Å; D2403-T2407 PolarHBondContact O-N 3.32Å; D2403-T2407 PolarHBondContact O-OG1 3.17Å; T2407-A2409 PolarHBondContact O-N 2.97Å; T2407-L2410 PolarHBondContact O-N 3.35Å; T2407-E2411 HydrophobicContact CG2-CG 3.98Å; T2407-E2411 VanDerWaalsContact O-CB 3.28Å; T2407-E2411 WeakPolarHBondContact O-CB 3.41Å; T2407-E2411 VanDerWaalsContact O-CG 3.26Å; T2407-E2411 WeakPolarHBondContact O-CG 3.11Å; T2407-E2411 PolarHBondContact O-N 3.45Å
2408	A	82.7	Confident	86.7	Confident	6 Å²	6	40.2 Å²	40.2	5%	0.05	21%	0.205	C	C	.	.	H	α-helix	trans	-58.8	-43.9	176.9	0	0	0	0	0	112.9	Y2404 L2405 I2406 Q2412 R2413	Y2404-A2408 VanDerWaalsContact O-CB 3.28Å; Y2404-A2408 WeakPolarHBondContact O-CB 3.16Å; Y2404-A2408 PolarHBondContact O-N 2.93Å; L2405-A2408 PolarHBondContact O-N 3.23Å; I2406-A2408 PolarHBondContact O-N 2.86Å; A2408-Q2412 PolarHBondContact O-N 3.42Å; A2408-Q2412 VanDerWaalsContact O-N 3.1Å; A2408-R2413 PolarHBondContact O-N 3.39Å
2409	A	78.1	Confident	86.7	Confident	17 Å²	17	40.6 Å²	40.6	14%	0.14	21%	0.205	C	C	.	.	H	α-helix	trans	-66	-44.4	178	0	0	0	0	0	112.2	I2344 L2405 I2406 T2407 Q2412	I2344-A2409 HydrophobicContact CG2-CB 4.5Å; L2405-A2409 WeakPolarHBondContact O-CB 3.45Å; L2405-A2409 PolarHBondContact O-N 2.82Å; I2406-A2409 PolarHBondContact O-N 3.41Å; T2407-A2409 PolarHBondContact O-N 2.97Å; A2409-Q2412 PolarHBondContact O-N 3.08Å; A2409-Q2412 PolarHBondContact O-NE2 2.99Å
2410	L	75.1	Confident	86.8	Confident	119 Å²	119	37.2 Å²	37.2	62%	0.623	19%	0.19	S	C	*	.	H	α-helix	trans	-67.6	-35.7	178.2	-68	172.6	0	0	0	112.8	I2406 T2407 Q2412	I2406-L2410 HydrophobicContact CG2-CD1 3.8Å; I2406-L2410 HydrophobicContact CG2-CG 4.36Å; I2406-L2410 WeakPolarHBondContact O-CB 3.49Å; I2406-L2410 VanDerWaalsContact O-CG 3.27Å; I2406-L2410 WeakPolarHBondContact O-CG 3.49Å; I2406-L2410 PolarHBondContact O-N 3.06Å; T2407-L2410 PolarHBondContact O-N 3.35Å; L2410-Q2412 VanDerWaalsContact C-N 3.3Å
2411	E	75.6	Confident	86.8	Confident	111 Å²	111	33.6 Å²	33.6	52%	0.519	17%	0.17	S	C	.	.	H	α-helix	trans	-77.4	-11	174.8	-70.7	-176.7	142.6	0	0	113.6	T2407 R2413	T2407-E2411 HydrophobicContact CG2-CG 3.98Å; T2407-E2411 VanDerWaalsContact O-CB 3.28Å; T2407-E2411 WeakPolarHBondContact O-CB 3.41Å; T2407-E2411 VanDerWaalsContact O-CG 3.26Å; T2407-E2411 WeakPolarHBondContact O-CG 3.11Å; T2407-E2411 PolarHBondContact O-N 3.45Å; E2411-R2413 HydrophobicContact CB-CB 3.92Å; E2411-R2413 PolarHBondContact O-N 3.04Å; E2411-R2413 WeakPolarHBondContact OE2-CD 3.43Å; E2411-R2413 IonicContact OE2-NE 3.22Å; E2411-R2413 PolarHBondContact OE2-NE 3.19Å
2412	Q	71.1	Confident	86.8	Confident	108 Å²	108	33.5 Å²	33.5	51%	0.505	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	50.1	37	-162.8	-66.8	-65.9	-22.6	0	0	112.8	S1534 A2408 A2409 L2410	S1534-Q2412 PolarHBondContact OG-OE1 3.24Å; S1534-Q2412 VanDerWaalsContact OG-OE1 3.05Å; A2408-Q2412 PolarHBondContact O-N 3.42Å; A2408-Q2412 VanDerWaalsContact O-N 3.1Å; A2409-Q2412 PolarHBondContact O-N 3.08Å; A2409-Q2412 PolarHBondContact O-NE2 2.99Å; L2410-Q2412 VanDerWaalsContact C-N 3.3Å
2413	R	80	Confident	86.9	Confident	47 Å²	47	33.3 Å²	33.3	18%	0.177	17%	0.169	C	C	.	.			trans	-83.6	123.7	179.3	179.4	173.9	58.9	79.5	-9.3	109.8	Y2404 A2408 E2411	Y2404-R2413 VanDerWaalsContact CZ-NH1 3.35Å; Y2404-R2413 PolarHBondContact O-NH2 2.63Å; Y2404-R2413 PolarHBondContact OH-NH1 2.88Å; A2408-R2413 PolarHBondContact O-N 3.39Å; E2411-R2413 HydrophobicContact CB-CB 3.92Å; E2411-R2413 PolarHBondContact O-N 3.04Å; E2411-R2413 WeakPolarHBondContact OE2-CD 3.43Å; E2411-R2413 IonicContact OE2-NE 3.22Å; E2411-R2413 PolarHBondContact OE2-NE 3.19Å
2414	L	83.4	Confident	87.1	Confident	21 Å²	21	28.5 Å²	28.5	11%	0.11	14%	0.143	C	C	.	.			trans	-56	139.3	175.1	-62.3	178.2	0	0	0	111.5	L1084 Y1087 M1531 A2561 C2565	L1084-L2414 HydrophobicContact CD2-CD1 4.32Å; L1084-L2414 HydrophobicContact CD2-CD2 4.5Å; Y1087-L2414 HydrophobicContact CD1-CD1 3.79Å; Y1087-L2414 HydrophobicContact CD2-CD1 3.79Å; Y1087-L2414 HydrophobicContact CD2-CD2 4.16Å; Y1087-L2414 HydrophobicContact CD2-CG 3.68Å; Y1087-L2414 HydrophobicContact CE1-CD1 3.72Å; Y1087-L2414 HydrophobicContact CE2-CD1 3.72Å; Y1087-L2414 HydrophobicContact CE2-CG 3.75Å; Y1087-L2414 HydrophobicContact CG-CD1 3.81Å; Y1087-L2414 HydrophobicContact CG-CD2 4.33Å; Y1087-L2414 HydrophobicContact CG-CG 4.1Å; M1531-L2414 HydrophobicContact CE-CD1 4.24Å; M1531-L2414 HydrophobicContact SD-CB 3.92Å; M1531-L2414 HydrophobicContact SD-CD1 4.12Å; M1531-L2414 HydrophobicContact SD-CD2 4.18Å; M1531-L2414 HydrophobicContact SD-CG 4.31Å; L2414-A2561 HydrophobicContact CD1-CB 4.02Å; L2414-C2565 WeakPolarHBondContact CB-SG 3.33Å
2415	C	87.7	Confident	87.2	Confident	7 Å²	7	29.1 Å²	29.1	5%	0.047	15%	0.147	C	C	.	.			trans	-145.9	141.7	-179.1	-176.5	0	0	0	0	108.5	D2569	C2415-D2569 PolarHBondContact SG-OD1 2.92Å; C2415-D2569 PolarHBondContact SG-OD2 3.43Å; C2415-D2569 VanDerWaalsContact SG-OD2 3.36Å
2416	V	92.2	Very high	87.3	Confident	0 Å²	0	28.8 Å²	28.8	0%	0	15%	0.145	C	C	.	.			trans	-110.9	-0.1	177.3	-66.6	0	0	0	0	113.1	M1531 S2418 C2565 L2566 D2569 I2596 G2597 L2598	M1531-V2416 HydrophobicContact CB-CG1 4.43Å; M1531-V2416 HydrophobicContact CE-CG1 4.22Å; M1531-V2416 HydrophobicContact CG-CG1 3.9Å; M1531-V2416 HydrophobicContact SD-CG1 3.89Å; V2416-S2418 PolarHBondContact O-N 2.9Å; V2416-C2565 HydrophobicContact CG1-CB 3.89Å; V2416-C2565 HydrophobicContact CG2-CB 4.04Å; V2416-L2566 HydrophobicContact CG2-CD2 4.03Å; V2416-D2569 WeakPolarHBondContact CG2-OD2 3.4Å; V2416-D2569 PolarHBondContact N-OD2 3.46Å; V2416-I2596 HydrophobicContact CG1-CD1 3.89Å; V2416-I2596 HydrophobicContact CG1-CG1 4.34Å; V2416-G2597 CarbonylContact O-C 3.49Å; V2416-G2597 VanDerWaalsContact O-CA 3.26Å; V2416-G2597 WeakPolarHBondContact O-CA 3.5Å; V2416-L2598 HydrophobicContact CG2-CD1 3.88Å; V2416-L2598 HydrophobicContact CG2-CG 3.97Å; V2416-L2598 PolarHBondContact O-N 2.87Å
2417	L	92.5	Very high	87.4	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.136	C	C	.	.	B	Isolated β-bridge	trans	-58.5	121.8	168.6	-63	173.9	0	0	0	110.4	Y2404 L2405 R2419 D2569 F2572 L2573 L2598 Y2601	Y2404-L2417 HydrophobicContact CD1-CD1 3.96Å; Y2404-L2417 HydrophobicContact CE1-CD1 3.83Å; L2405-L2417 HydrophobicContact CD2-CD1 4.42Å; L2417-R2419 PolarHBondContact O-N 3.19Å; L2417-D2569 HydrophobicContact CD2-CB 4.32Å; L2417-D2569 HydrophobicContact CG-CB 4.19Å; L2417-D2569 PolarHBondContact N-OD2 3.13Å; L2417-F2572 HydrophobicContact CD1-CD1 4.14Å; L2417-F2572 HydrophobicContact CD1-CE1 4.1Å; L2417-L2573 HydrophobicContact CD2-CD1 4.09Å; L2417-L2573 HydrophobicContact CD2-CD2 4.29Å; L2417-L2573 HydrophobicContact CD2-CG 4.35Å; L2417-L2598 HydrophobicContact CD2-CB 4.18Å; L2417-L2598 HydrophobicContact CD2-CD1 4Å; L2417-Y2601 HydrophobicContact CD2-CD1 4.26Å; L2417-Y2601 HydrophobicContact CD2-CE1 4.39Å
2418	S	91.3	Very high	87.7	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	P	Polyproline II helix	trans	-70.7	120.4	170.7	-178.6	0	0	0	0	109.1	V2416 M2444 E2445 L2598 Y2601	V2416-S2418 PolarHBondContact O-N 2.9Å; S2418-M2444 WeakPolarHBondContact OG-CE 3.36Å; S2418-E2445 WeakPolarHBondContact CA-OE1 3.27Å; S2418-L2598 VanDerWaalsContact CB-O 3.27Å; S2418-L2598 WeakPolarHBondContact CB-O 2.9Å; S2418-L2598 PolarHBondContact N-O 3.17Å; S2418-Y2601 WeakPolarHBondContact O-CE1 3.49Å; S2418-Y2601 PolarHBondContact O-OH 3.11Å
2419	R	91.9	Very high	88	Confident	17 Å²	17	30.2 Å²	30.2	6%	0.064	14%	0.144	C	C	.	.	P	Polyproline II helix	trans	-81.2	130.6	-164.4	-59.7	174.8	-159.3	149.7	18.1	112	P1532 P1533 S1534 L2405 L2417 L2421 M2444 E2445	P1532-R2419 PolarHBondContact O-NH2 2.92Å; P1533-R2419 VanDerWaalsContact C-NH2 3.35Å; P1533-R2419 PolarHBondContact O-NH1 3.18Å; P1533-R2419 PolarHBondContact O-NH2 3.3Å; S1534-R2419 PolarHBondContact O-NH1 3.35Å; L2405-R2419 HydrophobicContact CD1-CG 4.18Å; L2417-R2419 PolarHBondContact O-N 3.19Å; R2419-L2421 HydrophobicContact CB-CD2 4.14Å; R2419-M2444 VanDerWaalsContact O-CA 3.24Å; R2419-M2444 WeakPolarHBondContact O-CA 3.47Å; R2419-M2444 WeakPolarHBondContact O-CB 3.47Å; R2419-E2445 WeakPolarHBondContact CG-OE1 3.42Å; R2419-E2445 PolarHBondContact N-OE1 3.45Å; R2419-E2445 PolarHBondContact O-N 2.97Å
2420	I	94.4	Very high	88.4	Confident	4 Å²	4	30.6 Å²	30.6	2%	0.021	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	129.9	162.2	-53.2	161.4	0	0	0	107.6	F2337 F2394 Y2401 I2423 L2442 Y2601 L2602	F2337-I2420 HydrophobicContact CE1-CB 4.24Å; F2337-I2420 HydrophobicContact CE1-CG2 3.83Å; F2337-I2420 WeakPolarHBondContact CE1-O 3.49Å; F2337-I2420 HydrophobicContact CZ-CG2 3.82Å; F2394-I2420 HydrophobicContact CD2-CD1 3.98Å; F2394-I2420 HydrophobicContact CE2-CD1 3.91Å; Y2401-I2420 HydrophobicContact CE2-CD1 4.49Å; Y2401-I2420 WeakPolarHBondContact OH-CA 3.3Å; Y2401-I2420 WeakPolarHBondContact OH-CB 3.42Å; Y2401-I2420 PolarHBondContact OH-N 3.41Å; Y2401-I2420 PolarHBondContact OH-O 2.81Å; I2420-I2423 HydrophobicContact CG2-CD1 4.13Å; I2420-I2423 HydrophobicContact CG2-CG1 3.73Å; I2420-L2442 HydrophobicContact CG1-CD1 4.5Å; I2420-L2442 HydrophobicContact CG2-CB 4.29Å; I2420-Y2601 HydrophobicContact CD1-CE2 4.24Å; I2420-L2602 HydrophobicContact CD1-CD1 3.95Å; I2420-L2602 HydrophobicContact CD1-CD2 4Å; I2420-L2602 HydrophobicContact CD1-CG 4.33Å
2421	L	93.5	Very high	88.8	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	-15.2	-173.2	-55.9	177.5	0	0	0	112.8	I1536 F2337 R2341 I2344 F2352 F2381 R2419 V2443	I1536-L2421 HydrophobicContact CD1-CD1 4.03Å; I1536-L2421 HydrophobicContact CD1-CD2 3.91Å; F2337-L2421 VanDerWaalsContact CD1-C 3.47Å; F2337-L2421 WeakPolarHBondContact CD1-O 3.41Å; R2341-L2421 WeakPolarHBondContact CD-O 3.49Å; R2341-L2421 HydrophobicContact CG-CB 4.45Å; R2341-L2421 PolarHBondContact NH1-O 2.9Å; I2344-L2421 HydrophobicContact CD1-CD2 3.6Å; F2352-L2421 HydrophobicContact CD2-CB 4.43Å; F2352-L2421 HydrophobicContact CE2-CB 3.71Å; F2352-L2421 HydrophobicContact CE2-CD1 4.33Å; F2352-L2421 HydrophobicContact CZ-CB 4.31Å; F2381-L2421 HydrophobicContact CD1-CD1 3.5Å; F2381-L2421 VanDerWaalsContact CD1-CD1 3.5Å; F2381-L2421 HydrophobicContact CE1-CD1 3.2Å; F2381-L2421 HydrophobicContact CZ-CD1 4.06Å; R2419-L2421 HydrophobicContact CB-CD2 4.14Å; L2421-V2443 PolarHBondContact N-O 2.97Å
2422	G	94.2	Very high	89.1	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176	154.6	172.6	0	0	0	0	0	110.8	V2443	G2422-V2443 PolarHBondContact O-N 3.03Å
2423	I	96.3	Very high	89.7	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	135.1	172.8	-61.6	176.2	0	0	0	108	Y2332 F2337 L2386 M2391 F2394 I2420 V2441 L2442	Y2332-I2423 HydrophobicContact CD2-CB 4.4Å; Y2332-I2423 HydrophobicContact CD2-CG2 3.78Å; Y2332-I2423 HydrophobicContact CE2-CG2 4.38Å; Y2332-I2423 HydrophobicContact CG-CG2 4.41Å; Y2332-I2423 PolarHBondContact N-O 2.95Å; F2337-I2423 HydrophobicContact CE2-CB 4.19Å; F2337-I2423 HydrophobicContact CE2-CD1 4.31Å; F2337-I2423 HydrophobicContact CE2-CG1 4.01Å; F2337-I2423 HydrophobicContact CZ-CD1 4.02Å; F2337-I2423 HydrophobicContact CZ-CG1 3.86Å; L2386-I2423 HydrophobicContact CD1-CD1 4.41Å; L2386-I2423 HydrophobicContact CD1-CG1 4.45Å; L2386-I2423 HydrophobicContact CD1-CG2 3.47Å; L2386-I2423 VanDerWaalsContact CD1-CG2 3.47Å; M2391-I2423 HydrophobicContact CE-CG2 3.63Å; M2391-I2423 HydrophobicContact SD-CG2 3.95Å; F2394-I2423 HydrophobicContact CB-CD1 4.25Å; F2394-I2423 HydrophobicContact CD1-CD1 3.46Å; F2394-I2423 VanDerWaalsContact CD1-CD1 3.46Å; F2394-I2423 HydrophobicContact CD2-CD1 3.81Å; F2394-I2423 HydrophobicContact CE1-CD1 3.71Å; F2394-I2423 HydrophobicContact CE2-CD1 4.04Å; F2394-I2423 HydrophobicContact CG-CD1 3.52Å; F2394-I2423 HydrophobicContact CZ-CD1 4Å; I2420-I2423 HydrophobicContact CG2-CD1 4.13Å; I2420-I2423 HydrophobicContact CG2-CG1 3.73Å; I2423-V2441 WeakPolarHBondContact CA-O 3.47Å; I2423-L2442 HydrophobicContact CG1-CB 4.13Å
2424	F	95.4	Very high	89.8	Confident	0 Å²	0	28.2 Å²	28.2	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	128.3	-168.8	-52.8	-87.1	0	0	0	111	I2175 L2179 C2330 V2331 F2352 V2441 V2443	I2175-F2424 HydrophobicContact CD1-CB 3.86Å; I2175-F2424 HydrophobicContact CD1-CD2 4.11Å; I2175-F2424 HydrophobicContact CD1-CG 3.98Å; I2175-F2424 HydrophobicContact CG1-CB 4.3Å; I2175-F2424 HydrophobicContact CG1-CG 4.38Å; I2175-F2424 HydrophobicContact CG2-CD1 3.46Å; I2175-F2424 VanDerWaalsContact CG2-CD1 3.46Å; I2175-F2424 HydrophobicContact CG2-CD2 4.04Å; I2175-F2424 HydrophobicContact CG2-CE1 3.51Å; I2175-F2424 HydrophobicContact CG2-CE2 4.09Å; I2175-F2424 HydrophobicContact CG2-CG 3.74Å; I2175-F2424 HydrophobicContact CG2-CZ 3.84Å; L2179-F2424 HydrophobicContact CD1-CE1 4.12Å; L2179-F2424 HydrophobicContact CD1-CZ 4.2Å; L2179-F2424 HydrophobicContact CD2-CE1 4.32Å; L2179-F2424 HydrophobicContact CG-CE1 4.47Å; C2330-F2424 WeakPolarHBondContact O-CA 3.18Å; V2331-F2424 HydrophobicContact CB-CD1 4.31Å; V2331-F2424 HydrophobicContact CB-CE1 4.29Å; V2331-F2424 HydrophobicContact CG1-CD1 4.22Å; V2331-F2424 HydrophobicContact CG1-CE1 3.79Å; V2331-F2424 HydrophobicContact CG2-CD1 3.98Å; V2331-F2424 HydrophobicContact CG2-CE1 3.94Å; F2352-F2424 HydrophobicContact CE1-CZ 4.02Å; F2352-F2424 HydrophobicContact CZ-CE2 4.28Å; F2352-F2424 HydrophobicContact CZ-CZ 4.18Å; F2424-V2441 HydrophobicContact CB-CG2 4.06Å; F2424-V2441 PolarHBondContact N-O 2.87Å; F2424-V2441 PolarHBondContact O-N 3.35Å; F2424-V2443 HydrophobicContact CD2-CG2 3.96Å; F2424-V2443 HydrophobicContact CE2-CB 4.36Å; F2424-V2443 HydrophobicContact CE2-CG2 3.66Å
2425	H	94.3	Very high	89.7	Confident	46 Å²	46	31.8 Å²	31.8	21%	0.213	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	112.9	159.8	-171.6	73.8	0	0	0	107.1	F2328 C2329 C2330 Y2332 D2440	F2328-H2425 AromaticContact CE2-CD2 3.4Å; F2328-H2425 VanDerWaalsContact CE2-CD2 3.4Å; F2328-H2425 WeakPolarHBondContact CE2-CD2 3.38Å; F2328-H2425 AromaticContact CE2-NE2 3.62Å; C2329-H2425 CarbonylContact C-O 3.46Å; C2329-H2425 WeakPolarHBondContact CA-O 3.39Å; C2330-H2425 HydrophobicContact CB-CB 4.02Å; C2330-H2425 PolarHBondContact N-O 3.32Å; C2330-H2425 PolarHBondContact O-N 2.87Å; Y2332-H2425 HydrophobicContact CE2-CB 3.72Å; H2425-D2440 WeakPolarHBondContact CB-OD1 3.37Å; H2425-D2440 IonicContact CE1-OD1 2.76Å; H2425-D2440 IonicContact CE1-OD2 2.78Å; H2425-D2440 IonicContact CG-OD1 3.86Å; H2425-D2440 VanDerWaalsContact ND1-CG 3.28Å; H2425-D2440 IonicContact ND1-OD1 3.55Å; H2425-D2440 PolarHBondContact ND1-OD1 2.82Å; H2425-D2440 IonicContact ND1-OD2 3.42Å; H2425-D2440 PolarHBondContact ND1-OD2 2.85Å
2426	V	92.6	Very high	89.5	Confident	0 Å²	0	34.4 Å²	34.4	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	147.5	-175.2	64.3	0	0	0	0	110.3	F2171 I2174 I2175 F2439 V2441	F2171-V2426 HydrophobicContact CD2-CG1 3.72Å; F2171-V2426 HydrophobicContact CE2-CG1 4.3Å; F2171-V2426 HydrophobicContact CG-CG1 4.42Å; I2174-V2426 HydrophobicContact CB-CG2 3.82Å; I2174-V2426 HydrophobicContact CD1-CG2 4.11Å; I2174-V2426 HydrophobicContact CG2-CG2 3.77Å; I2175-V2426 HydrophobicContact CD1-CB 4.35Å; I2175-V2426 HydrophobicContact CD1-CG1 4.18Å; I2175-V2426 HydrophobicContact CG1-CB 4.07Å; I2175-V2426 HydrophobicContact CG1-CG1 4.39Å; I2175-V2426 HydrophobicContact CG1-CG2 3.91Å; V2426-F2439 HydrophobicContact CG1-CB 4.09Å; V2426-F2439 PolarHBondContact N-O 2.65Å; V2426-F2439 PolarHBondContact O-N 2.77Å; V2426-V2441 HydrophobicContact CG1-CG2 4.26Å
2427	G	89.8	Confident	89.2	Confident	0 Å²	0	37.8 Å²	37.8	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-179.9	178.1	171.6	0	0	0	0	0	113.2	F2328 H2437	F2328-G2427 WeakPolarHBondContact CD1-O 3.48Å; F2328-G2427 VanDerWaalsContact CE1-C 3.43Å; F2328-G2427 PolarHBondContact N-O 3.1Å; F2328-G2427 PolarHBondContact O-N 3.48Å; F2328-G2427 VanDerWaalsContact O-N 3.1Å; G2427-H2437 WeakPolarHBondContact CA-O 3.41Å
2428	F	90.4	Very high	89	Confident	11 Å²	11	46.6 Å²	46.6	5%	0.048	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	161	179.5	67.8	-94	0	0	0	111.4	D2168 I2174 T2325 T2326 F2327 E2435 A2436 H2437	D2168-F2428 HydrophobicContact CB-CZ 4.3Å; I2174-F2428 HydrophobicContact CD1-CD1 4.27Å; T2325-F2428 HydrophobicContact CG2-CB 3.73Å; T2325-F2428 HydrophobicContact CG2-CD2 3.86Å; T2325-F2428 HydrophobicContact CG2-CG 4.14Å; T2326-F2428 CarbonylContact O-C 3.6Å; T2326-F2428 WeakPolarHBondContact O-CA 3.17Å; F2327-F2428 HydrophobicContact CD1-CB 3.7Å; F2327-F2428 HydrophobicContact CE1-CB 4.06Å; F2428-E2435 HydrophobicContact CE2-CG 4.4Å; F2428-A2436 CarbonylContact O-C 3.58Å; F2428-A2436 VanDerWaalsContact O-CA 3.23Å; F2428-A2436 WeakPolarHBondContact O-CA 3.25Å; F2428-H2437 HydrophobicContact CE1-CB 4.14Å; F2428-H2437 HydrophobicContact CZ-CB 4.45Å; F2428-H2437 AromaticContact CZ-CD2 3.52Å; F2428-H2437 PolarHBondContact N-O 2.97Å; F2428-H2437 PolarHBondContact O-N 2.89Å
2429	K	88.4	Confident	88.9	Confident	126 Å²	126	48.5 Å²	48.5	55%	0.548	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.6	111.6	169.2	174.6	-179.1	179	-174	0	108.2	T2326 E2435 A2436	T2326-K2429 PolarHBondContact N-O 3.16Å; T2326-K2429 PolarHBondContact O-N 2.85Å; T2326-K2429 PolarHBondContact OG1-O 3.17Å; K2429-E2435 WeakPolarHBondContact CA-O 3.21Å; K2429-A2436 HydrophobicContact CB-CB 4.01Å; K2429-A2436 HydrophobicContact CG-CB 4.09Å
2430	N	85.6	Confident	88.9	Confident	26 Å²	26	49.7 Å²	49.7	14%	0.139	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	116.7	174.2	-174.3	-38.9	0	0	0	109	S2324 T2325 T2432 S2433 G2434 E2435	S2324-N2430 CarbonylContact O-C 2.89Å; T2325-N2430 HydrophobicContact CG2-CB 4.42Å; T2325-N2430 PolarHBondContact OG1-ND2 3.37Å; N2430-T2432 VanDerWaalsContact C-N 3.25Å; N2430-T2432 PolarHBondContact O-N 3.23Å; N2430-T2432 WeakPolarHBondContact OD1-CA 3.2Å; N2430-T2432 WeakPolarHBondContact OD1-CB 3.33Å; N2430-T2432 PolarHBondContact OD1-N 3.27Å; N2430-S2433 WeakPolarHBondContact CB-OG 3.37Å; N2430-S2433 VanDerWaalsContact CG-OG 3.23Å; N2430-S2433 PolarHBondContact OD1-N 2.82Å; N2430-G2434 CarbonylContact O-C 3.42Å; N2430-G2434 VanDerWaalsContact O-CA 3.28Å; N2430-G2434 WeakPolarHBondContact O-CA 3.41Å; N2430-G2434 PolarHBondContact O-N 3.08Å; N2430-E2435 PolarHBondContact N-O 2.55Å
2431	S	84.8	Confident	88.9	Confident	92 Å²	92	49.5 Å²	49.5	64%	0.643	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-16.9	179.7	58.9	0	0	0	0	113.6	S2324	S2324-S2431 PolarHBondContact O-N 2.88Å; S2324-S2431 PolarHBondContact O-OG 2.9Å
2432	T	82	Confident	89	Confident	112 Å²	112	49.8 Å²	49.8	69%	0.687	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.7	-38.9	-176.1	-50.4	0	0	0	0	112.1	N2430	N2430-T2432 VanDerWaalsContact C-N 3.25Å; N2430-T2432 PolarHBondContact O-N 3.23Å; N2430-T2432 WeakPolarHBondContact OD1-CA 3.2Å; N2430-T2432 WeakPolarHBondContact OD1-CB 3.33Å; N2430-T2432 PolarHBondContact OD1-N 3.27Å
2433	S	82.1	Confident	89	Confident	71 Å²	71	49.8 Å²	49.8	50%	0.497	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.3	-15	172.7	65.9	0	0	0	0	113.8	N2430 E2435	N2430-S2433 WeakPolarHBondContact CB-OG 3.37Å; N2430-S2433 VanDerWaalsContact CG-OG 3.23Å; N2430-S2433 PolarHBondContact OD1-N 2.82Å; S2433-E2435 PolarHBondContact O-N 2.81Å; S2433-E2435 VanDerWaalsContact OG-CB 3.22Å; S2433-E2435 WeakPolarHBondContact OG-CB 3.36Å; S2433-E2435 PolarHBondContact OG-N 2.89Å
2434	G	83.1	Confident	88.8	Confident	59 Å²	59	51 Å²	51	61%	0.608	28%	0.282	S	S	*	.			trans	75	-4	-171.4	0	0	0	0	0	114.1	N2430	N2430-G2434 CarbonylContact O-C 3.42Å; N2430-G2434 VanDerWaalsContact O-CA 3.28Å; N2430-G2434 WeakPolarHBondContact O-CA 3.41Å; N2430-G2434 PolarHBondContact O-N 3.08Å
2435	E	82	Confident	88.5	Confident	96 Å²	96	51.6 Å²	51.6	45%	0.449	29%	0.285	S	S	.	.			trans	-70.1	133.1	-176.7	-171.7	172.7	-163.9	0	0	111.5	F2428 K2429 N2430 S2433 H2437	F2428-E2435 HydrophobicContact CE2-CG 4.4Å; K2429-E2435 WeakPolarHBondContact CA-O 3.21Å; N2430-E2435 PolarHBondContact N-O 2.55Å; S2433-E2435 PolarHBondContact O-N 2.81Å; S2433-E2435 VanDerWaalsContact OG-CB 3.22Å; S2433-E2435 WeakPolarHBondContact OG-CB 3.36Å; S2433-E2435 PolarHBondContact OG-N 2.89Å; E2435-H2437 WeakPolarHBondContact CG-NE2 3.48Å; E2435-H2437 IonicContact OE1-CD2 2.84Å; E2435-H2437 IonicContact OE1-CE1 3.08Å; E2435-H2437 IonicContact OE1-NE2 3.85Å; E2435-H2437 PolarHBondContact OE1-NE2 3.44Å
2436	A	83.7	Confident	88.3	Confident	62 Å²	62	50 Å²	50	51%	0.512	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	120.5	178.1	0	0	0	0	0	111.3	F2428 K2429	F2428-A2436 CarbonylContact O-C 3.58Å; F2428-A2436 VanDerWaalsContact O-CA 3.23Å; F2428-A2436 WeakPolarHBondContact O-CA 3.25Å; K2429-A2436 HydrophobicContact CB-CB 4.01Å; K2429-A2436 HydrophobicContact CG-CB 4.09Å
2437	H	85.7	Confident	88	Confident	71 Å²	71	51.2 Å²	51.2	33%	0.329	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	147.5	179.4	-68.2	-81.5	0	0	0	110.9	G2427 F2428 E2435 F2439	G2427-H2437 WeakPolarHBondContact CA-O 3.41Å; F2428-H2437 HydrophobicContact CE1-CB 4.14Å; F2428-H2437 HydrophobicContact CZ-CB 4.45Å; F2428-H2437 AromaticContact CZ-CD2 3.52Å; F2428-H2437 PolarHBondContact N-O 2.97Å; F2428-H2437 PolarHBondContact O-N 2.89Å; E2435-H2437 WeakPolarHBondContact CG-NE2 3.48Å; E2435-H2437 IonicContact OE1-CD2 2.84Å; E2435-H2437 IonicContact OE1-CE1 3.08Å; E2435-H2437 IonicContact OE1-NE2 3.85Å; E2435-H2437 PolarHBondContact OE1-NE2 3.44Å; H2437-F2439 HydrophobicContact CB-CE2 3.73Å; H2437-F2439 HydrophobicContact CB-CZ 3.95Å
2438	R	87.6	Confident	87.9	Confident	186 Å²	186	52.1 Å²	52.1	70%	0.702	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-137.5	132.5	173.4	-51.8	-154	170.5	106.2	-4.1	109.4	F2328	F2328-R2438 HydrophobicContact CE1-CG 4.46Å; F2328-R2438 HydrophobicContact CZ-CB 4.33Å; F2328-R2438 HydrophobicContact CZ-CG 3.79Å
2439	F	89	Confident	87.5	Confident	40 Å²	40	54.3 Å²	54.3	18%	0.175	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	131	176.8	-51.9	-78.9	0	0	0	109.3	F2171 V2426 H2437 V2441	F2171-F2439 HydrophobicContact CB-CD2 4.44Å; F2171-F2439 AromaticContact CD1-CD2 3.78Å; F2171-F2439 HydrophobicContact CD1-CD2 3.78Å; F2171-F2439 AromaticContact CD1-CE2 3.74Å; F2171-F2439 HydrophobicContact CD1-CE2 3.74Å; F2171-F2439 HydrophobicContact CD1-CG 4.42Å; F2171-F2439 HydrophobicContact CD1-CZ 4.36Å; F2171-F2439 HydrophobicContact CD2-CD2 4.5Å; F2171-F2439 HydrophobicContact CE1-CD2 4.12Å; F2171-F2439 HydrophobicContact CE1-CE2 4.24Å; F2171-F2439 HydrophobicContact CE1-CG 4.32Å; F2171-F2439 AromaticContact CG-CD2 3.99Å; F2171-F2439 HydrophobicContact CG-CD2 3.99Å; F2171-F2439 HydrophobicContact CG-CE2 4.26Å; V2426-F2439 HydrophobicContact CG1-CB 4.09Å; V2426-F2439 PolarHBondContact N-O 2.65Å; V2426-F2439 PolarHBondContact O-N 2.77Å; H2437-F2439 HydrophobicContact CB-CE2 3.73Å; H2437-F2439 HydrophobicContact CB-CZ 3.95Å; F2439-V2441 HydrophobicContact CB-CG1 3.89Å
2440	D	92.8	Very high	86.9	Confident	41 Å²	41	51.5 Å²	51.5	22%	0.219	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	123.6	158.6	-78.5	-57.2	0	0	0	107.4	E2385 L2386 M2391 H2425	E2385-D2440 WeakPolarHBondContact CA-O 3.16Å; L2386-D2440 HydrophobicContact CB-CB 4.08Å; L2386-D2440 PolarHBondContact N-O 2.76Å; M2391-D2440 HydrophobicContact CE-CB 3.68Å; M2391-D2440 VanDerWaalsContact CE-OD1 3.27Å; M2391-D2440 WeakPolarHBondContact CE-OD1 3.14Å; H2425-D2440 WeakPolarHBondContact CB-OD1 3.37Å; H2425-D2440 IonicContact CE1-OD1 2.76Å; H2425-D2440 IonicContact CE1-OD2 2.78Å; H2425-D2440 IonicContact CG-OD1 3.86Å; H2425-D2440 VanDerWaalsContact ND1-CG 3.28Å; H2425-D2440 IonicContact ND1-OD1 3.55Å; H2425-D2440 PolarHBondContact ND1-OD1 2.82Å; H2425-D2440 IonicContact ND1-OD2 3.42Å; H2425-D2440 PolarHBondContact ND1-OD2 2.85Å
2441	V	93.7	Very high	86.5	Confident	1 Å²	1	53.2 Å²	53.2	1%	0.006	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	140.8	-176.3	-61.1	0	0	0	0	112.4	F2171 I2175 I2383 K2384 I2423 F2424 V2426 F2439	F2171-V2441 HydrophobicContact CE2-CG1 3.79Å; F2171-V2441 HydrophobicContact CE2-CG2 4.33Å; F2171-V2441 HydrophobicContact CZ-CG1 4.01Å; I2175-V2441 HydrophobicContact CD1-CG2 3.78Å; I2383-V2441 HydrophobicContact CG2-CB 3.81Å; I2383-V2441 HydrophobicContact CG2-CG1 4.24Å; I2383-V2441 HydrophobicContact CG2-CG2 4.18Å; K2384-V2441 WeakPolarHBondContact O-CA 3.3Å; I2423-V2441 WeakPolarHBondContact CA-O 3.47Å; F2424-V2441 HydrophobicContact CB-CG2 4.06Å; F2424-V2441 PolarHBondContact N-O 2.87Å; F2424-V2441 PolarHBondContact O-N 3.35Å; V2426-V2441 HydrophobicContact CG1-CG2 4.26Å; F2439-V2441 HydrophobicContact CB-CG1 3.89Å
2442	L	94.5	Very high	85.8	Confident	5 Å²	5	54.1 Å²	54.1	3%	0.026	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	143.2	165.7	75.9	91.8	0	0	0	109.6	I2383 K2384 L2386 I2420 I2423 M2444 L2602	I2383-L2442 WeakPolarHBondContact CA-O 3.14Å; K2384-L2442 HydrophobicContact CB-CD1 4.28Å; K2384-L2442 HydrophobicContact CB-CD2 4.19Å; K2384-L2442 HydrophobicContact CB-CG 3.99Å; K2384-L2442 HydrophobicContact CD-CD2 4.16Å; K2384-L2442 HydrophobicContact CG-CD2 4.33Å; K2384-L2442 PolarHBondContact N-O 3.49Å; K2384-L2442 PolarHBondContact O-N 3.05Å; L2386-L2442 HydrophobicContact CD1-CB 4.04Å; L2386-L2442 HydrophobicContact CD2-CB 4.36Å; L2386-L2442 HydrophobicContact CD2-CD2 3.6Å; L2386-L2442 HydrophobicContact CG-CB 4.06Å; L2386-L2442 HydrophobicContact CG-CD2 4Å; L2386-L2442 HydrophobicContact CG-CG 4.43Å; I2420-L2442 HydrophobicContact CG1-CD1 4.5Å; I2420-L2442 HydrophobicContact CG2-CB 4.29Å; I2423-L2442 HydrophobicContact CG1-CB 4.13Å; L2442-M2444 HydrophobicContact CD1-CB 3.69Å; L2442-M2444 HydrophobicContact CD1-CG 3.69Å; L2442-M2444 HydrophobicContact CD1-SD 3.73Å; L2442-L2602 HydrophobicContact CD2-CD1 4.08Å
2443	V	94.5	Very high	85.4	Confident	0 Å²	0	54 Å²	54	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.9	124	168.2	-176.3	0	0	0	0	108	F2352 L2356 F2381 I2383 L2421 G2422 F2424	F2352-V2443 HydrophobicContact CE2-CB 4.28Å; F2352-V2443 HydrophobicContact CE2-CG1 3.68Å; F2352-V2443 HydrophobicContact CZ-CB 4.17Å; F2352-V2443 HydrophobicContact CZ-CG1 4.02Å; F2352-V2443 HydrophobicContact CZ-CG2 4.49Å; L2356-V2443 HydrophobicContact CD1-CG2 4.45Å; L2356-V2443 HydrophobicContact CD2-CG1 4.07Å; L2356-V2443 HydrophobicContact CD2-CG2 3.94Å; F2381-V2443 HydrophobicContact CB-CG1 3.83Å; F2381-V2443 HydrophobicContact CG-CG1 4.14Å; I2383-V2443 HydrophobicContact CG1-CG2 4.14Å; L2421-V2443 PolarHBondContact N-O 2.97Å; G2422-V2443 PolarHBondContact O-N 3.03Å; F2424-V2443 HydrophobicContact CD2-CG2 3.96Å; F2424-V2443 HydrophobicContact CE2-CB 4.36Å; F2424-V2443 HydrophobicContact CE2-CG2 3.66Å
2444	M	92.6	Very high	85.4	Confident	26 Å²	26	51.6 Å²	51.6	13%	0.128	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	160.3	179.9	63.2	-174.7	-65	0	0	111.7	F2381 V2382 S2418 R2419 L2442 I2599	F2381-M2444 WeakPolarHBondContact CA-O 3.23Å; F2381-M2444 WeakPolarHBondContact CB-O 3.38Å; V2382-M2444 HydrophobicContact CB-CG 3.96Å; V2382-M2444 HydrophobicContact CG1-CG 4.48Å; V2382-M2444 PolarHBondContact N-O 3.02Å; V2382-M2444 WeakPolarHBondContact O-CG 3.45Å; V2382-M2444 PolarHBondContact O-N 2.9Å; S2418-M2444 WeakPolarHBondContact OG-CE 3.36Å; R2419-M2444 VanDerWaalsContact O-CA 3.24Å; R2419-M2444 WeakPolarHBondContact O-CA 3.47Å; R2419-M2444 WeakPolarHBondContact O-CB 3.47Å; L2442-M2444 HydrophobicContact CD1-CB 3.69Å; L2442-M2444 HydrophobicContact CD1-CG 3.69Å; L2442-M2444 HydrophobicContact CD1-SD 3.73Å; M2444-I2599 HydrophobicContact CE-CG2 4.08Å
2445	E	89.7	Confident	85.4	Confident	12 Å²	12	50.4 Å²	50.4	6%	0.056	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	134.8	176.3	68.8	-168.6	145.3	0	0	112.6	P1532 S2418 R2419 L2447	P1532-E2445 WeakPolarHBondContact CB-OE1 3.32Å; S2418-E2445 WeakPolarHBondContact CA-OE1 3.27Å; R2419-E2445 WeakPolarHBondContact CG-OE1 3.42Å; R2419-E2445 PolarHBondContact N-OE1 3.45Å; R2419-E2445 PolarHBondContact O-N 2.97Å; E2445-L2447 HydrophobicContact CG-CD2 4.26Å; E2445-L2447 PolarHBondContact O-N 2.89Å
2446	N	89.7	Confident	85.6	Confident	14 Å²	14	51.3 Å²	51.3	8%	0.075	27%	0.267	C	S	.	.			trans	-79	104.9	165.9	-178.5	15.1	0	0	0	108.8	E2379 R2380 V2382 Y2448 Y2449	E2379-N2446 WeakPolarHBondContact O-CB 3.45Å; E2379-N2446 PolarHBondContact O-ND2 3.26Å; R2380-N2446 VanDerWaalsContact O-CB 3.22Å; R2380-N2446 WeakPolarHBondContact O-CB 3.47Å; R2380-N2446 PolarHBondContact O-N 3.18Å; V2382-N2446 HydrophobicContact CG2-CB 3.95Å; N2446-Y2448 PolarHBondContact O-N 2.89Å; N2446-Y2448 PolarHBondContact OD1-N 3.49Å; N2446-Y2448 VanDerWaalsContact OD1-N 3.09Å; N2446-Y2449 WeakPolarHBondContact O-CB 3.22Å; N2446-Y2449 PolarHBondContact O-N 2.93Å
2447	L	86.9	Confident	85.9	Confident	25 Å²	25	49 Å²	49	13%	0.131	25%	0.247	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.4	-26.5	175.4	-60.5	172.8	0	0	0	112.9	P1532 E2445 L2584 I2595	P1532-L2447 HydrophobicContact CB-CD2 4.47Å; P1532-L2447 HydrophobicContact CG-CD2 3.82Å; E2445-L2447 HydrophobicContact CG-CD2 4.26Å; E2445-L2447 PolarHBondContact O-N 2.89Å; L2447-L2584 HydrophobicContact CD1-CB 4.48Å; L2447-L2584 HydrophobicContact CD1-CD2 4.26Å; L2447-I2595 HydrophobicContact CB-CG2 4.17Å; L2447-I2595 VanDerWaalsContact O-CG2 3.27Å; L2447-I2595 WeakPolarHBondContact O-CG2 3.05Å
2448	Y	86.6	Confident	86.2	Confident	18 Å²	18	46.2 Å²	46.2	7%	0.071	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	10.4	-178.5	-51.5	-45.6	0	0	0	114.8	N2446 G2450 R2451 L2454 I2457 L2584 G2586 I2595	N2446-Y2448 PolarHBondContact O-N 2.89Å; N2446-Y2448 PolarHBondContact OD1-N 3.49Å; N2446-Y2448 VanDerWaalsContact OD1-N 3.09Å; Y2448-G2450 PolarHBondContact O-N 2.88Å; Y2448-R2451 PolarHBondContact O-N 2.84Å; Y2448-L2454 HydrophobicContact CD1-CD1 3.49Å; Y2448-L2454 VanDerWaalsContact CD1-CD1 3.49Å; Y2448-L2454 HydrophobicContact CD2-CD1 4.15Å; Y2448-L2454 HydrophobicContact CE1-CD1 4Å; Y2448-L2454 HydrophobicContact CG-CD1 3.57Å; Y2448-I2457 HydrophobicContact CD2-CD1 4.26Å; Y2448-I2457 HydrophobicContact CE2-CD1 3.73Å; Y2448-I2457 HydrophobicContact CE2-CG1 4.09Å; Y2448-I2457 HydrophobicContact CE2-CG2 4.37Å; Y2448-I2457 WeakPolarHBondContact OH-CG2 3.26Å; Y2448-L2584 HydrophobicContact CE2-CD2 3.86Å; Y2448-L2584 WeakPolarHBondContact OH-CD2 3.27Å; Y2448-L2584 WeakPolarHBondContact OH-CG 3.31Å; Y2448-G2586 PolarHBondContact OH-N 2.76Å; Y2448-I2595 HydrophobicContact CD1-CB 4.17Å; Y2448-I2595 HydrophobicContact CD1-CG2 3.81Å; Y2448-I2595 HydrophobicContact CE1-CB 3.98Å; Y2448-I2595 HydrophobicContact CE1-CG2 3.83Å
2449	Y	82.7	Confident	86.4	Confident	57 Å²	57	38.5 Å²	38.5	22%	0.224	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53.4	129.3	176.7	175	-124.6	0	0	0	111.3	D2378 R2380 N2446 R2451	D2378-Y2449 VanDerWaalsContact O-CE2 3.24Å; D2378-Y2449 WeakPolarHBondContact O-CE2 3.28Å; R2380-Y2449 HydrophobicContact CB-CD2 3.93Å; R2380-Y2449 HydrophobicContact CB-CE2 3.99Å; R2380-Y2449 HydrophobicContact CB-CG 4.28Å; R2380-Y2449 HydrophobicContact CG-CD1 4.28Å; R2380-Y2449 HydrophobicContact CG-CD2 4.44Å; R2380-Y2449 HydrophobicContact CG-CE1 4.35Å; R2380-Y2449 HydrophobicContact CG-CG 4.33Å; R2380-Y2449 PolarHBondContact NH2-OH 3.09Å; N2446-Y2449 WeakPolarHBondContact O-CB 3.22Å; N2446-Y2449 PolarHBondContact O-N 2.93Å; Y2449-R2451 VanDerWaalsContact C-N 3.31Å; Y2449-R2451 PolarHBondContact O-N 3.05Å
2450	G	76.5	Confident	86.6	Confident	68 Å²	68	36.6 Å²	36.6	70%	0.701	20%	0.198	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.7	2.4	-178.6	0	0	0	0	0	116.3	Y2448	Y2448-G2450 PolarHBondContact O-N 2.88Å
2451	R	77.1	Confident	86.5	Confident	62 Å²	62	36 Å²	36	23%	0.234	19%	0.193	C	C	.	.			trans	-115	94	-173.2	-59.8	178	-176.1	-98.8	4.6	112.5	Y2448 Y2449 I2595	Y2448-R2451 PolarHBondContact O-N 2.84Å; Y2449-R2451 VanDerWaalsContact C-N 3.31Å; Y2449-R2451 PolarHBondContact O-N 3.05Å; R2451-I2595 VanDerWaalsContact CD-CG1 3.42Å
2452	T	68.2	Low	86.2	Confident	110 Å²	110	36 Å²	36	68%	0.675	19%	0.193	S	C	*	.			trans	-92.2	-3.5	-176.5	54.7	0	0	0	0	115.1
2453	Q	73.9	Confident	85.7	Confident	109 Å²	109	36.2 Å²	36.2	51%	0.509	20%	0.195	S	C	.	.			trans	-112.2	26.9	-171.1	-57.3	-176.3	17.8	0	0	113.4	A2455 T2590	Q2453-A2455 PolarHBondContact O-N 2.92Å; Q2453-T2590 HydrophobicContact CB-CG2 4.26Å; Q2453-T2590 PolarHBondContact OE1-OG1 3.1Å
2454	L	82.9	Confident	84.9	Confident	22 Å²	22	39 Å²	39	12%	0.115	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	127	175.4	-60.3	177	0	0	0	110.3	Y2448 I2457 V2535 D2588 I2595	Y2448-L2454 HydrophobicContact CD1-CD1 3.49Å; Y2448-L2454 VanDerWaalsContact CD1-CD1 3.49Å; Y2448-L2454 HydrophobicContact CD2-CD1 4.15Å; Y2448-L2454 HydrophobicContact CE1-CD1 4Å; Y2448-L2454 HydrophobicContact CG-CD1 3.57Å; L2454-I2457 HydrophobicContact CD1-CD1 4.44Å; L2454-I2457 HydrophobicContact CD1-CG1 4.46Å; L2454-V2535 HydrophobicContact CB-CG2 4.48Å; L2454-V2535 VanDerWaalsContact O-CG2 3.28Å; L2454-V2535 WeakPolarHBondContact O-CG2 3.43Å; L2454-D2588 HydrophobicContact CD2-CB 4.14Å; L2454-I2595 HydrophobicContact CD2-CD1 3.73Å; L2454-I2595 HydrophobicContact CD2-CG1 4.49Å
2455	A	83.3	Confident	83.9	Confident	34 Å²	34	40.9 Å²	40.9	28%	0.281	22%	0.215	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	-37.7	176.9	0	0	0	0	0	112.1	Q2453 V2587 T2589	Q2453-A2455 PolarHBondContact O-N 2.92Å; A2455-V2587 PolarHBondContact N-O 2.77Å; A2455-T2589 HydrophobicContact CB-CG2 3.87Å
2456	Y	86.3	Confident	82.8	Confident	114 Å²	114	49 Å²	49	45%	0.447	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	151.3	-176.9	-56.4	-76.2	0	0	0	111.1	L2538 V2587	Y2456-L2538 HydrophobicContact CD1-CD1 3.9Å; Y2456-V2587 PolarHBondContact O-N 2.73Å
2457	I	90	Very high	82.4	Confident	15 Å²	15	49.4 Å²	49.4	8%	0.077	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	135.1	168.4	-67.5	167.1	0	0	0	107.9	Y2448 L2454 V2535 V2537 L2538 L2584 V2585	Y2448-I2457 HydrophobicContact CD2-CD1 4.26Å; Y2448-I2457 HydrophobicContact CE2-CD1 3.73Å; Y2448-I2457 HydrophobicContact CE2-CG1 4.09Å; Y2448-I2457 HydrophobicContact CE2-CG2 4.37Å; Y2448-I2457 WeakPolarHBondContact OH-CG2 3.26Å; L2454-I2457 HydrophobicContact CD1-CD1 4.44Å; L2454-I2457 HydrophobicContact CD1-CG1 4.46Å; I2457-V2535 HydrophobicContact CB-CG1 4.47Å; I2457-V2535 HydrophobicContact CD1-CB 4.16Å; I2457-V2535 HydrophobicContact CD1-CG1 4.14Å; I2457-V2535 HydrophobicContact CG1-CG1 3.97Å; I2457-V2537 HydrophobicContact CG2-CG1 4.34Å; I2457-V2537 HydrophobicContact CG2-CG2 4.09Å; I2457-L2538 WeakPolarHBondContact O-CB 3.39Å; I2457-L2538 PolarHBondContact O-N 3.28Å; I2457-L2584 HydrophobicContact CG2-CD1 4.01Å; I2457-L2584 HydrophobicContact CG2-CG 4.4Å; I2457-V2585 CarbonylContact C-O 3.51Å; I2457-V2585 WeakPolarHBondContact CA-O 3.33Å
2458	Y	92.3	Very high	82	Confident	11 Å²	11	52.1 Å²	52.1	4%	0.043	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.1	175.6	-62.8	-84.4	0	0	0	111.5	L2538 N2542 L2543 L2584 V2585 V2587	Y2458-L2538 CarbonylContact C-O 3.56Å; Y2458-L2538 WeakPolarHBondContact CA-O 3.45Å; Y2458-L2538 HydrophobicContact CD1-CB 3.57Å; Y2458-L2538 HydrophobicContact CE1-CB 3.64Å; Y2458-L2538 HydrophobicContact CE1-CD1 3.79Å; Y2458-L2538 HydrophobicContact CE1-CG 4.36Å; Y2458-L2538 HydrophobicContact CG-CB 4.45Å; Y2458-N2542 HydrophobicContact CE1-CB 4.35Å; Y2458-L2543 HydrophobicContact CD1-CB 3.72Å; Y2458-L2543 HydrophobicContact CD1-CD1 4.38Å; Y2458-L2543 HydrophobicContact CD1-CG 4.49Å; Y2458-L2543 HydrophobicContact CD2-CD1 4.38Å; Y2458-L2543 HydrophobicContact CE1-CB 3.77Å; Y2458-L2543 HydrophobicContact CE1-CD1 4.1Å; Y2458-L2543 HydrophobicContact CE2-CD1 4.09Å; Y2458-L2543 HydrophobicContact CG-CB 4.4Å; Y2458-L2584 CarbonylContact O-C 3.41Å; Y2458-L2584 WeakPolarHBondContact O-CA 3.26Å; Y2458-V2585 PolarHBondContact N-O 3.47Å; Y2458-V2585 PolarHBondContact O-N 3.48Å; Y2458-V2587 HydrophobicContact CD2-CG2 3.99Å; Y2458-V2587 HydrophobicContact CE2-CG2 3.78Å
2459	D	91.6	Very high	81.7	Confident	25 Å²	25	53 Å²	53	13%	0.134	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	124.3	161.5	156.3	23.8	0	0	0	108.6	R2467 V2537 L2538 L2539 S2582 L2584	D2459-R2467 PolarHBondContact O-NH2 3.14Å; D2459-R2467 IonicContact OD1-CZ 3.88Å; D2459-R2467 IonicContact OD1-NH1 3.65Å; D2459-R2467 PolarHBondContact OD1-NH1 3.46Å; D2459-R2467 IonicContact OD1-NH2 2.73Å; D2459-R2467 PolarHBondContact OD1-NH2 3.28Å; D2459-R2467 IonicContact OD2-CZ 3.22Å; D2459-R2467 IonicContact OD2-NH1 2.72Å; D2459-R2467 PolarHBondContact OD2-NH1 3.26Å; D2459-R2467 IonicContact OD2-NH2 3.81Å; D2459-R2467 PolarHBondContact OD2-NH2 3.4Å; D2459-V2537 HydrophobicContact CB-CG1 4.06Å; D2459-L2538 PolarHBondContact N-O 2.87Å; D2459-L2539 HydrophobicContact CB-CD2 3.93Å; D2459-L2539 WeakPolarHBondContact O-CA 3.41Å; D2459-L2539 WeakPolarHBondContact OD2-CD2 3.42Å; D2459-S2582 WeakPolarHBondContact OD1-CB 3.15Å; D2459-S2582 PolarHBondContact OD1-OG 2.84Å; D2459-L2584 HydrophobicContact CB-CD1 4.21Å
2460	L	93.4	Very high	81.3	Confident	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	119.6	-173.6	-55.2	173.4	0	0	0	111.6	D2540 L2543 S2582 L2583 V2585 L2643 Y2646 F2647	L2460-D2540 WeakPolarHBondContact CA-OD2 3.38Å; L2460-L2543 HydrophobicContact CD1-CD2 3.67Å; L2460-L2543 HydrophobicContact CD2-CB 4.17Å; L2460-L2543 HydrophobicContact CD2-CD2 3.62Å; L2460-L2543 HydrophobicContact CG-CD2 4.3Å; L2460-S2582 WeakPolarHBondContact O-CA 3.2Å; L2460-L2583 HydrophobicContact CB-CB 4.46Å; L2460-L2583 WeakPolarHBondContact CB-O 3.13Å; L2460-L2583 PolarHBondContact N-O 2.73Å; L2460-L2583 PolarHBondContact O-N 3.12Å; L2460-V2585 HydrophobicContact CD1-CG2 3.83Å; L2460-L2643 HydrophobicContact CB-CD2 3.88Å; L2460-L2643 HydrophobicContact CD1-CD2 4.14Å; L2460-Y2646 HydrophobicContact CB-CE2 4.31Å; L2460-Y2646 HydrophobicContact CD1-CD2 4.06Å; L2460-Y2646 HydrophobicContact CD2-CD2 4.18Å; L2460-Y2646 HydrophobicContact CD2-CE2 3.95Å; L2460-Y2646 HydrophobicContact CG-CE2 4.49Å; L2460-F2647 HydrophobicContact CD1-CE2 4.13Å; L2460-F2647 HydrophobicContact CD1-CZ 3.69Å
2461	K	90.2	Very high	80.9	Confident	28 Å²	28	57.3 Å²	57.3	12%	0.122	28%	0.28	C	S	.	.			trans	-113.7	8.8	178.8	-77.3	-168.2	170	-162	0	113.8	S2463 R2467 D2540 D2580 S2582 R2638	K2461-S2463 VanDerWaalsContact C-N 3.34Å; K2461-S2463 PolarHBondContact O-N 3.09Å; K2461-R2467 VanDerWaalsContact N-NH2 3.12Å; K2461-D2540 PolarHBondContact N-OD1 3.25Å; K2461-D2540 PolarHBondContact N-OD2 3.45Å; K2461-D2580 WeakPolarHBondContact CE-O 3.46Å; K2461-D2580 PolarHBondContact NZ-O 3.33Å; K2461-D2580 IonicContact NZ-OD1 2.62Å; K2461-D2580 PolarHBondContact NZ-OD1 3.29Å; K2461-S2582 WeakPolarHBondContact CE-OG 3.32Å; K2461-S2582 WeakPolarHBondContact CG-OG 3.39Å; K2461-R2638 PolarHBondContact O-NH2 3.36Å
2462	G	86.9	Confident	79.8	Confident	1 Å²	1	59 Å²	59	1%	0.01	30%	0.301	C	S	.	.	S	Bend	trans	60	45.1	-175.4	0	0	0	0	0	111.4	D2540 R2638	G2462-D2540 WeakPolarHBondContact CA-OD1 3.3Å; G2462-D2540 PolarHBondContact N-OD1 3.47Å; G2462-R2638 WeakPolarHBondContact O-CD 3.22Å; G2462-R2638 PolarHBondContact O-NE 2.83Å
2463	S	84	Confident	79.1	Confident	10 Å²	10	57.5 Å²	57.5	7%	0.07	30%	0.295	C	S	.	.			trans	-158	127.8	-174	-176.6	0	0	0	0	110.8	K2461 R2467 D2540	K2461-S2463 VanDerWaalsContact C-N 3.34Å; K2461-S2463 PolarHBondContact O-N 3.09Å; S2463-R2467 WeakPolarHBondContact O-CB 3.42Å; S2463-R2467 VanDerWaalsContact O-CG 3.29Å; S2463-R2467 WeakPolarHBondContact O-CG 3.05Å; S2463-D2540 PolarHBondContact N-OD1 3.07Å; S2463-D2540 WeakPolarHBondContact O-CB 3.34Å
2464	L	78.9	Confident	77.8	Confident	57 Å²	57	56.3 Å²	56.3	30%	0.298	29%	0.292	S	S	.	.			trans	-88	-15.1	-178.3	-51.7	-175	0	0	0	113.6	K2466 R2467 D2540 L2544	L2464-K2466 PolarHBondContact O-N 2.79Å; L2464-R2467 PolarHBondContact O-N 3.36Å; L2464-D2540 HydrophobicContact CD2-CB 4.11Å; L2464-L2544 HydrophobicContact CD1-CD1 3.59Å; L2464-L2544 HydrophobicContact CD2-CD1 3.46Å; L2464-L2544 VanDerWaalsContact CD2-CD1 3.46Å; L2464-L2544 HydrophobicContact CD2-CG 4.16Å; L2464-L2544 HydrophobicContact CG-CD1 4.17Å
2465	R	69.7	Low	75.6	Confident	66 Å²	66	62.6 Å²	62.6	25%	0.249	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.5	114.4	-168.9	-175.3	-178.5	-176.9	153.1	-2.8	112.1	R2467 T2620 P2625	R2465-R2467 VanDerWaalsContact C-N 3.26Å; R2465-R2467 PolarHBondContact O-N 3.46Å; R2465-T2620 VanDerWaalsContact CZ-OG1 3.23Å; R2465-T2620 PolarHBondContact NH1-OG1 3.07Å; R2465-T2620 PolarHBondContact NH2-OG1 3.36Å; R2465-P2625 HydrophobicContact CB-CB 4.26Å; R2465-P2625 HydrophobicContact CB-CG 4.23Å; R2465-P2625 HydrophobicContact CG-CG 4.07Å; R2465-P2625 PolarHBondContact NH1-O 3.37Å
2466	K	68	Low	73	Confident	184 Å²	184	63.8 Å²	63.8	80%	0.8	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.1	43.4	-174.4	-62.9	-166.4	173.9	-166	0	111.9	L2464	L2464-K2466 PolarHBondContact O-N 2.79Å
2467	R	80.2	Confident	70.1	Confident	21 Å²	21	67 Å²	67	8%	0.079	36%	0.363	C	S	.	.			trans	-127	42.5	-179.9	-67.7	-78.2	-75.5	-168.9	-3.9	111.4	D2459 K2461 S2463 L2464 R2465 L2539 D2540 Q2541	D2459-R2467 PolarHBondContact O-NH2 3.14Å; D2459-R2467 IonicContact OD1-CZ 3.88Å; D2459-R2467 IonicContact OD1-NH1 3.65Å; D2459-R2467 PolarHBondContact OD1-NH1 3.46Å; D2459-R2467 IonicContact OD1-NH2 2.73Å; D2459-R2467 PolarHBondContact OD1-NH2 3.28Å; D2459-R2467 IonicContact OD2-CZ 3.22Å; D2459-R2467 IonicContact OD2-NH1 2.72Å; D2459-R2467 PolarHBondContact OD2-NH1 3.26Å; D2459-R2467 IonicContact OD2-NH2 3.81Å; D2459-R2467 PolarHBondContact OD2-NH2 3.4Å; K2461-R2467 VanDerWaalsContact N-NH2 3.12Å; S2463-R2467 WeakPolarHBondContact O-CB 3.42Å; S2463-R2467 VanDerWaalsContact O-CG 3.29Å; S2463-R2467 WeakPolarHBondContact O-CG 3.05Å; L2464-R2467 PolarHBondContact O-N 3.36Å; R2465-R2467 VanDerWaalsContact C-N 3.26Å; R2465-R2467 PolarHBondContact O-N 3.46Å; R2467-L2539 HydrophobicContact CB-CB 4.15Å; R2467-L2539 WeakPolarHBondContact O-CB 3.49Å; R2467-D2540 HydrophobicContact CB-CB 3.96Å; R2467-D2540 IonicContact CZ-OD2 2.82Å; R2467-D2540 IonicContact NE-OD2 2.58Å; R2467-D2540 PolarHBondContact NE-OD2 3.46Å; R2467-D2540 IonicContact NH2-OD2 3.91Å; R2467-D2540 PolarHBondContact NH2-OD2 2.81Å; R2467-Q2541 WeakPolarHBondContact O-CA 3.43Å; R2467-Q2541 WeakPolarHBondContact O-CB 3.43Å; R2467-Q2541 PolarHBondContact O-N 3.45Å
2468	L	80.1	Confident	66.9	Low	83 Å²	83	74.8 Å²	74.8	44%	0.435	41%	0.405	S	S	.	.			trans	-118	138.2	168	-179.2	67.3	0	0	0	107.6	Q2541 N2542	L2468-Q2541 HydrophobicContact CB-CB 4.03Å; L2468-Q2541 HydrophobicContact CB-CG 4.22Å; L2468-Q2541 HydrophobicContact CD1-CB 4.21Å; L2468-Q2541 HydrophobicContact CD1-CG 4.05Å; L2468-N2542 WeakPolarHBondContact CA-OD1 3.48Å
2469	V	80.2	Confident	63.7	Low	36 Å²	36	78.7 Å²	78.7	22%	0.218	44%	0.439	C	S	.	.			trans	-109.7	128.6	168.2	-178.3	0	0	0	0	107.8	E2471 L2538 L2539 N2542	V2469-E2471 PolarHBondContact O-N 2.66Å; V2469-L2538 HydrophobicContact CB-CD2 4.5Å; V2469-L2539 HydrophobicContact CG2-CB 4.42Å; V2469-L2539 HydrophobicContact CG2-CD1 3.57Å; V2469-L2539 HydrophobicContact CG2-CG 3.67Å; V2469-N2542 PolarHBondContact N-OD1 2.84Å; V2469-N2542 PolarHBondContact O-ND2 2.74Å
2470	D	73.6	Confident	60.5	Low	106 Å²	106	84.7 Å²	84.7	57%	0.567	47%	0.471	S	S	*	.			trans	-79.8	101.4	177.6	-65.1	-40.7	0	0	0	109.8	S2472 S2473	D2470-S2472 PolarHBondContact O-N 3.47Å; D2470-S2472 VanDerWaalsContact O-N 3.13Å; D2470-S2473 WeakPolarHBondContact O-CB 3.45Å; D2470-S2473 PolarHBondContact O-N 3.24Å; D2470-S2473 PolarHBondContact O-OG 2.84Å
2471	E	67.1	Low	57	Low	110 Å²	110	90.7 Å²	90.7	51%	0.514	51%	0.513	S	S	.	.	G	3₁₀ helix	trans	-59.6	-25.6	-175.1	-70.5	164.8	-154.3	0	0	113.1	V2469 S2473 N2474 L2538 N2542	V2469-E2471 PolarHBondContact O-N 2.66Å; E2471-S2473 VanDerWaalsContact C-N 3.26Å; E2471-S2473 PolarHBondContact O-N 2.87Å; E2471-N2474 PolarHBondContact O-N 3.07Å; E2471-L2538 HydrophobicContact CG-CD2 4.14Å; E2471-N2542 PolarHBondContact OE1-ND2 3.24Å
2472	S	56	Low	53.7	Low	96 Å²	96	94.8 Å²	94.8	67%	0.671	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-58.4	-33.3	172	50.7	0	0	0	0	113.5	D2470 N2474 N2475	D2470-S2472 PolarHBondContact O-N 3.47Å; D2470-S2472 VanDerWaalsContact O-N 3.13Å; S2472-N2474 VanDerWaalsContact C-N 3.26Å; S2472-N2474 PolarHBondContact O-N 3.42Å; S2472-N2475 PolarHBondContact O-N 3.08Å
2473	S	52.4	Low	50.7	Low	80 Å²	80	100.3 Å²	100.3	56%	0.559	58%	0.575	S	S	*	*	G	3₁₀ helix	trans	-67	-25.1	-179.1	66.2	0	0	0	0	113.4	D2470 E2471	D2470-S2473 WeakPolarHBondContact O-CB 3.45Å; D2470-S2473 PolarHBondContact O-N 3.24Å; D2470-S2473 PolarHBondContact O-OG 2.84Å; E2471-S2473 VanDerWaalsContact C-N 3.26Å; E2471-S2473 PolarHBondContact O-N 2.87Å
2474	N	46.9	Very low	47.7	Very low	84 Å²	84	105 Å²	105	45%	0.449	60%	0.603	S	S	.	*	G	3₁₀ helix	trans	-78.1	-19.7	178.4	-75.6	-39.5	0	0	0	113.7	E2471 S2472	E2471-N2474 PolarHBondContact O-N 3.07Å; S2472-N2474 VanDerWaalsContact C-N 3.26Å; S2472-N2474 PolarHBondContact O-N 3.42Å
2475	N	35.6	Very low	44.9	Very low	153 Å²	153	109.8 Å²	109.8	82%	0.818	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-90.8	0.1	177.1	-71.5	-11.6	0	0	0	112.9	S2472	S2472-N2475 PolarHBondContact O-N 3.08Å
2476	G	29.6	Very low	42.7	Very low	60 Å²	60	110.8 Å²	110.8	62%	0.619	65%	0.651	S	S	*	*	S	Bend	trans	-96.9	2.8	-165.9	0	0	0	0	0	117.4
2477	M	25.4	Very low	40.5	Very low	180 Å²	180	109.4 Å²	109.4	89%	0.887	65%	0.651	S	S	*	*			trans	-135	92.6	-179.9	-77.7	-164.4	166.9	0	0	113.4
2478	N	23.6	Very low	37.7	Very low	179 Å²	179	116.6 Å²	116.6	96%	0.957	69%	0.688	S	S	*	*			trans	-148	57.9	156.7	-129.5	5.4	0	0	0	109.4
2479	A	25.2	Very low	35.8	Very low	93 Å²	93	118 Å²	118	77%	0.769	70%	0.702	S	S	*	*	S	Bend	trans	-146.9	102.6	179	0	0	0	0	0	110.6
2480	N	24	Very low	33	Very low	151 Å²	151	120.3 Å²	120.3	81%	0.807	73%	0.725	S	S	*	*			trans	39.4	107.1	162	-60.2	-1	0	0	0	119.6	T2482	N2480-T2482 PolarHBondContact O-N 3.22Å
2481	S	19.2	Very low	30.4	Very low	126 Å²	126	122.6 Å²	122.6	88%	0.881	74%	0.737	S	S	*	*			trans	-86.9	85.2	166.8	56.5	0	0	0	0	112.6
2482	T	22.1	Very low	28.3	Very low	115 Å²	115	125 Å²	125	71%	0.706	75%	0.752	S	S	*	*			trans	-156.4	139.4	170.5	21.7	0	0	0	0	108	N2480	N2480-T2482 PolarHBondContact O-N 3.22Å
2483	T	23.4	Very low	26.6	Very low	117 Å²	117	124.1 Å²	124.1	72%	0.718	75%	0.751	S	S	*	*			cis	-154	146.3	9.8	-22.5	0	0	0	0	110.9
2484	T	20.3	Very low	25.1	Very low	109 Å²	109	128.8 Å²	128.8	67%	0.669	76%	0.764	S	S	*	*			trans	37.7	123.1	149.9	50.7	0	0	0	0	123.4
2485	N	20.9	Very low	23.8	Very low	156 Å²	156	130.9 Å²	130.9	83%	0.834	78%	0.78	S	S	*	*			trans	79.5	154.3	132.5	-61.3	-11.3	0	0	0	122.7
2486	A	23.1	Very low	23.1	Very low	87 Å²	87	130.4 Å²	130.4	72%	0.719	78%	0.783	S	S	*	*			trans	87.4	89.3	156.7	0	0	0	0	0	121.7
2487	I	20.6	Very low	22.6	Very low	155 Å²	155	135 Å²	135	80%	0.795	79%	0.793	S	S	*	*				67.6	115.6	108.3	-70.1	169.5	0	0	0	120.4
2488	M	22.4	Very low	22.4	Very low	172 Å²	172	134.5 Å²	134.5	85%	0.847	79%	0.789	S	S	*	*			trans	85.3	158.8	146.9	-66	-64.2	172.1	0	0	121.1
2489	P	40.2	Very low	22.3	Very low	112 Å²	112	132.4 Å²	132.4	73%	0.727	78%	0.782	S	S	*	*			trans	-134.3	-173.1	-144.7	46.1	-30.1	0	0	0	117.2
2490	A	20.5	Very low	22.2	Very low	85 Å²	85	134.2 Å²	134.2	70%	0.702	78%	0.784	S	S	*	*			trans	96	136.2	151.6	0	0	0	0	0	120.8
2491	D	20.4	Very low	22	Very low	154 Å²	154	133.5 Å²	133.5	82%	0.824	79%	0.786	S	S	*	*			trans	54.3	90.4	146.6	-57.1	-15.7	0	0	0	123
2492	L	22.4	Very low	22.1	Very low	161 Å²	161	135.2 Å²	135.2	84%	0.843	79%	0.785	S	S	*	*				-160.9	129.9	125.9	-132.2	63.3	0	0	0	107.7
2493	A	20.1	Very low	22	Very low	78 Å²	78	135.5 Å²	135.5	65%	0.645	79%	0.792	S	S	*	*			cis	82.7	137.1	31.5	0	0	0	0	0	114.6
2494	Q	21.7	Very low	22	Very low	177 Å²	177	133.4 Å²	133.4	83%	0.827	79%	0.793	S	S	*	*			trans	71.3	130.7	-170.4	-53.2	174.9	2.7	0	0	113.7
2495	T	18.2	Very low	22	Very low	128 Å²	128	135.5 Å²	135.5	79%	0.785	81%	0.805	S	S	*	*			cis	80.5	90.7	25	78.4	0	0	0	0	116.3
2496	T	22.7	Very low	22	Very low	143 Å²	143	132.4 Å²	132.4	88%	0.877	80%	0.802	S	S	*	*			trans	-142.4	159.6	151	36.3	0	0	0	0	109.8
2497	D	19.2	Very low	21.9	Very low	157 Å²	157	133.8 Å²	133.8	84%	0.84	81%	0.806	S	S	*	*			trans	-99	-157.2	-167.3	-66.2	-89.9	0	0	0	113.5
2498	E	21.2	Very low	22	Very low	170 Å²	170	137.5 Å²	137.5	79%	0.794	81%	0.812	S	S	*	*			trans	82.6	88.3	159.6	-56	-163.1	164.6	0	0	119.4	T2500	E2498-T2500 PolarHBondContact O-N 3.15Å
2499	T	20.1	Very low	21.8	Very low	134 Å²	134	138 Å²	138	82%	0.822	81%	0.812	S	S	*	*				11.1	108.4	122	50.3	0	0	0	0	117.9
2500	T	23	Very low	20.9	Very low	131 Å²	131	137.8 Å²	137.8	80%	0.804	81%	0.813	S	S	*	*			trans	-121	120.3	146.2	39.9	0	0	0	0	110	E2498	E2498-T2500 PolarHBondContact O-N 3.15Å
2501	T	20.2	Very low	20.8	Very low	137 Å²	137	144.1 Å²	144.1	84%	0.84	83%	0.825	S	S	*	*			trans	-79.2	118.7	173.1	48.9	0	0	0	0	109.9
2502	N	22.1	Very low	20.8	Very low	161 Å²	161	143 Å²	143	86%	0.861	82%	0.824	S	S	*	*			trans	-126	107.8	165.6	-107.2	-32.6	0	0	0	110.9	G2504	N2502-G2504 PolarHBondContact O-N 3.09Å
2503	S	20.2	Very low	20.6	Very low	122 Å²	122	141.1 Å²	141.1	85%	0.853	82%	0.823	S	S	*	*			trans	-86.7	81.5	-179.6	44	0	0	0	0	110.7	V2505	S2503-V2505 PolarHBondContact O-N 3.25Å
2504	G	22.2	Very low	20.6	Very low	73 Å²	73	144.7 Å²	144.7	75%	0.753	83%	0.831	S	S	*	*			trans	-90.3	88.8	177.5	0	0	0	0	0	113.3	N2502	N2502-G2504 PolarHBondContact O-N 3.09Å
2505	V	19.5	Very low	20.5	Very low	152 Å²	152	145.3 Å²	145.3	92%	0.921	83%	0.834	S	S	*	*			trans	-90.3	101.5	166.2	178.6	0	0	0	0	108.8	S2503	S2503-V2505 PolarHBondContact O-N 3.25Å
2506	A	22.1	Very low	20.7	Very low	92 Å²	92	145 Å²	145	76%	0.76	84%	0.837	S	S	*	*			trans	-139.5	141.2	176	0	0	0	0	0	111.9
2507	S	21.3	Very low	20.5	Very low	116 Å²	116	144.2 Å²	144.2	81%	0.811	83%	0.832	S	S	*	*			trans	-70	138.7	-170.6	-50.8	0	0	0	0	114.3	H2509	S2507-H2509 PolarHBondContact O-N 2.59Å
2508	Y	21.4	Very low	20.5	Very low	233 Å²	233	142.8 Å²	142.8	91%	0.914	83%	0.83	S	S	*	*			trans	-88.8	95.1	155.8	-92	-84.8	0	0	0	110
2509	H	19.8	Very low	20.5	Very low	182 Å²	182	140.8 Å²	140.8	84%	0.843	83%	0.829	S	S	*	*			trans	-155.3	71.3	171	-139	-62.4	0	0	0	112.3	S2507	S2507-H2509 PolarHBondContact O-N 2.59Å
2510	S	20.3	Very low	20.5	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	83%	0.828	S	S	*	*			trans	-151.9	98.4	171.9	43.3	0	0	0	0	112.6
2511	F	19.2	Very low	20.3	Very low	218 Å²	218	140.9 Å²	140.9	96%	0.956	83%	0.828	S	S	*	*			trans	-76.7	119.2	147.6	-97.8	-100	0	0	0	107.7
2512	T	20.9	Very low	20.4	Very low	131 Å²	131	140.4 Å²	140.4	80%	0.804	83%	0.831	S	S	*	*			trans	-159.8	136.2	146.9	13.7	0	0	0	0	110.4
2513	C	17.8	Very low	20.4	Very low	122 Å²	122	136.4 Å²	136.4	82%	0.824	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-75.5	132.8	168.4	-172.6	0	0	0	0	109.2
2514	N	20	Very low	20.5	Very low	153 Å²	153	138.7 Å²	138.7	82%	0.818	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-96	157	162.4	-97.7	-1.9	0	0	0	110.5
2515	Q	19.3	Very low	20.5	Very low	189 Å²	189	141.9 Å²	141.9	88%	0.883	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-96.1	144.9	-179.2	-60.9	162.5	-72.2	0	0	110.6
2516	S	22.2	Very low	20.7	Very low	123 Å²	123	139.9 Å²	139.9	86%	0.86	83%	0.827	S	S	*	*			trans	-147.3	102.1	159.6	58.9	0	0	0	0	110
2517	T	17.9	Very low	20.8	Very low	125 Å²	125	143.5 Å²	143.5	77%	0.767	83%	0.828	S	S	*	*			trans	-90.5	134.5	169.6	46.2	0	0	0	0	110.2
2518	T	20.9	Very low	20.9	Very low	128 Å²	128	144.4 Å²	144.4	79%	0.785	83%	0.829	S	S	*	*			trans	160.9	120.9	131.6	44.8	0	0	0	0	112.4
2519	V	20.1	Very low	21.1	Very low	128 Å²	128	139 Å²	139	78%	0.776	82%	0.82	S	S	*	*			trans	29.3	117.7	132.7	-169.6	0	0	0	0	117
2520	S	19.5	Very low	21.4	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	82%	0.818	S	S	*	*				-164.4	168	79.2	21	0	0	0	0	113.8
2521	D	20	Very low	21.8	Very low	152 Å²	152	137 Å²	137	81%	0.813	82%	0.816	S	S	*	*			trans	-77.6	142.8	-162.1	-55.9	-91.5	0	0	0	117.4
2522	S	22.4	Very low	22.8	Very low	128 Å²	128	132.7 Å²	132.7	90%	0.895	80%	0.797	S	S	*	*				-167.4	102.3	128.9	20.6	0	0	0	0	109.2
2523	G	20.6	Very low	24	Very low	76 Å²	76	134.9 Å²	134.9	78%	0.784	80%	0.798	S	S	*	*			trans	-90.1	127.9	-172.3	0	0	0	0	0	114.2
2524	L	22.2	Very low	26.1	Very low	171 Å²	171	134.6 Å²	134.6	90%	0.895	79%	0.788	S	S	*	*			trans	-143.4	139.1	141.9	-143.8	72.7	0	0	0	108.9	S2526	L2524-S2526 PolarHBondContact O-N 3.47Å
2525	T	23.1	Very low	28.7	Very low	140 Å²	140	129.4 Å²	129.4	86%	0.859	76%	0.762	S	S	*	*			trans	-81.3	120.2	-160.2	47.6	0	0	0	0	113.4	E2527	T2525-E2527 PolarHBondContact O-N 2.93Å
2526	S	22.8	Very low	31.5	Very low	110 Å²	110	122.7 Å²	122.7	77%	0.769	73%	0.734	S	S	*	*			trans	-73.8	115	171	-43.6	0	0	0	0	111.7	L2524	L2524-S2526 PolarHBondContact O-N 3.47Å
2527	E	24.6	Very low	34.5	Very low	167 Å²	167	118.6 Å²	118.6	78%	0.78	70%	0.704	S	S	*	*			trans	-63.8	135.3	157.5	-72.9	-156.3	130.7	0	0	109.3	T2525 T2529	T2525-E2527 PolarHBondContact O-N 2.93Å; E2527-T2529 VanDerWaalsContact C-N 3.32Å; E2527-T2529 PolarHBondContact O-N 3.19Å
2528	T	23.2	Very low	38	Very low	136 Å²	136	112.8 Å²	112.8	83%	0.834	67%	0.669	S	S	*	*			trans	-81.6	75.1	-167.1	-33.5	0	0	0	0	111.6	T2530	T2528-T2530 PolarHBondContact O-N 3.33Å
2529	T	26.6	Very low	41.3	Very low	120 Å²	120	107.7 Å²	107.7	74%	0.736	64%	0.636	S	S	*	*			trans	-56.5	114.8	168.3	50.4	0	0	0	0	109.4	E2527 V2531	E2527-T2529 VanDerWaalsContact C-N 3.32Å; E2527-T2529 PolarHBondContact O-N 3.19Å; T2529-V2531 PolarHBondContact O-N 2.81Å
2530	T	26.5	Very low	44.6	Very low	128 Å²	128	101.6 Å²	101.6	79%	0.785	60%	0.599	S	S	*	*			trans	-66.3	100.2	174.5	52.7	0	0	0	0	108.8	T2528 K2532	T2528-T2530 PolarHBondContact O-N 3.33Å; T2530-K2532 PolarHBondContact O-N 2.87Å
2531	V	28.9	Very low	47.7	Very low	118 Å²	118	97.7 Å²	97.7	72%	0.715	57%	0.569	S	S	*	*			trans	-62	100.1	176.5	-179.5	0	0	0	0	108.1	T2529 H2533	T2529-V2531 PolarHBondContact O-N 2.81Å; V2531-H2533 PolarHBondContact O-N 3.13Å
2532	K	38.9	Very low	51	Low	128 Å²	128	90.8 Å²	90.8	56%	0.557	53%	0.531	S	S	*	.			trans	-56.8	115.2	168.8	-73.1	-172.1	-179.4	-174.9	0	106.8	E2379 T2530 N2534	E2379-K2532 VanDerWaalsContact CD-NZ 3.33Å; E2379-K2532 IonicContact OE1-NZ 3.29Å; E2379-K2532 PolarHBondContact OE1-NZ 2.97Å; E2379-K2532 IonicContact OE2-NZ 3.39Å; E2379-K2532 PolarHBondContact OE2-NZ 3.4Å; T2530-K2532 PolarHBondContact O-N 2.87Å; K2532-N2534 PolarHBondContact O-N 3.42Å; K2532-N2534 VanDerWaalsContact O-N 3.09Å
2533	H	45.9	Very low	54.2	Low	177 Å²	177	84.9 Å²	84.9	82%	0.819	49%	0.49	S	S	*	.			trans	-59	117.2	173.8	-71.6	-82.1	0	0	0	109	V2531 V2535	V2531-H2533 PolarHBondContact O-N 3.13Å; H2533-V2535 PolarHBondContact O-N 2.81Å; H2533-V2535 VanDerWaalsContact O-N 3.07Å
2534	N	63.4	Low	57.3	Low	115 Å²	115	82 Å²	82	62%	0.615	46%	0.456	S	S	*	.			trans	-67.3	107.7	174.1	-85.9	-29.1	0	0	0	108.9	K2532	K2532-N2534 PolarHBondContact O-N 3.42Å; K2532-N2534 VanDerWaalsContact O-N 3.09Å
2535	V	74.6	Confident	60.2	Low	45 Å²	45	76.8 Å²	76.8	27%	0.273	43%	0.43	S	S	.	.			trans	-60.4	124.1	176.4	-178.4	0	0	0	0	108.9	L2454 I2457 H2533	L2454-V2535 HydrophobicContact CB-CG2 4.48Å; L2454-V2535 VanDerWaalsContact O-CG2 3.28Å; L2454-V2535 WeakPolarHBondContact O-CG2 3.43Å; I2457-V2535 HydrophobicContact CB-CG1 4.47Å; I2457-V2535 HydrophobicContact CD1-CB 4.16Å; I2457-V2535 HydrophobicContact CD1-CG1 4.14Å; I2457-V2535 HydrophobicContact CG1-CG1 3.97Å; H2533-V2535 PolarHBondContact O-N 2.81Å; H2533-V2535 VanDerWaalsContact O-N 3.07Å
2536	P	78	Confident	63.1	Low	47 Å²	47	71.9 Å²	71.9	31%	0.305	40%	0.403	S	S	.	.			trans	-69	141.9	-175.4	27.6	-34.8	0	0	0	111.6	L2538	P2536-L2538 HydrophobicContact CB-CD2 4.28Å; P2536-L2538 HydrophobicContact CG-CD2 4.39Å; P2536-L2538 PolarHBondContact O-N 2.85Å
2537	V	85.3	Confident	65.9	Low	37 Å²	37	68.1 Å²	68.1	22%	0.224	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	101.6	170.2	-177.1	0	0	0	0	108.7	I2457 D2459	I2457-V2537 HydrophobicContact CG2-CG1 4.34Å; I2457-V2537 HydrophobicContact CG2-CG2 4.09Å; D2459-V2537 HydrophobicContact CB-CG1 4.06Å
2538	L	90	Very high	68.3	Low	4 Å²	4	61.2 Å²	61.2	2%	0.021	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	166.6	177.1	-59.2	-177.9	0	0	0	110.9	Y2456 I2457 Y2458 D2459 V2469 E2471 P2536 N2542	Y2456-L2538 HydrophobicContact CD1-CD1 3.9Å; I2457-L2538 WeakPolarHBondContact O-CB 3.39Å; I2457-L2538 PolarHBondContact O-N 3.28Å; Y2458-L2538 CarbonylContact C-O 3.56Å; Y2458-L2538 WeakPolarHBondContact CA-O 3.45Å; Y2458-L2538 HydrophobicContact CD1-CB 3.57Å; Y2458-L2538 HydrophobicContact CE1-CB 3.64Å; Y2458-L2538 HydrophobicContact CE1-CD1 3.79Å; Y2458-L2538 HydrophobicContact CE1-CG 4.36Å; Y2458-L2538 HydrophobicContact CG-CB 4.45Å; D2459-L2538 PolarHBondContact N-O 2.87Å; V2469-L2538 HydrophobicContact CB-CD2 4.5Å; E2471-L2538 HydrophobicContact CG-CD2 4.14Å; P2536-L2538 HydrophobicContact CB-CD2 4.28Å; P2536-L2538 HydrophobicContact CG-CD2 4.39Å; P2536-L2538 PolarHBondContact O-N 2.85Å; L2538-N2542 HydrophobicContact CB-CB 3.85Å; L2538-N2542 HydrophobicContact CD1-CB 4.38Å; L2538-N2542 HydrophobicContact CD2-CB 4.46Å; L2538-N2542 HydrophobicContact CG-CB 4.46Å
2539	L	90.2	Very high	70.7	Confident	20 Å²	20	59.6 Å²	59.6	11%	0.105	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	173.3	-171	-60.6	177.2	0	0	0	112.5	D2459 R2467 V2469 Q2541 N2542 L2543	D2459-L2539 HydrophobicContact CB-CD2 3.93Å; D2459-L2539 WeakPolarHBondContact O-CA 3.41Å; D2459-L2539 WeakPolarHBondContact OD2-CD2 3.42Å; R2467-L2539 HydrophobicContact CB-CB 4.15Å; R2467-L2539 WeakPolarHBondContact O-CB 3.49Å; V2469-L2539 HydrophobicContact CG2-CB 4.42Å; V2469-L2539 HydrophobicContact CG2-CD1 3.57Å; V2469-L2539 HydrophobicContact CG2-CG 3.67Å; L2539-Q2541 VanDerWaalsContact C-N 3.25Å; L2539-Q2541 PolarHBondContact O-N 3.38Å; L2539-N2542 PolarHBondContact N-OD1 2.93Å; L2539-N2542 WeakPolarHBondContact O-CA 3.09Å; L2539-N2542 WeakPolarHBondContact O-CB 3.25Å; L2539-N2542 PolarHBondContact O-N 3.11Å; L2539-L2543 PolarHBondContact O-N 2.9Å
2540	D	89.4	Confident	73.4	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-39.2	-45.2	-179.5	-70.5	-109.9	0	0	0	115.1	L2460 K2461 G2462 S2463 L2464 R2467 L2543 L2544 Y2646	L2460-D2540 WeakPolarHBondContact CA-OD2 3.38Å; K2461-D2540 PolarHBondContact N-OD1 3.25Å; K2461-D2540 PolarHBondContact N-OD2 3.45Å; G2462-D2540 WeakPolarHBondContact CA-OD1 3.3Å; G2462-D2540 PolarHBondContact N-OD1 3.47Å; S2463-D2540 PolarHBondContact N-OD1 3.07Å; S2463-D2540 WeakPolarHBondContact O-CB 3.34Å; L2464-D2540 HydrophobicContact CD2-CB 4.11Å; R2467-D2540 HydrophobicContact CB-CB 3.96Å; R2467-D2540 IonicContact CZ-OD2 2.82Å; R2467-D2540 IonicContact NE-OD2 2.58Å; R2467-D2540 PolarHBondContact NE-OD2 3.46Å; R2467-D2540 IonicContact NH2-OD2 3.91Å; R2467-D2540 PolarHBondContact NH2-OD2 2.81Å; D2540-L2543 PolarHBondContact O-N 3.32Å; D2540-L2544 PolarHBondContact O-N 3.11Å; D2540-L2544 VanDerWaalsContact O-N 3.07Å; D2540-Y2646 VanDerWaalsContact CB-OH 3.3Å; D2540-Y2646 WeakPolarHBondContact CB-OH 3.4Å; D2540-Y2646 WeakPolarHBondContact OD1-CE2 3.45Å; D2540-Y2646 PolarHBondContact OD1-OH 3.39Å
2541	Q	85.3	Confident	76.3	Confident	33 Å²	33	54.4 Å²	54.4	15%	0.154	30%	0.295	C	S	.	.	H	α-helix	trans	-77.4	-32.9	-179.1	-169.7	62.9	55.8	0	0	112.8	R2467 L2468 L2539 L2543 L2544 N2545	R2467-Q2541 WeakPolarHBondContact O-CA 3.43Å; R2467-Q2541 WeakPolarHBondContact O-CB 3.43Å; R2467-Q2541 PolarHBondContact O-N 3.45Å; L2468-Q2541 HydrophobicContact CB-CB 4.03Å; L2468-Q2541 HydrophobicContact CB-CG 4.22Å; L2468-Q2541 HydrophobicContact CD1-CB 4.21Å; L2468-Q2541 HydrophobicContact CD1-CG 4.05Å; L2539-Q2541 VanDerWaalsContact C-N 3.25Å; L2539-Q2541 PolarHBondContact O-N 3.38Å; Q2541-L2543 VanDerWaalsContact C-N 3.3Å; Q2541-L2544 PolarHBondContact O-N 3.46Å; Q2541-N2545 PolarHBondContact NE2-OD1 3.27Å; Q2541-N2545 WeakPolarHBondContact O-CB 3.26Å; Q2541-N2545 PolarHBondContact O-N 2.95Å; Q2541-N2545 PolarHBondContact O-ND2 3.35Å; Q2541-N2545 PolarHBondContact O-OD1 3.3Å
2542	N	88.7	Confident	79.3	Confident	6 Å²	6	49.2 Å²	49.2	3%	0.032	26%	0.263	C	S	.	.	H	α-helix	trans	-62.1	-42.1	170.7	-64.2	82.6	0	0	0	109.9	Y2458 L2468 V2469 E2471 L2538 L2539 N2545 A2546	Y2458-N2542 HydrophobicContact CE1-CB 4.35Å; L2468-N2542 WeakPolarHBondContact CA-OD1 3.48Å; V2469-N2542 PolarHBondContact N-OD1 2.84Å; V2469-N2542 PolarHBondContact O-ND2 2.74Å; E2471-N2542 PolarHBondContact OE1-ND2 3.24Å; L2538-N2542 HydrophobicContact CB-CB 3.85Å; L2538-N2542 HydrophobicContact CD1-CB 4.38Å; L2538-N2542 HydrophobicContact CD2-CB 4.46Å; L2538-N2542 HydrophobicContact CG-CB 4.46Å; L2539-N2542 PolarHBondContact N-OD1 2.93Å; L2539-N2542 WeakPolarHBondContact O-CA 3.09Å; L2539-N2542 WeakPolarHBondContact O-CB 3.25Å; L2539-N2542 PolarHBondContact O-N 3.11Å; N2542-N2545 PolarHBondContact O-N 2.9Å; N2542-A2546 WeakPolarHBondContact O-CB 3.27Å; N2542-A2546 PolarHBondContact O-N 3.19Å
2543	L	90.4	Very high	81.8	Confident	4 Å²	4	43.8 Å²	43.8	2%	0.021	24%	0.239	C	C	.	.	H	α-helix	trans	-63.2	-45.5	176.3	-177.8	57.1	0	0	0	111.7	Y2458 L2460 L2539 D2540 Q2541 N2545 A2546 S2547 L2552 Y2646 F2647	Y2458-L2543 HydrophobicContact CD1-CB 3.72Å; Y2458-L2543 HydrophobicContact CD1-CD1 4.38Å; Y2458-L2543 HydrophobicContact CD1-CG 4.49Å; Y2458-L2543 HydrophobicContact CD2-CD1 4.38Å; Y2458-L2543 HydrophobicContact CE1-CB 3.77Å; Y2458-L2543 HydrophobicContact CE1-CD1 4.1Å; Y2458-L2543 HydrophobicContact CE2-CD1 4.09Å; Y2458-L2543 HydrophobicContact CG-CB 4.4Å; L2460-L2543 HydrophobicContact CD1-CD2 3.67Å; L2460-L2543 HydrophobicContact CD2-CB 4.17Å; L2460-L2543 HydrophobicContact CD2-CD2 3.62Å; L2460-L2543 HydrophobicContact CG-CD2 4.3Å; L2539-L2543 PolarHBondContact O-N 2.9Å; D2540-L2543 PolarHBondContact O-N 3.32Å; Q2541-L2543 VanDerWaalsContact C-N 3.3Å; L2543-N2545 VanDerWaalsContact C-N 3.34Å; L2543-N2545 PolarHBondContact O-N 2.77Å; L2543-A2546 PolarHBondContact O-N 2.93Å; L2543-S2547 VanDerWaalsContact O-CB 3.27Å; L2543-S2547 WeakPolarHBondContact O-CB 3.34Å; L2543-S2547 PolarHBondContact O-N 3.14Å; L2543-L2552 HydrophobicContact CD1-CD1 3.71Å; L2543-L2552 HydrophobicContact CD1-CG 4.19Å; L2543-Y2646 HydrophobicContact CD2-CD2 4.07Å; L2543-Y2646 HydrophobicContact CD2-CG 4.02Å; L2543-F2647 HydrophobicContact CD2-CZ 4.44Å
2544	L	84.9	Confident	84	Confident	15 Å²	15	35.3 Å²	35.3	8%	0.079	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-42.8	174.7	-79.9	-168.3	0	0	0	112.6	P1315 L2464 D2540 Q2541 S2547 Y2646	P1315-L2544 HydrophobicContact CB-CB 4.33Å; P1315-L2544 HydrophobicContact CG-CB 3.98Å; P1315-L2544 HydrophobicContact CG-CD1 3.96Å; L2464-L2544 HydrophobicContact CD1-CD1 3.59Å; L2464-L2544 HydrophobicContact CD2-CD1 3.46Å; L2464-L2544 VanDerWaalsContact CD2-CD1 3.46Å; L2464-L2544 HydrophobicContact CD2-CG 4.16Å; L2464-L2544 HydrophobicContact CG-CD1 4.17Å; D2540-L2544 PolarHBondContact O-N 3.11Å; D2540-L2544 VanDerWaalsContact O-N 3.07Å; Q2541-L2544 PolarHBondContact O-N 3.46Å; L2544-S2547 PolarHBondContact O-N 2.88Å; L2544-S2547 PolarHBondContact O-OG 3.34Å; L2544-Y2646 HydrophobicContact CD1-CE1 4.37Å; L2544-Y2646 HydrophobicContact CD2-CD1 3.7Å; L2544-Y2646 HydrophobicContact CD2-CE1 3.64Å; L2544-Y2646 HydrophobicContact CG-CD1 4.28Å; L2544-Y2646 HydrophobicContact CG-CE1 3.76Å
2545	N	84	Confident	85.1	Confident	63 Å²	63	31.5 Å²	31.5	34%	0.337	18%	0.177	S	C	.	.	H	α-helix	trans	-62.9	-47.8	178.5	-68.5	-6.6	0	0	0	111.2	Q2541 N2542 L2543 S2547 I2548	Q2541-N2545 PolarHBondContact NE2-OD1 3.27Å; Q2541-N2545 WeakPolarHBondContact O-CB 3.26Å; Q2541-N2545 PolarHBondContact O-N 2.95Å; Q2541-N2545 PolarHBondContact O-ND2 3.35Å; Q2541-N2545 PolarHBondContact O-OD1 3.3Å; N2542-N2545 PolarHBondContact O-N 2.9Å; L2543-N2545 VanDerWaalsContact C-N 3.34Å; L2543-N2545 PolarHBondContact O-N 2.77Å; N2545-S2547 VanDerWaalsContact C-N 3.29Å; N2545-S2547 PolarHBondContact O-N 3.33Å; N2545-I2548 WeakPolarHBondContact O-CG1 3.48Å; N2545-I2548 PolarHBondContact O-N 3.08Å
2546	A	83.5	Confident	85.4	Confident	36 Å²	36	29.5 Å²	29.5	30%	0.298	17%	0.165	S	C	.	.	H	α-helix	trans	-63.3	-33.6	176.8	0	0	0	0	0	112.6	N2542 L2543 I2548 D2549 N2550	N2542-A2546 WeakPolarHBondContact O-CB 3.27Å; N2542-A2546 PolarHBondContact O-N 3.19Å; L2543-A2546 PolarHBondContact O-N 2.93Å; A2546-I2548 PolarHBondContact O-N 3.17Å; A2546-I2548 VanDerWaalsContact O-N 3.12Å; A2546-D2549 PolarHBondContact O-N 3.2Å; A2546-D2549 VanDerWaalsContact O-N 3.16Å; A2546-N2550 PolarHBondContact O-N 2.99Å
2547	S	81.8	Confident	85.4	Confident	32 Å²	32	27.7 Å²	27.7	22%	0.224	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-9.7	-179.6	77.8	0	0	0	0	114.9	L2543 L2544 N2545 P2551	L2543-S2547 VanDerWaalsContact O-CB 3.27Å; L2543-S2547 WeakPolarHBondContact O-CB 3.34Å; L2543-S2547 PolarHBondContact O-N 3.14Å; L2544-S2547 PolarHBondContact O-N 2.88Å; L2544-S2547 PolarHBondContact O-OG 3.34Å; N2545-S2547 VanDerWaalsContact C-N 3.29Å; N2545-S2547 PolarHBondContact O-N 3.33Å; S2547-P2551 VanDerWaalsContact O-CG 3.27Å; S2547-P2551 WeakPolarHBondContact O-CG 3.4Å
2548	I	74.3	Confident	85.5	Confident	22 Å²	22	25.9 Å²	25.9	11%	0.113	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-42.4	172.6	-59.8	176	0	0	0	110.3	R1314 P1315 R1365 N2545 A2546	R1314-I2548 HydrophobicContact CG-CD1 4.13Å; R1314-I2548 VanDerWaalsContact CZ-CD1 3.47Å; P1315-I2548 HydrophobicContact CB-CD1 3.86Å; P1315-I2548 HydrophobicContact CB-CG1 4.24Å; R1365-I2548 PolarHBondContact NH1-O 3.47Å; N2545-I2548 WeakPolarHBondContact O-CG1 3.48Å; N2545-I2548 PolarHBondContact O-N 3.08Å; A2546-I2548 PolarHBondContact O-N 3.17Å; A2546-I2548 VanDerWaalsContact O-N 3.12Å
2549	D	75.3	Confident	85.5	Confident	102 Å²	102	26 Å²	26	55%	0.545	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	-45.7	-173.8	-61.4	-51.5	0	0	0	111.3	A2546	A2546-D2549 PolarHBondContact O-N 3.2Å; A2546-D2549 VanDerWaalsContact O-N 3.16Å
2550	N	82.2	Confident	85.1	Confident	119 Å²	119	27 Å²	27	64%	0.636	15%	0.148	S	C	*	.	S	Bend	trans	-128.6	80	179.9	-68.3	-46.9	0	0	0	112.3	A2546	A2546-N2550 PolarHBondContact O-N 2.99Å
2551	P	87.2	Confident	84.8	Confident	19 Å²	19	27 Å²	27	12%	0.123	15%	0.148	C	C	.	.			trans	-62.4	140.3	173.2	-13.4	23.2	0	0	0	112.9	S2547 Y2553 P2648	S2547-P2551 VanDerWaalsContact O-CG 3.27Å; S2547-P2551 WeakPolarHBondContact O-CG 3.4Å; P2551-Y2553 VanDerWaalsContact C-N 3.34Å; P2551-Y2553 HydrophobicContact CB-CD2 4.17Å; P2551-Y2553 HydrophobicContact CB-CE1 4.13Å; P2551-Y2553 HydrophobicContact CB-CE2 3.75Å; P2551-Y2553 HydrophobicContact CG-CE1 4.44Å; P2551-Y2553 HydrophobicContact CG-CE2 3.78Å; P2551-Y2553 WeakPolarHBondContact O-CD2 3.18Å; P2551-Y2553 PolarHBondContact O-N 2.85Å; P2551-P2648 HydrophobicContact CB-CG 4.1Å
2552	L	91.3	Very high	85.1	Confident	9 Å²	9	25.6 Å²	25.6	5%	0.047	14%	0.141	C	C	.	.			trans	-82.3	76.7	174.9	-60.3	-174.9	0	0	0	111	Y1527 L2543 V2587 L2594 F2647	Y1527-L2552 HydrophobicContact CD2-CD2 4.27Å; Y1527-L2552 HydrophobicContact CE2-CD2 3.7Å; L2543-L2552 HydrophobicContact CD1-CD1 3.71Å; L2543-L2552 HydrophobicContact CD1-CG 4.19Å; L2552-V2587 HydrophobicContact CD1-CG2 3.98Å; L2552-V2587 HydrophobicContact CD2-CG1 4.22Å; L2552-V2587 HydrophobicContact CD2-CG2 4.37Å; L2552-L2594 HydrophobicContact CB-CD1 4.2Å; L2552-L2594 HydrophobicContact CD1-CD1 4.29Å; L2552-L2594 HydrophobicContact CD1-CD2 4.23Å; L2552-L2594 HydrophobicContact CD2-CD2 4.38Å; L2552-F2647 HydrophobicContact CB-CD1 4.1Å; L2552-F2647 HydrophobicContact CB-CE1 4.35Å; L2552-F2647 HydrophobicContact CD1-CE1 4.02Å
2553	Y	92.7	Very high	85	Confident	14 Å²	14	26.9 Å²	26.9	6%	0.055	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	132.2	178.4	-64.1	-72.7	0	0	0	112.4	L1303 I1367 V1524 Y1527 P2551 P2648 L2650	L1303-Y2553 HydrophobicContact CD2-CD1 4.32Å; L1303-Y2553 HydrophobicContact CD2-CE1 3.82Å; I1367-Y2553 HydrophobicContact CD1-CE1 4.25Å; I1367-Y2553 WeakPolarHBondContact CD1-OH 3.25Å; I1367-Y2553 HydrophobicContact CG2-CE1 4.18Å; I1367-Y2553 HydrophobicContact CG2-CE2 4.43Å; V1524-Y2553 HydrophobicContact CG1-CD2 3.43Å; V1524-Y2553 VanDerWaalsContact CG1-CD2 3.43Å; V1524-Y2553 HydrophobicContact CG1-CE2 3.62Å; V1524-Y2553 HydrophobicContact CG1-CG 4.19Å; Y1527-Y2553 PolarHBondContact N-O 3.21Å; P2551-Y2553 VanDerWaalsContact C-N 3.34Å; P2551-Y2553 HydrophobicContact CB-CD2 4.17Å; P2551-Y2553 HydrophobicContact CB-CE1 4.13Å; P2551-Y2553 HydrophobicContact CB-CE2 3.75Å; P2551-Y2553 HydrophobicContact CG-CE1 4.44Å; P2551-Y2553 HydrophobicContact CG-CE2 3.78Å; P2551-Y2553 WeakPolarHBondContact O-CD2 3.18Å; P2551-Y2553 PolarHBondContact O-N 2.85Å; Y2553-P2648 HydrophobicContact CD1-CB 4.03Å; Y2553-P2648 HydrophobicContact CD1-CG 3.63Å; Y2553-P2648 HydrophobicContact CE1-CB 4.26Å; Y2553-P2648 HydrophobicContact CE1-CG 3.93Å; Y2553-P2648 HydrophobicContact CG-CG 4.37Å; Y2553-L2650 HydrophobicContact CD1-CB 4.17Å; Y2553-L2650 HydrophobicContact CD1-CD1 4.13Å; Y2553-L2650 HydrophobicContact CD1-CD2 4.43Å; Y2553-L2650 HydrophobicContact CE1-CD1 4.41Å; Y2553-L2650 HydrophobicContact CG-CB 4.43Å; Y2553-L2650 HydrophobicContact CG-CD2 4.15Å
2554	L	91.5	Very high	84.7	Confident	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	142.3	172.8	-68.1	-176.6	0	0	0	111.5	Y1527 I1529 K2559 L2562 L2594 F2647 P2648 L2650	Y1527-L2554 VanDerWaalsContact O-CD2 3.29Å; Y1527-L2554 WeakPolarHBondContact O-CD2 3.31Å; I1529-L2554 HydrophobicContact CG2-CD1 3.84Å; I1529-L2554 HydrophobicContact CG2-CD2 3.67Å; I1529-L2554 HydrophobicContact CG2-CG 4.43Å; L2554-K2559 HydrophobicContact CB-CB 4.17Å; L2554-K2559 HydrophobicContact CD1-CD 4.38Å; L2554-L2562 HydrophobicContact CD1-CD2 3.67Å; L2554-L2594 HydrophobicContact CD2-CD1 3.82Å; L2554-L2594 HydrophobicContact CD2-CG 4.27Å; L2554-F2647 HydrophobicContact CD1-CB 3.79Å; L2554-F2647 HydrophobicContact CD1-CG 4.27Å; L2554-F2647 HydrophobicContact CG-CB 4.2Å; L2554-P2648 PolarHBondContact N-O 3.29Å; L2554-L2650 PolarHBondContact O-N 3.15Å
2555	R	87	Confident	84.9	Confident	34 Å²	34	29 Å²	29	13%	0.128	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	158.3	167.4	-63.9	-156.9	-138.6	-111.9	-1.7	111.4	Y1073 E1078 T1369 V1526 E1528 H2557 S2558 K2559	Y1073-R2555 VanDerWaalsContact CD2-NH2 3.29Å; E1078-R2555 IonicContact OE1-NH2 3.13Å; T1369-R2555 HydrophobicContact CG2-CG 4.31Å; V1526-R2555 HydrophobicContact CG1-CG 3.51Å; E1528-R2555 WeakPolarHBondContact OE1-CD 3.37Å; E1528-R2555 VanDerWaalsContact OE1-CG 3.26Å; E1528-R2555 WeakPolarHBondContact OE1-CG 3.48Å; E1528-R2555 IonicContact OE1-CZ 3.25Å; E1528-R2555 IonicContact OE1-NE 2.9Å; E1528-R2555 PolarHBondContact OE1-NE 2.82Å; E1528-R2555 IonicContact OE1-NH2 3.91Å; R2555-H2557 VanDerWaalsContact C-N 3.29Å; R2555-H2557 PolarHBondContact O-N 3.05Å; R2555-S2558 PolarHBondContact O-N 3.14Å; R2555-K2559 PolarHBondContact O-N 3.15Å
2556	V	81.7	Confident	85.3	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.024	15%	0.146	C	C	.	.	H	α-helix	trans	-46	-50.4	179.8	-160.7	0	0	0	0	112.5	K2559 N2560 L2649 Y2655 L2658	V2556-K2559 PolarHBondContact O-N 3.25Å; V2556-N2560 WeakPolarHBondContact O-CB 3.4Å; V2556-N2560 PolarHBondContact O-N 3.43Å; V2556-N2560 PolarHBondContact O-ND2 2.65Å; V2556-L2649 HydrophobicContact CG1-CD1 4.48Å; V2556-L2649 HydrophobicContact CG2-CD2 4.21Å; V2556-Y2655 HydrophobicContact CG1-CD2 4.04Å; V2556-Y2655 HydrophobicContact CG1-CE2 4.1Å; V2556-Y2655 HydrophobicContact CG2-CD2 3.76Å; V2556-Y2655 HydrophobicContact CG2-CE2 4.47Å; V2556-L2658 HydrophobicContact CB-CD2 4.08Å; V2556-L2658 HydrophobicContact CG1-CD2 4.12Å
2557	H	76.7	Confident	85.7	Confident	8 Å²	8	27.7 Å²	27.7	4%	0.037	15%	0.148	C	C	.	.	H	α-helix	trans	-71.8	-42.6	-173.6	78	-80.6	0	0	0	112.2	Y1073 L1074 Y1088 E1528 R2555 N2560 A2561	Y1073-H2557 AromaticContact CD1-CE1 3.4Å; Y1073-H2557 WeakPolarHBondContact CD1-CE1 2.89Å; Y1073-H2557 AromaticContact CD1-NE2 3.94Å; Y1073-H2557 AromaticContact CE1-CE1 3.76Å; L1074-H2557 HydrophobicContact CD1-CB 4.42Å; Y1088-H2557 HydrophobicContact CD2-CB 4.21Å; Y1088-H2557 AromaticContact CD2-CD2 3.71Å; Y1088-H2557 HydrophobicContact CE1-CB 4.16Å; Y1088-H2557 HydrophobicContact CE2-CB 3.67Å; Y1088-H2557 AromaticContact CE2-CD2 3.62Å; Y1088-H2557 PolarHBondContact OH-O 2.79Å; E1528-H2557 VanDerWaalsContact CD-CE1 3.41Å; E1528-H2557 IonicContact OE1-CE1 2.77Å; E1528-H2557 PolarHBondContact OE1-CE1 3.35Å; E1528-H2557 IonicContact OE2-CE1 3.92Å; E1528-H2557 PolarHBondContact OE2-CE1 3.28Å; E1528-H2557 IonicContact OE2-ND1 3.85Å; E1528-H2557 IonicContact OE2-NE2 2.7Å; E1528-H2557 PolarHBondContact OE2-NE2 3.32Å; R2555-H2557 VanDerWaalsContact C-N 3.29Å; R2555-H2557 PolarHBondContact O-N 3.05Å; H2557-N2560 PolarHBondContact O-N 3.33Å; H2557-A2561 WeakPolarHBondContact O-CB 3.46Å; H2557-A2561 PolarHBondContact O-N 3.44Å
2558	S	87	Confident	86.1	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.5	-50.7	169.3	-86.5	0	0	0	0	112.1	E1528 I1529 R2555 N2560 A2561 L2562	E1528-S2558 VanDerWaalsContact OE2-CB 3.29Å; E1528-S2558 WeakPolarHBondContact OE2-CB 3.32Å; E1528-S2558 PolarHBondContact OE2-OG 2.95Å; I1529-S2558 WeakPolarHBondContact CD1-O 3.3Å; I1529-S2558 PolarHBondContact N-OG 3.27Å; I1529-S2558 VanDerWaalsContact N-OG 3.12Å; R2555-S2558 PolarHBondContact O-N 3.14Å; S2558-N2560 VanDerWaalsContact C-N 3.3Å; S2558-N2560 PolarHBondContact O-N 2.79Å; S2558-A2561 PolarHBondContact O-N 3.05Å; S2558-L2562 WeakPolarHBondContact O-CB 3.48Å; S2558-L2562 PolarHBondContact O-N 3.29Å
2559	K	89.6	Confident	87	Confident	5 Å²	5	28.3 Å²	28.3	2%	0.022	15%	0.148	C	C	.	.	H	α-helix	trans	-60.1	-39.1	178.4	-178.1	67.9	173.7	-163.7	0	112.2	L2554 R2555 V2556 S2563 H2644 F2647 L2649	L2554-K2559 HydrophobicContact CB-CB 4.17Å; L2554-K2559 HydrophobicContact CD1-CD 4.38Å; R2555-K2559 PolarHBondContact O-N 3.15Å; V2556-K2559 PolarHBondContact O-N 3.25Å; K2559-S2563 VanDerWaalsContact O-CB 3.22Å; K2559-S2563 WeakPolarHBondContact O-CB 3.17Å; K2559-S2563 PolarHBondContact O-N 2.88Å; K2559-S2563 PolarHBondContact O-OG 2.68Å; K2559-H2644 PolarHBondContact NZ-O 2.85Å; K2559-F2647 WeakPolarHBondContact CE-O 3.43Å; K2559-F2647 PolarHBondContact NZ-O 2.78Å; K2559-L2649 HydrophobicContact CB-CB 4.41Å; K2559-L2649 HydrophobicContact CB-CD1 4.09Å; K2559-L2649 HydrophobicContact CB-CG 4.05Å; K2559-L2649 HydrophobicContact CG-CB 4.01Å; K2559-L2649 HydrophobicContact CG-CD1 3.87Å; K2559-L2649 HydrophobicContact CG-CG 4.05Å
2560	N	82.7	Confident	88	Confident	43 Å²	43	23.5 Å²	23.5	23%	0.23	12%	0.122	C	C	.	.	H	α-helix	trans	-63.5	-46.4	175.4	-76.7	-12.4	0	0	0	111.7	V2556 H2557 S2558 S2563 H2564 T2662	V2556-N2560 WeakPolarHBondContact O-CB 3.4Å; V2556-N2560 PolarHBondContact O-N 3.43Å; V2556-N2560 PolarHBondContact O-ND2 2.65Å; H2557-N2560 PolarHBondContact O-N 3.33Å; S2558-N2560 VanDerWaalsContact C-N 3.3Å; S2558-N2560 PolarHBondContact O-N 2.79Å; N2560-S2563 PolarHBondContact O-N 2.97Å; N2560-H2564 WeakPolarHBondContact O-CB 3.43Å; N2560-H2564 PolarHBondContact O-N 2.81Å; N2560-T2662 WeakPolarHBondContact ND2-CG2 3.45Å; N2560-T2662 PolarHBondContact ND2-OG1 3.45Å
2561	A	83.1	Confident	88.5	Confident	0 Å²	0	19 Å²	19	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.9	-48.6	178.3	0	0	0	0	0	111.5	L1084 I1529 M1531 L2414 H2557 S2558 S2563 H2564 C2565	L1084-A2561 HydrophobicContact CD1-CB 4.07Å; I1529-A2561 HydrophobicContact CD1-CB 4.19Å; M1531-A2561 HydrophobicContact CE-CB 3.73Å; L2414-A2561 HydrophobicContact CD1-CB 4.02Å; H2557-A2561 WeakPolarHBondContact O-CB 3.46Å; H2557-A2561 PolarHBondContact O-N 3.44Å; S2558-A2561 PolarHBondContact O-N 3.05Å; A2561-S2563 VanDerWaalsContact C-N 3.33Å; A2561-S2563 PolarHBondContact O-N 3.42Å; A2561-H2564 PolarHBondContact O-N 2.67Å; A2561-C2565 PolarHBondContact O-N 3.1Å; A2561-C2565 PolarHBondContact O-SG 3.05Å
2562	L	90.8	Very high	88.9	Confident	3 Å²	3	19.4 Å²	19.4	2%	0.016	10%	0.101	C	C	.	.	H	α-helix	trans	-52.7	-50.9	172.5	174.7	64.8	0	0	0	111.2	I1529 L2554 S2558 H2564 C2565 L2566 I2596 F2647	I1529-L2562 HydrophobicContact CD1-CB 3.68Å; L2554-L2562 HydrophobicContact CD1-CD2 3.67Å; S2558-L2562 WeakPolarHBondContact O-CB 3.48Å; S2558-L2562 PolarHBondContact O-N 3.29Å; L2562-H2564 VanDerWaalsContact C-N 3.32Å; L2562-H2564 PolarHBondContact O-N 3.36Å; L2562-C2565 PolarHBondContact O-N 3.04Å; L2562-L2566 HydrophobicContact CD1-CD1 3.6Å; L2562-L2566 HydrophobicContact CD1-CG 3.92Å; L2562-L2566 HydrophobicContact CG-CD1 3.84Å; L2562-L2566 HydrophobicContact CG-CG 4.44Å; L2562-L2566 VanDerWaalsContact O-CB 3.31Å; L2562-L2566 WeakPolarHBondContact O-CB 3.42Å; L2562-L2566 VanDerWaalsContact O-CG 3.28Å; L2562-L2566 WeakPolarHBondContact O-CG 3.44Å; L2562-L2566 PolarHBondContact O-N 2.88Å; L2562-I2596 HydrophobicContact CD1-CD1 3.61Å; L2562-F2647 HydrophobicContact CD2-CB 4.44Å; L2562-F2647 HydrophobicContact CD2-CD2 3.97Å; L2562-F2647 HydrophobicContact CD2-CG 4.33Å
2563	S	88.2	Confident	89.1	Confident	33 Å²	33	19 Å²	19	23%	0.231	10%	0.099	C	C	.	.	H	α-helix	trans	-68.4	-31.1	-176.8	-54.4	0	0	0	0	112.3	K2559 N2560 A2561 N2567	K2559-S2563 VanDerWaalsContact O-CB 3.22Å; K2559-S2563 WeakPolarHBondContact O-CB 3.17Å; K2559-S2563 PolarHBondContact O-N 2.88Å; K2559-S2563 PolarHBondContact O-OG 2.68Å; N2560-S2563 PolarHBondContact O-N 2.97Å; A2561-S2563 VanDerWaalsContact C-N 3.33Å; A2561-S2563 PolarHBondContact O-N 3.42Å; S2563-N2567 VanDerWaalsContact O-CB 3.29Å; S2563-N2567 WeakPolarHBondContact O-CB 3.38Å; S2563-N2567 PolarHBondContact O-N 2.9Å; S2563-N2567 PolarHBondContact O-ND2 2.73Å
2564	H	84.4	Confident	89.1	Confident	63 Å²	63	18.6 Å²	18.6	29%	0.292	10%	0.099	S	C	.	.	H	α-helix	trans	-69.6	-52.4	174.3	-177.3	49.1	0	0	0	111.3	N2560 A2561 L2562 N2567 M2568	N2560-H2564 WeakPolarHBondContact O-CB 3.43Å; N2560-H2564 PolarHBondContact O-N 2.81Å; A2561-H2564 PolarHBondContact O-N 2.67Å; L2562-H2564 VanDerWaalsContact C-N 3.32Å; L2562-H2564 PolarHBondContact O-N 3.36Å; H2564-N2567 PolarHBondContact O-N 3.25Å; H2564-N2567 VanDerWaalsContact O-N 3.15Å; H2564-M2568 WeakPolarHBondContact O-CG 3.39Å; H2564-M2568 PolarHBondContact O-N 3.24Å; H2564-M2568 VanDerWaalsContact O-N 3.08Å
2565	C	87.8	Confident	89.2	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-61.8	-49.5	-178.4	-56.4	0	0	0	0	111	M1531 L2414 V2416 A2561 L2562 N2567 M2568 D2569	M1531-C2565 HydrophobicContact CE-CB 4.39Å; M1531-C2565 VanDerWaalsContact CE-SG 3.54Å; L2414-C2565 WeakPolarHBondContact CB-SG 3.33Å; V2416-C2565 HydrophobicContact CG1-CB 3.89Å; V2416-C2565 HydrophobicContact CG2-CB 4.04Å; A2561-C2565 PolarHBondContact O-N 3.1Å; A2561-C2565 PolarHBondContact O-SG 3.05Å; L2562-C2565 PolarHBondContact O-N 3.04Å; C2565-N2567 VanDerWaalsContact C-N 3.27Å; C2565-N2567 PolarHBondContact O-N 3.45Å; C2565-M2568 PolarHBondContact O-N 3.32Å; C2565-M2568 VanDerWaalsContact O-N 3.11Å; C2565-D2569 WeakPolarHBondContact O-CB 3.38Å; C2565-D2569 PolarHBondContact O-N 2.89Å
2566	L	92.6	Very high	89.5	Confident	7 Å²	7	24 Å²	24	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-56.6	-40.4	175	-71.7	177.2	0	0	0	112	V2416 L2562 M2568 T2570 L2583 L2598 F2639 L2640 L2643	V2416-L2566 HydrophobicContact CG2-CD2 4.03Å; L2562-L2566 HydrophobicContact CD1-CD1 3.6Å; L2562-L2566 HydrophobicContact CD1-CG 3.92Å; L2562-L2566 HydrophobicContact CG-CD1 3.84Å; L2562-L2566 HydrophobicContact CG-CG 4.44Å; L2562-L2566 VanDerWaalsContact O-CB 3.31Å; L2562-L2566 WeakPolarHBondContact O-CB 3.42Å; L2562-L2566 VanDerWaalsContact O-CG 3.28Å; L2562-L2566 WeakPolarHBondContact O-CG 3.44Å; L2562-L2566 PolarHBondContact O-N 2.88Å; L2566-M2568 VanDerWaalsContact C-N 3.35Å; L2566-M2568 PolarHBondContact O-N 2.98Å; L2566-T2570 VanDerWaalsContact O-CB 3.25Å; L2566-T2570 WeakPolarHBondContact O-CB 3.36Å; L2566-T2570 VanDerWaalsContact O-CG2 3.23Å; L2566-T2570 WeakPolarHBondContact O-CG2 3.42Å; L2566-T2570 PolarHBondContact O-N 3.01Å; L2566-T2570 PolarHBondContact O-OG1 2.92Å; L2566-L2583 HydrophobicContact CD2-CD1 4.39Å; L2566-L2598 HydrophobicContact CD2-CD1 4.32Å; L2566-L2598 HydrophobicContact CD2-CD2 4.1Å; L2566-L2598 HydrophobicContact CD2-CG 4.39Å; L2566-F2639 HydrophobicContact CD2-CE1 4.22Å; L2566-L2640 HydrophobicContact CB-CD2 3.72Å; L2566-L2643 HydrophobicContact CD1-CB 4.44Å; L2566-L2643 HydrophobicContact CD1-CD1 3.73Å; L2566-L2643 HydrophobicContact CD2-CD1 4.16Å
2567	N	91.5	Very high	90	Very high	64 Å²	64	30 Å²	30	34%	0.342	16%	0.156	S	C	.	.	H	α-helix	trans	-66.8	-33.1	178.5	-94	-74	0	0	0	113.8	S2563 H2564 C2565 A2571 R2636	S2563-N2567 VanDerWaalsContact O-CB 3.29Å; S2563-N2567 WeakPolarHBondContact O-CB 3.38Å; S2563-N2567 PolarHBondContact O-N 2.9Å; S2563-N2567 PolarHBondContact O-ND2 2.73Å; H2564-N2567 PolarHBondContact O-N 3.25Å; H2564-N2567 VanDerWaalsContact O-N 3.15Å; C2565-N2567 VanDerWaalsContact C-N 3.27Å; C2565-N2567 PolarHBondContact O-N 3.45Å; N2567-A2571 VanDerWaalsContact O-CB 3.23Å; N2567-A2571 WeakPolarHBondContact O-CB 3.47Å; N2567-R2636 PolarHBondContact O-NH2 3.32Å; N2567-R2636 PolarHBondContact OD1-NH2 3.16Å
2568	M	89.7	Confident	90.8	Very high	68 Å²	68	29.6 Å²	29.6	34%	0.335	15%	0.154	S	C	.	.	H	α-helix	trans	-80.9	-52.7	177.9	-60.8	-62.4	86.5	0	0	111.3	H2564 C2565 L2566 T2570 A2571 F2572	H2564-M2568 WeakPolarHBondContact O-CG 3.39Å; H2564-M2568 PolarHBondContact O-N 3.24Å; H2564-M2568 VanDerWaalsContact O-N 3.08Å; C2565-M2568 PolarHBondContact O-N 3.32Å; C2565-M2568 VanDerWaalsContact O-N 3.11Å; L2566-M2568 VanDerWaalsContact C-N 3.35Å; L2566-M2568 PolarHBondContact O-N 2.98Å; M2568-T2570 PolarHBondContact O-N 2.9Å; M2568-A2571 WeakPolarHBondContact O-CB 3.3Å; M2568-A2571 PolarHBondContact O-N 3.28Å; M2568-A2571 VanDerWaalsContact O-N 3.11Å; M2568-F2572 PolarHBondContact O-N 2.95Å
2569	D	95	Very high	90.8	Very high	0 Å²	0	29.6 Å²	29.6	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-62.9	-44.5	-177.4	-65.1	-5.4	0	0	0	111.2	Y2404 C2415 V2416 L2417 C2565 A2571 F2572 L2573 L2598	Y2404-D2569 WeakPolarHBondContact CE1-OD1 3.23Å; Y2404-D2569 WeakPolarHBondContact OH-CA 3.46Å; Y2404-D2569 PolarHBondContact OH-N 3.48Å; Y2404-D2569 PolarHBondContact OH-OD1 3.38Å; C2415-D2569 PolarHBondContact SG-OD1 2.92Å; C2415-D2569 PolarHBondContact SG-OD2 3.43Å; C2415-D2569 VanDerWaalsContact SG-OD2 3.36Å; V2416-D2569 WeakPolarHBondContact CG2-OD2 3.4Å; V2416-D2569 PolarHBondContact N-OD2 3.46Å; L2417-D2569 HydrophobicContact CD2-CB 4.32Å; L2417-D2569 HydrophobicContact CG-CB 4.19Å; L2417-D2569 PolarHBondContact N-OD2 3.13Å; C2565-D2569 WeakPolarHBondContact O-CB 3.38Å; C2565-D2569 PolarHBondContact O-N 2.89Å; D2569-A2571 VanDerWaalsContact C-N 3.31Å; D2569-A2571 PolarHBondContact O-N 2.87Å; D2569-F2572 WeakPolarHBondContact O-CB 3.5Å; D2569-F2572 PolarHBondContact O-N 2.65Å; D2569-L2573 WeakPolarHBondContact O-CG 3.41Å; D2569-L2573 PolarHBondContact O-N 3.13Å; D2569-L2598 HydrophobicContact CB-CD1 3.97Å
2570	T	95.3	Very high	90.6	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-70.2	-26.5	176.2	64.3	0	0	0	0	113.1	L2566 M2568 A2574 Y2581 R2636 F2639 L2640	L2566-T2570 VanDerWaalsContact O-CB 3.25Å; L2566-T2570 WeakPolarHBondContact O-CB 3.36Å; L2566-T2570 VanDerWaalsContact O-CG2 3.23Å; L2566-T2570 WeakPolarHBondContact O-CG2 3.42Å; L2566-T2570 PolarHBondContact O-N 3.01Å; L2566-T2570 PolarHBondContact O-OG1 2.92Å; M2568-T2570 PolarHBondContact O-N 2.9Å; T2570-A2574 VanDerWaalsContact O-CB 3.25Å; T2570-A2574 WeakPolarHBondContact O-CB 3.35Å; T2570-A2574 PolarHBondContact O-N 2.89Å; T2570-Y2581 HydrophobicContact CG2-CE2 3.83Å; T2570-R2636 WeakPolarHBondContact O-CD 3.44Å; T2570-R2636 PolarHBondContact OG1-NE 3.19Å; T2570-F2639 HydrophobicContact CG2-CD1 4.02Å; T2570-F2639 HydrophobicContact CG2-CE1 3.98Å; T2570-L2640 HydrophobicContact CG2-CD2 4.34Å
2571	A	93.7	Very high	91.1	Very high	25 Å²	25	28.5 Å²	28.5	21%	0.207	15%	0.148	C	C	.	.	H	α-helix	trans	-71.3	-40.2	173.1	0	0	0	0	0	111	N2567 M2568 D2569 A2574 N2575	N2567-A2571 VanDerWaalsContact O-CB 3.23Å; N2567-A2571 WeakPolarHBondContact O-CB 3.47Å; M2568-A2571 WeakPolarHBondContact O-CB 3.3Å; M2568-A2571 PolarHBondContact O-N 3.28Å; M2568-A2571 VanDerWaalsContact O-N 3.11Å; D2569-A2571 VanDerWaalsContact C-N 3.31Å; D2569-A2571 PolarHBondContact O-N 2.87Å; A2571-A2574 PolarHBondContact O-N 2.92Å; A2571-N2575 WeakPolarHBondContact O-CB 3.2Å; A2571-N2575 PolarHBondContact O-N 3Å; A2571-N2575 PolarHBondContact O-OD1 2.9Å
2572	F	95.3	Very high	91.6	Very high	27 Å²	27	28.5 Å²	28.5	12%	0.118	15%	0.148	C	C	.	.	H	α-helix	trans	-57.8	-50.2	169.7	165.9	-102.7	0	0	0	111.5	D2400 Y2404 L2417 M2568 D2569 A2574 N2575 L2576	D2400-F2572 HydrophobicContact CB-CE2 3.98Å; D2400-F2572 HydrophobicContact CB-CZ 4.37Å; D2400-F2572 WeakPolarHBondContact O-CE2 3.28Å; D2400-F2572 WeakPolarHBondContact O-CZ 3.36Å; Y2404-F2572 HydrophobicContact CD1-CD1 4.07Å; Y2404-F2572 HydrophobicContact CD1-CD2 4.42Å; Y2404-F2572 HydrophobicContact CD1-CE1 4.16Å; Y2404-F2572 HydrophobicContact CD1-CE2 4.5Å; Y2404-F2572 HydrophobicContact CD1-CG 4.2Å; Y2404-F2572 HydrophobicContact CD1-CZ 4.38Å; Y2404-F2572 HydrophobicContact CD2-CB 4.09Å; Y2404-F2572 HydrophobicContact CD2-CD1 4.43Å; Y2404-F2572 AromaticContact CD2-CD2 3.5Å; Y2404-F2572 HydrophobicContact CD2-CD2 3.5Å; Y2404-F2572 VanDerWaalsContact CD2-CD2 3.5Å; Y2404-F2572 AromaticContact CD2-CE2 3.99Å; Y2404-F2572 HydrophobicContact CD2-CE2 3.99Å; Y2404-F2572 AromaticContact CD2-CG 3.75Å; Y2404-F2572 HydrophobicContact CD2-CG 3.75Å; Y2404-F2572 HydrophobicContact CE1-CD1 4.23Å; Y2404-F2572 HydrophobicContact CE1-CG 4.31Å; Y2404-F2572 HydrophobicContact CE2-CB 3.72Å; Y2404-F2572 HydrophobicContact CE2-CD2 4.05Å; Y2404-F2572 AromaticContact CE2-CG 3.88Å; Y2404-F2572 HydrophobicContact CE2-CG 3.88Å; Y2404-F2572 HydrophobicContact CG-CD1 4.17Å; Y2404-F2572 AromaticContact CG-CD2 3.71Å; Y2404-F2572 HydrophobicContact CG-CD2 3.71Å; Y2404-F2572 HydrophobicContact CG-CE1 4.23Å; Y2404-F2572 AromaticContact CG-CE2 3.76Å; Y2404-F2572 HydrophobicContact CG-CE2 3.76Å; Y2404-F2572 AromaticContact CG-CG 3.92Å; Y2404-F2572 HydrophobicContact CG-CG 3.92Å; Y2404-F2572 HydrophobicContact CG-CZ 4.03Å; L2417-F2572 HydrophobicContact CD1-CD1 4.14Å; L2417-F2572 HydrophobicContact CD1-CE1 4.1Å; M2568-F2572 PolarHBondContact O-N 2.95Å; D2569-F2572 WeakPolarHBondContact O-CB 3.5Å; D2569-F2572 PolarHBondContact O-N 2.65Å; F2572-A2574 PolarHBondContact O-N 2.96Å; F2572-N2575 PolarHBondContact O-N 3.47Å; F2572-L2576 HydrophobicContact CD1-CD1 4.43Å; F2572-L2576 HydrophobicContact CD2-CD1 4.19Å; F2572-L2576 HydrophobicContact CE1-CD1 3.87Å; F2572-L2576 HydrophobicContact CE2-CD1 3.6Å; F2572-L2576 HydrophobicContact CE2-CG 4.44Å; F2572-L2576 HydrophobicContact CZ-CD1 3.41Å; F2572-L2576 VanDerWaalsContact CZ-CD1 3.41Å; F2572-L2576 WeakPolarHBondContact O-CG 3.18Å; F2572-L2576 PolarHBondContact O-N 2.96Å
2573	L	95.7	Very high	91.8	Very high	1 Å²	1	28.3 Å²	28.3	1%	0.005	15%	0.148	C	C	.	.	H	α-helix	trans	-61.3	-42.7	176.4	-64.3	-178.1	0	0	0	112.4	L2417 D2569 L2576 F2577 I2578 Y2581 Y2601	L2417-L2573 HydrophobicContact CD2-CD1 4.09Å; L2417-L2573 HydrophobicContact CD2-CD2 4.29Å; L2417-L2573 HydrophobicContact CD2-CG 4.35Å; D2569-L2573 WeakPolarHBondContact O-CG 3.41Å; D2569-L2573 PolarHBondContact O-N 3.13Å; L2573-L2576 CarbonylContact O-C 3.5Å; L2573-L2576 PolarHBondContact O-N 2.89Å; L2573-F2577 PolarHBondContact O-N 3.24Å; L2573-I2578 HydrophobicContact CB-CB 4.09Å; L2573-I2578 HydrophobicContact CB-CG2 4.26Å; L2573-I2578 HydrophobicContact CD2-CB 4.34Å; L2573-I2578 HydrophobicContact CD2-CD1 3.77Å; L2573-I2578 HydrophobicContact CD2-CG2 4.1Å; L2573-I2578 WeakPolarHBondContact O-CB 3.33Å; L2573-I2578 PolarHBondContact O-N 2.87Å; L2573-Y2581 HydrophobicContact CB-CD1 4.44Å; L2573-Y2581 HydrophobicContact CB-CE1 4.06Å; L2573-Y2581 HydrophobicContact CD1-CD1 3.66Å; L2573-Y2581 HydrophobicContact CD1-CD2 4.35Å; L2573-Y2581 HydrophobicContact CD1-CE1 3.9Å; L2573-Y2581 HydrophobicContact CD1-CG 3.91Å; L2573-Y2601 HydrophobicContact CD2-CD2 4.34Å; L2573-Y2601 HydrophobicContact CD2-CG 4.39Å
2574	A	92.9	Very high	92	Very high	6 Å²	6	28.1 Å²	28.1	5%	0.05	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-41.5	178.7	0	0	0	0	0	112.6	T2570 A2571 F2572 L2576 F2577 P2632 R2636	T2570-A2574 VanDerWaalsContact O-CB 3.25Å; T2570-A2574 WeakPolarHBondContact O-CB 3.35Å; T2570-A2574 PolarHBondContact O-N 2.89Å; A2571-A2574 PolarHBondContact O-N 2.92Å; F2572-A2574 PolarHBondContact O-N 2.96Å; A2574-L2576 PolarHBondContact O-N 2.9Å; A2574-F2577 WeakPolarHBondContact O-CA 3.32Å; A2574-F2577 PolarHBondContact O-N 2.86Å; A2574-P2632 HydrophobicContact CB-CB 4.35Å; A2574-R2636 HydrophobicContact CB-CB 4.41Å
2575	N	93.2	Very high	92.5	Very high	126 Å²	126	25.1 Å²	25.1	67%	0.674	13%	0.13	S	C	*	.	H	α-helix	trans	-58.7	-34	174.4	-70	-6.5	0	0	0	112.2	A2571 F2572 F2577	A2571-N2575 WeakPolarHBondContact O-CB 3.2Å; A2571-N2575 PolarHBondContact O-N 3Å; A2571-N2575 PolarHBondContact O-OD1 2.9Å; F2572-N2575 PolarHBondContact O-N 3.47Å; N2575-F2577 PolarHBondContact O-N 3.15Å
2576	L	93	Very high	92.7	Very high	22 Å²	22	25.1 Å²	25.1	12%	0.115	13%	0.13	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	8.3	176.2	-63.6	175.9	0	0	0	113.8	I2397 D2400 F2572 L2573 A2574 I2578 K2604	I2397-L2576 HydrophobicContact CB-CD1 4.23Å; I2397-L2576 HydrophobicContact CG2-CB 4.39Å; I2397-L2576 HydrophobicContact CG2-CD1 4.35Å; I2397-L2576 HydrophobicContact CG2-CD2 4.5Å; D2400-L2576 HydrophobicContact CB-CD1 4.03Å; D2400-L2576 HydrophobicContact CB-CD2 3.74Å; D2400-L2576 HydrophobicContact CB-CG 4.48Å; F2572-L2576 HydrophobicContact CD1-CD1 4.43Å; F2572-L2576 HydrophobicContact CD2-CD1 4.19Å; F2572-L2576 HydrophobicContact CE1-CD1 3.87Å; F2572-L2576 HydrophobicContact CE2-CD1 3.6Å; F2572-L2576 HydrophobicContact CE2-CG 4.44Å; F2572-L2576 HydrophobicContact CZ-CD1 3.41Å; F2572-L2576 VanDerWaalsContact CZ-CD1 3.41Å; F2572-L2576 WeakPolarHBondContact O-CG 3.18Å; F2572-L2576 PolarHBondContact O-N 2.96Å; L2573-L2576 CarbonylContact O-C 3.5Å; L2573-L2576 PolarHBondContact O-N 2.89Å; A2574-L2576 PolarHBondContact O-N 2.9Å; L2576-I2578 HydrophobicContact CB-CD1 3.7Å; L2576-I2578 HydrophobicContact CB-CG1 3.91Å; L2576-I2578 HydrophobicContact CD1-CD1 3.95Å; L2576-I2578 PolarHBondContact O-N 3.28Å; L2576-K2604 WeakPolarHBondContact O-CE 3.42Å
2577	F	92.1	Very high	92.7	Very high	129 Å²	129	24.9 Å²	24.9	57%	0.566	13%	0.129	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.6	23.7	-173.1	-64.6	-100.3	0	0	0	114.3	L2573 A2574 N2575 K2604 F2605 P2632	L2573-F2577 PolarHBondContact O-N 3.24Å; A2574-F2577 WeakPolarHBondContact O-CA 3.32Å; A2574-F2577 PolarHBondContact O-N 2.86Å; N2575-F2577 PolarHBondContact O-N 3.15Å; F2577-K2604 CarbonylContact O-C 3.58Å; F2577-K2604 VanDerWaalsContact O-CA 3.32Å; F2577-K2604 WeakPolarHBondContact O-CA 3.17Å; F2577-F2605 PolarHBondContact O-N 3.48Å; F2577-P2632 HydrophobicContact CB-CG 4.16Å; F2577-P2632 HydrophobicContact CD1-CG 4.12Å
2578	I	92.8	Very high	92.6	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	11%	0.114	C	C	.	.	B	Isolated β-bridge	trans	-82.8	143.8	178.8	-62.8	167.6	0	0	0	110.5	I2397 L2573 L2576 Y2581 Y2601 K2604	I2397-I2578 HydrophobicContact CD1-CD1 3.63Å; I2397-I2578 HydrophobicContact CG2-CD1 4.34Å; L2573-I2578 HydrophobicContact CB-CB 4.09Å; L2573-I2578 HydrophobicContact CB-CG2 4.26Å; L2573-I2578 HydrophobicContact CD2-CB 4.34Å; L2573-I2578 HydrophobicContact CD2-CD1 3.77Å; L2573-I2578 HydrophobicContact CD2-CG2 4.1Å; L2573-I2578 WeakPolarHBondContact O-CB 3.33Å; L2573-I2578 PolarHBondContact O-N 2.87Å; L2576-I2578 HydrophobicContact CB-CD1 3.7Å; L2576-I2578 HydrophobicContact CB-CG1 3.91Å; L2576-I2578 HydrophobicContact CD1-CD1 3.95Å; L2576-I2578 PolarHBondContact O-N 3.28Å; I2578-Y2581 HydrophobicContact CG2-CD1 4.25Å; I2578-Y2601 WeakPolarHBondContact CG2-O 3.41Å; I2578-K2604 HydrophobicContact CG1-CG 4.18Å
2579	M	87.6	Confident	92.4	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	12%	0.115	C	C	.	.			trans	-155.9	-176	-179.6	66.8	166.9	-50	0	0	112	Y2581 R2603 F2605 I2629 L2630 Y2635	M2579-Y2581 PolarHBondContact O-N 3.33Å; M2579-Y2581 VanDerWaalsContact O-N 3.17Å; M2579-R2603 PolarHBondContact N-O 3.28Å; M2579-R2603 VanDerWaalsContact N-O 3.08Å; M2579-F2605 HydrophobicContact CG-CB 4.33Å; M2579-F2605 HydrophobicContact SD-CB 3.79Å; M2579-F2605 HydrophobicContact SD-CD2 3.49Å; M2579-F2605 WeakPolarHBondContact SD-CD2 3.49Å; M2579-F2605 HydrophobicContact SD-CE2 4.46Å; M2579-F2605 HydrophobicContact SD-CG 4.04Å; M2579-I2629 HydrophobicContact CE-CB 3.91Å; M2579-I2629 HydrophobicContact CE-CG1 4.18Å; M2579-I2629 HydrophobicContact CE-CG2 3.51Å; M2579-I2629 HydrophobicContact SD-CG2 3.98Å; M2579-L2630 WeakPolarHBondContact CE-O 3.5Å; M2579-Y2635 HydrophobicContact CB-CD1 4.44Å; M2579-Y2635 HydrophobicContact CB-CD2 4.37Å; M2579-Y2635 HydrophobicContact CB-CG 4.15Å; M2579-Y2635 HydrophobicContact CE-CD2 3.57Å; M2579-Y2635 HydrophobicContact CE-CE2 4.24Å; M2579-Y2635 HydrophobicContact CE-CG 4.19Å
2580	D	85.3	Confident	91.9	Very high	24 Å²	24	25.6 Å²	25.6	13%	0.128	14%	0.139	C	C	.	.			trans	62.4	19	177.7	-144.6	-12.6	0	0	0	113.4	K2461 K2609 Y2635	K2461-D2580 WeakPolarHBondContact CE-O 3.46Å; K2461-D2580 PolarHBondContact NZ-O 3.33Å; K2461-D2580 IonicContact NZ-OD1 2.62Å; K2461-D2580 PolarHBondContact NZ-OD1 3.29Å; D2580-K2609 IonicContact OD2-NZ 2.61Å; D2580-K2609 PolarHBondContact OD2-NZ 3.47Å; D2580-Y2635 VanDerWaalsContact CA-CZ 3.5Å; D2580-Y2635 WeakPolarHBondContact CA-OH 3.26Å
2581	Y	93.8	Very high	91.3	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	16%	0.159	C	C	.	.			trans	-77.8	152.9	174	50.8	-100.7	0	0	0	112.2	T2570 L2573 I2578 M2579 L2598 I2599 Y2635 F2639	T2570-Y2581 HydrophobicContact CG2-CE2 3.83Å; L2573-Y2581 HydrophobicContact CB-CD1 4.44Å; L2573-Y2581 HydrophobicContact CB-CE1 4.06Å; L2573-Y2581 HydrophobicContact CD1-CD1 3.66Å; L2573-Y2581 HydrophobicContact CD1-CD2 4.35Å; L2573-Y2581 HydrophobicContact CD1-CE1 3.9Å; L2573-Y2581 HydrophobicContact CD1-CG 3.91Å; I2578-Y2581 HydrophobicContact CG2-CD1 4.25Å; M2579-Y2581 PolarHBondContact O-N 3.33Å; M2579-Y2581 VanDerWaalsContact O-N 3.17Å; Y2581-L2598 HydrophobicContact CD2-CD2 4.39Å; Y2581-I2599 WeakPolarHBondContact CA-O 3.44Å; Y2581-Y2635 HydrophobicContact CD1-CE1 4.25Å; Y2581-Y2635 HydrophobicContact CD2-CE1 4.1Å; Y2581-Y2635 AromaticContact CE1-CD1 3.97Å; Y2581-Y2635 HydrophobicContact CE1-CD1 3.97Å; Y2581-Y2635 HydrophobicContact CE1-CE1 4.01Å; Y2581-Y2635 HydrophobicContact CE2-CD1 4.26Å; Y2581-Y2635 AromaticContact CE2-CE1 3.83Å; Y2581-Y2635 HydrophobicContact CE2-CE1 3.83Å; Y2581-Y2635 HydrophobicContact CG-CE1 4.3Å; Y2581-Y2635 AromaticContact CZ-CD1 3.78Å; Y2581-Y2635 AromaticContact CZ-CE1 3.79Å; Y2581-Y2635 PolarHBondContact O-OH 3.47Å; Y2581-F2639 HydrophobicContact CD2-CD2 4.29Å; Y2581-F2639 HydrophobicContact CD2-CE1 4.08Å; Y2581-F2639 AromaticContact CD2-CE2 3.84Å; Y2581-F2639 HydrophobicContact CD2-CE2 3.84Å; Y2581-F2639 AromaticContact CD2-CZ 3.72Å; Y2581-F2639 HydrophobicContact CD2-CZ 3.72Å; Y2581-F2639 AromaticContact CE2-CD1 3.71Å; Y2581-F2639 HydrophobicContact CE2-CD1 3.71Å; Y2581-F2639 AromaticContact CE2-CD2 3.97Å; Y2581-F2639 HydrophobicContact CE2-CD2 3.97Å; Y2581-F2639 AromaticContact CE2-CE1 3.61Å; Y2581-F2639 HydrophobicContact CE2-CE1 3.61Å; Y2581-F2639 AromaticContact CE2-CE2 3.91Å; Y2581-F2639 HydrophobicContact CE2-CE2 3.91Å; Y2581-F2639 AromaticContact CE2-CG 3.87Å; Y2581-F2639 HydrophobicContact CE2-CG 3.87Å; Y2581-F2639 AromaticContact CE2-CZ 3.72Å; Y2581-F2639 HydrophobicContact CE2-CZ 3.72Å
2582	S	92.2	Very high	91.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	149.1	178.1	-73.9	0	0	0	0	112	D2459 L2460 K2461 L2598 I2599	D2459-S2582 WeakPolarHBondContact OD1-CB 3.15Å; D2459-S2582 PolarHBondContact OD1-OG 2.84Å; L2460-S2582 WeakPolarHBondContact O-CA 3.2Å; K2461-S2582 WeakPolarHBondContact CE-OG 3.32Å; K2461-S2582 WeakPolarHBondContact CG-OG 3.39Å; S2582-L2598 CarbonylContact O-C 3.47Å; S2582-L2598 VanDerWaalsContact O-CA 3.25Å; S2582-L2598 WeakPolarHBondContact O-CA 3.47Å; S2582-I2599 PolarHBondContact N-O 3.08Å; S2582-I2599 PolarHBondContact O-N 2.67Å
2583	L	95.2	Very high	90.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	117.7	154.2	-175.3	72	0	0	0	108.4	L2460 L2566 V2585 I2596 L2598 F2639 L2643 F2647	L2460-L2583 HydrophobicContact CB-CB 4.46Å; L2460-L2583 WeakPolarHBondContact CB-O 3.13Å; L2460-L2583 PolarHBondContact N-O 2.73Å; L2460-L2583 PolarHBondContact O-N 3.12Å; L2566-L2583 HydrophobicContact CD2-CD1 4.39Å; L2583-V2585 HydrophobicContact CD2-CG2 3.75Å; L2583-V2585 HydrophobicContact CG-CG2 3.76Å; L2583-I2596 HydrophobicContact CD1-CB 4.36Å; L2583-L2598 HydrophobicContact CB-CD2 4.07Å; L2583-L2598 HydrophobicContact CD1-CD2 3.95Å; L2583-L2598 HydrophobicContact CD1-CG 4.32Å; L2583-F2639 HydrophobicContact CB-CZ 4.04Å; L2583-L2643 HydrophobicContact CB-CD1 4.06Å; L2583-L2643 HydrophobicContact CB-CD2 4.4Å; L2583-L2643 HydrophobicContact CD2-CD1 3.86Å; L2583-L2643 HydrophobicContact CD2-CD2 4.14Å; L2583-F2647 HydrophobicContact CD2-CE2 4.11Å
2584	L	93.9	Very high	90.7	Very high	28 Å²	28	31.5 Å²	31.5	15%	0.147	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	134.5	169.7	-163.1	75.6	0	0	0	109.2	L2447 Y2448 I2457 Y2458 D2459 I2596 G2597 I2599	L2447-L2584 HydrophobicContact CD1-CB 4.48Å; L2447-L2584 HydrophobicContact CD1-CD2 4.26Å; Y2448-L2584 HydrophobicContact CE2-CD2 3.86Å; Y2448-L2584 WeakPolarHBondContact OH-CD2 3.27Å; Y2448-L2584 WeakPolarHBondContact OH-CG 3.31Å; I2457-L2584 HydrophobicContact CG2-CD1 4.01Å; I2457-L2584 HydrophobicContact CG2-CG 4.4Å; Y2458-L2584 CarbonylContact O-C 3.41Å; Y2458-L2584 WeakPolarHBondContact O-CA 3.26Å; D2459-L2584 HydrophobicContact CB-CD1 4.21Å; L2584-I2596 WeakPolarHBondContact O-CA 3.31Å; L2584-G2597 PolarHBondContact N-O 3.23Å; L2584-G2597 PolarHBondContact O-N 2.84Å; L2584-I2599 HydrophobicContact CB-CD1 4Å; L2584-I2599 HydrophobicContact CB-CG1 4.32Å; L2584-I2599 HydrophobicContact CB-CG2 4.41Å; L2584-I2599 HydrophobicContact CD1-CD1 4.04Å; L2584-I2599 HydrophobicContact CD2-CD1 4.36Å; L2584-I2599 HydrophobicContact CG-CD1 4.35Å
2585	V	94	Very high	90.6	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	111.7	-175.1	-174.9	0	0	0	0	111	I2457 Y2458 L2460 L2583 L2594 I2595 I2596 F2647	I2457-V2585 CarbonylContact C-O 3.51Å; I2457-V2585 WeakPolarHBondContact CA-O 3.33Å; Y2458-V2585 PolarHBondContact N-O 3.47Å; Y2458-V2585 PolarHBondContact O-N 3.48Å; L2460-V2585 HydrophobicContact CD1-CG2 3.83Å; L2583-V2585 HydrophobicContact CD2-CG2 3.75Å; L2583-V2585 HydrophobicContact CG-CG2 3.76Å; V2585-L2594 HydrophobicContact CG1-CB 4.26Å; V2585-L2594 HydrophobicContact CG1-CD1 4.43Å; V2585-I2595 CarbonylContact C-O 3.59Å; V2585-I2595 VanDerWaalsContact CA-O 3.27Å; V2585-I2595 WeakPolarHBondContact CA-O 3.49Å; V2585-I2596 HydrophobicContact CG1-CG2 4.19Å; V2585-I2596 HydrophobicContact CG2-CG2 4.12Å; V2585-F2647 HydrophobicContact CG1-CE1 4.43Å; V2585-F2647 HydrophobicContact CG1-CZ 4.41Å; V2585-F2647 HydrophobicContact CG2-CZ 4.02Å
2586	G	92.2	Very high	90.6	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	14%	0.136	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	133.9	169.1	0	0	0	0	0	110.8	Y2448 L2594 I2595	Y2448-G2586 PolarHBondContact OH-N 2.76Å; G2586-L2594 CarbonylContact O-C 3.51Å; G2586-L2594 WeakPolarHBondContact O-CA 3.49Å; G2586-I2595 PolarHBondContact N-O 3.25Å; G2586-I2595 PolarHBondContact O-N 3.46Å
2587	V	92.2	Very high	90.6	Very high	2 Å²	2	24.5 Å²	24.5	1%	0.012	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	111.9	176.9	-171.5	0	0	0	0	109.5	Y1527 A2455 Y2456 Y2458 L2552 T2589 L2594	Y1527-V2587 HydrophobicContact CD1-CG1 4.41Å; Y1527-V2587 HydrophobicContact CE1-CG1 3.71Å; A2455-V2587 PolarHBondContact N-O 2.77Å; Y2456-V2587 PolarHBondContact O-N 2.73Å; Y2458-V2587 HydrophobicContact CD2-CG2 3.99Å; Y2458-V2587 HydrophobicContact CE2-CG2 3.78Å; L2552-V2587 HydrophobicContact CD1-CG2 3.98Å; L2552-V2587 HydrophobicContact CD2-CG1 4.22Å; L2552-V2587 HydrophobicContact CD2-CG2 4.37Å; V2587-T2589 HydrophobicContact CG1-CG2 4.07Å; V2587-L2594 HydrophobicContact CB-CD2 4.38Å; V2587-L2594 HydrophobicContact CG1-CD2 4.05Å; V2587-L2594 HydrophobicContact CG2-CD2 4.07Å
2588	D	89.2	Confident	90.8	Very high	8 Å²	8	18.3 Å²	18.3	4%	0.043	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	110.6	168.6	-176.6	-23.1	0	0	0	108.8	L2454 T2590 T2591 N2592 Q2593 I2595	L2454-D2588 HydrophobicContact CD2-CB 4.14Å; D2588-T2590 PolarHBondContact OD1-N 2.88Å; D2588-T2590 PolarHBondContact OD1-OG1 3.5Å; D2588-T2590 VanDerWaalsContact OD1-OG1 3.13Å; D2588-T2591 PolarHBondContact OD1-N 3.45Å; D2588-T2591 PolarHBondContact OD1-OG1 3.16Å; D2588-T2591 WeakPolarHBondContact OD2-CG2 3.3Å; D2588-T2591 PolarHBondContact OD2-OG1 3.14Å; D2588-N2592 CarbonylContact O-C 3.52Å; D2588-N2592 VanDerWaalsContact O-CA 3.24Å; D2588-N2592 WeakPolarHBondContact O-CA 3.16Å; D2588-N2592 PolarHBondContact O-N 3.32Å; D2588-Q2593 HydrophobicContact CB-CB 4.36Å; D2588-Q2593 PolarHBondContact N-O 2.84Å; D2588-Q2593 PolarHBondContact O-N 2.91Å; D2588-I2595 HydrophobicContact CB-CD1 3.94Å
2589	T	85	Confident	90.7	Very high	57 Å²	57	19.7 Å²	19.7	35%	0.35	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.8	-7.3	-179.6	52.6	0	0	0	0	113.5	A2455 V2587	A2455-T2589 HydrophobicContact CB-CG2 3.87Å; V2587-T2589 HydrophobicContact CG1-CG2 4.07Å
2590	T	84.9	Confident	90.8	Very high	82 Å²	82	23 Å²	23	50%	0.503	13%	0.129	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.1	-34.9	178.6	75.4	0	0	0	0	111.2	Q2453 D2588	Q2453-T2590 HydrophobicContact CB-CG2 4.26Å; Q2453-T2590 PolarHBondContact OE1-OG1 3.1Å; D2588-T2590 PolarHBondContact OD1-N 2.88Å; D2588-T2590 PolarHBondContact OD1-OG1 3.5Å; D2588-T2590 VanDerWaalsContact OD1-OG1 3.13Å
2591	T	83.6	Confident	91.1	Very high	68 Å²	68	22.4 Å²	22.4	42%	0.417	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-5.7	171.2	70.9	0	0	0	0	114	D2588 Q2593	D2588-T2591 PolarHBondContact OD1-N 3.45Å; D2588-T2591 PolarHBondContact OD1-OG1 3.16Å; D2588-T2591 WeakPolarHBondContact OD2-CG2 3.3Å; D2588-T2591 PolarHBondContact OD2-OG1 3.14Å; T2591-Q2593 WeakPolarHBondContact OG1-CG 3.43Å
2592	N	88.7	Confident	90.9	Very high	55 Å²	55	22.8 Å²	22.8	29%	0.294	13%	0.127	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.2	53	-170.7	-68	-70.3	0	0	0	112.5	Y1527 E1528 D2588	Y1527-N2592 VanDerWaalsContact CA-O 3.27Å; Y1527-N2592 WeakPolarHBondContact CA-O 3.42Å; Y1527-N2592 HydrophobicContact CD1-CB 4.33Å; E1528-N2592 PolarHBondContact N-O 3.26Å; D2588-N2592 CarbonylContact O-C 3.52Å; D2588-N2592 VanDerWaalsContact O-CA 3.24Å; D2588-N2592 WeakPolarHBondContact O-CA 3.16Å; D2588-N2592 PolarHBondContact O-N 3.32Å
2593	Q	90.3	Very high	90.6	Very high	53 Å²	53	26.8 Å²	26.8	25%	0.248	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	139.5	179.7	-66.4	178.6	15.8	0	0	112.3	E1528 V1530 D2588 T2591 I2595	E1528-Q2593 CarbonylContact O-C 3.52Å; E1528-Q2593 VanDerWaalsContact O-CA 3.31Å; E1528-Q2593 WeakPolarHBondContact O-CA 3.23Å; V1530-Q2593 HydrophobicContact CG2-CB 4.42Å; V1530-Q2593 HydrophobicContact CG2-CG 4.29Å; V1530-Q2593 VanDerWaalsContact CG2-OE1 3.29Å; D2588-Q2593 HydrophobicContact CB-CB 4.36Å; D2588-Q2593 PolarHBondContact N-O 2.84Å; D2588-Q2593 PolarHBondContact O-N 2.91Å; T2591-Q2593 WeakPolarHBondContact OG1-CG 3.43Å; Q2593-I2595 HydrophobicContact CB-CD1 4.33Å
2594	L	92.9	Very high	90.3	Very high	1 Å²	1	28.4 Å²	28.4	1%	0.005	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	112.4	164.1	-55.2	-165.9	0	0	0	109.2	Y1527 E1528 I1529 V1530 L2552 L2554 V2585 G2586 V2587 I2596 F2647	Y1527-L2594 HydrophobicContact CD1-CD2 3.68Å; Y1527-L2594 HydrophobicContact CD1-CG 4.39Å; Y1527-L2594 HydrophobicContact CD2-CD2 4.42Å; Y1527-L2594 HydrophobicContact CE1-CD2 4.3Å; Y1527-L2594 HydrophobicContact CG-CD2 3.76Å; Y1527-L2594 HydrophobicContact CG-CG 4.12Å; E1528-L2594 PolarHBondContact O-N 3.1Å; I1529-L2594 CarbonylContact C-O 3.57Å; I1529-L2594 WeakPolarHBondContact CA-O 3.18Å; I1529-L2594 HydrophobicContact CG2-CB 4.4Å; V1530-L2594 PolarHBondContact N-O 3.46Å; L2552-L2594 HydrophobicContact CB-CD1 4.2Å; L2552-L2594 HydrophobicContact CD1-CD1 4.29Å; L2552-L2594 HydrophobicContact CD1-CD2 4.23Å; L2552-L2594 HydrophobicContact CD2-CD2 4.38Å; L2554-L2594 HydrophobicContact CD2-CD1 3.82Å; L2554-L2594 HydrophobicContact CD2-CG 4.27Å; V2585-L2594 HydrophobicContact CG1-CB 4.26Å; V2585-L2594 HydrophobicContact CG1-CD1 4.43Å; G2586-L2594 CarbonylContact O-C 3.51Å; G2586-L2594 WeakPolarHBondContact O-CA 3.49Å; V2587-L2594 HydrophobicContact CB-CD2 4.38Å; V2587-L2594 HydrophobicContact CG1-CD2 4.05Å; V2587-L2594 HydrophobicContact CG2-CD2 4.07Å; L2594-I2596 HydrophobicContact CB-CG2 4.28Å; L2594-F2647 HydrophobicContact CD1-CD1 3.79Å; L2594-F2647 HydrophobicContact CD1-CE1 3.75Å
2595	I	91.1	Very high	89.9	Confident	4 Å²	4	29.1 Å²	29.1	2%	0.021	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	120.5	175.2	-59.8	72	0	0	0	107.2	L2447 Y2448 R2451 L2454 V2585 G2586 D2588 Q2593	L2447-I2595 HydrophobicContact CB-CG2 4.17Å; L2447-I2595 VanDerWaalsContact O-CG2 3.27Å; L2447-I2595 WeakPolarHBondContact O-CG2 3.05Å; Y2448-I2595 HydrophobicContact CD1-CB 4.17Å; Y2448-I2595 HydrophobicContact CD1-CG2 3.81Å; Y2448-I2595 HydrophobicContact CE1-CB 3.98Å; Y2448-I2595 HydrophobicContact CE1-CG2 3.83Å; R2451-I2595 VanDerWaalsContact CD-CG1 3.42Å; L2454-I2595 HydrophobicContact CD2-CD1 3.73Å; L2454-I2595 HydrophobicContact CD2-CG1 4.49Å; V2585-I2595 CarbonylContact C-O 3.59Å; V2585-I2595 VanDerWaalsContact CA-O 3.27Å; V2585-I2595 WeakPolarHBondContact CA-O 3.49Å; G2586-I2595 PolarHBondContact N-O 3.25Å; G2586-I2595 PolarHBondContact O-N 3.46Å; D2588-I2595 HydrophobicContact CB-CD1 3.94Å; Q2593-I2595 HydrophobicContact CB-CD1 4.33Å
2596	I	93.5	Very high	89.4	Confident	3 Å²	3	31.5 Å²	31.5	2%	0.015	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	144	-171	60.2	170.2	0	0	0	113.3	I1529 V1530 M1531 P1532 V2416 L2562 L2583 L2584 V2585 L2594	I1529-I2596 HydrophobicContact CB-CD1 3.92Å; I1529-I2596 HydrophobicContact CB-CG1 4.4Å; I1529-I2596 HydrophobicContact CD1-CD1 4.01Å; I1529-I2596 HydrophobicContact CG1-CD1 4.33Å; I1529-I2596 HydrophobicContact CG2-CD1 4.23Å; V1530-I2596 WeakPolarHBondContact O-CG1 3.3Å; V1530-I2596 PolarHBondContact O-N 2.76Å; M1531-I2596 HydrophobicContact CG-CD1 4.08Å; M1531-I2596 HydrophobicContact CG-CG1 4.27Å; P1532-I2596 WeakPolarHBondContact CD-O 3.4Å; V2416-I2596 HydrophobicContact CG1-CD1 3.89Å; V2416-I2596 HydrophobicContact CG1-CG1 4.34Å; L2562-I2596 HydrophobicContact CD1-CD1 3.61Å; L2583-I2596 HydrophobicContact CD1-CB 4.36Å; L2584-I2596 WeakPolarHBondContact O-CA 3.31Å; V2585-I2596 HydrophobicContact CG1-CG2 4.19Å; V2585-I2596 HydrophobicContact CG2-CG2 4.12Å; L2594-I2596 HydrophobicContact CB-CG2 4.28Å
2597	G	93.1	Very high	89	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-167.5	147.1	168.2	0	0	0	0	0	113.8	V2416 L2584	V2416-G2597 CarbonylContact O-C 3.49Å; V2416-G2597 VanDerWaalsContact O-CA 3.26Å; V2416-G2597 WeakPolarHBondContact O-CA 3.5Å; L2584-G2597 PolarHBondContact N-O 3.23Å; L2584-G2597 PolarHBondContact O-N 2.84Å
2598	L	94.5	Very high	88.4	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	132	174.7	-68.7	174.8	0	0	0	110.5	V2416 L2417 S2418 L2566 D2569 Y2581 S2582 L2583 F2639	V2416-L2598 HydrophobicContact CG2-CD1 3.88Å; V2416-L2598 HydrophobicContact CG2-CG 3.97Å; V2416-L2598 PolarHBondContact O-N 2.87Å; L2417-L2598 HydrophobicContact CD2-CB 4.18Å; L2417-L2598 HydrophobicContact CD2-CD1 4Å; S2418-L2598 VanDerWaalsContact CB-O 3.27Å; S2418-L2598 WeakPolarHBondContact CB-O 2.9Å; S2418-L2598 PolarHBondContact N-O 3.17Å; L2566-L2598 HydrophobicContact CD2-CD1 4.32Å; L2566-L2598 HydrophobicContact CD2-CD2 4.1Å; L2566-L2598 HydrophobicContact CD2-CG 4.39Å; D2569-L2598 HydrophobicContact CB-CD1 3.97Å; Y2581-L2598 HydrophobicContact CD2-CD2 4.39Å; S2582-L2598 CarbonylContact O-C 3.47Å; S2582-L2598 VanDerWaalsContact O-CA 3.25Å; S2582-L2598 WeakPolarHBondContact O-CA 3.47Å; L2583-L2598 HydrophobicContact CB-CD2 4.07Å; L2583-L2598 HydrophobicContact CD1-CD2 3.95Å; L2583-L2598 HydrophobicContact CD1-CG 4.32Å; L2598-F2639 HydrophobicContact CD2-CE1 3.96Å; L2598-F2639 HydrophobicContact CD2-CZ 3.62Å
2599	I	92.3	Very high	88	Confident	29 Å²	29	41.3 Å²	41.3	15%	0.149	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	172.1	-178.1	66.7	169.1	0	0	0	111.4	M2444 Y2581 S2582 L2584 Y2601	M2444-I2599 HydrophobicContact CE-CG2 4.08Å; Y2581-I2599 WeakPolarHBondContact CA-O 3.44Å; S2582-I2599 PolarHBondContact N-O 3.08Å; S2582-I2599 PolarHBondContact O-N 2.67Å; L2584-I2599 HydrophobicContact CB-CD1 4Å; L2584-I2599 HydrophobicContact CB-CG1 4.32Å; L2584-I2599 HydrophobicContact CB-CG2 4.41Å; L2584-I2599 HydrophobicContact CD1-CD1 4.04Å; L2584-I2599 HydrophobicContact CD2-CD1 4.36Å; L2584-I2599 HydrophobicContact CG-CD1 4.35Å; I2599-Y2601 PolarHBondContact O-N 3.33Å
2600	D	89.2	Confident	87.8	Confident	70 Å²	70	45.4 Å²	45.4	37%	0.374	23%	0.226	S	C	.	.			trans	54.5	30	179.8	-78.1	-18.9	0	0	0	115	K2384 L2602	K2384-D2600 IonicContact NZ-OD1 2.93Å; K2384-D2600 PolarHBondContact NZ-OD1 3.27Å; D2600-L2602 VanDerWaalsContact C-N 3.27Å; D2600-L2602 PolarHBondContact O-N 2.98Å
2601	Y	92	Very high	87.6	Confident	11 Å²	11	46.1 Å²	46.1	4%	0.043	23%	0.226	C	C	.	.			trans	-84.2	15.3	178.8	60.5	-99.5	0	0	0	114.6	Y2401 L2417 S2418 I2420 L2573 I2578 I2599 R2603	Y2401-Y2601 HydrophobicContact CD2-CE2 4.44Å; Y2401-Y2601 HydrophobicContact CE2-CE2 4.17Å; L2417-Y2601 HydrophobicContact CD2-CD1 4.26Å; L2417-Y2601 HydrophobicContact CD2-CE1 4.39Å; S2418-Y2601 WeakPolarHBondContact O-CE1 3.49Å; S2418-Y2601 PolarHBondContact O-OH 3.11Å; I2420-Y2601 HydrophobicContact CD1-CE2 4.24Å; L2573-Y2601 HydrophobicContact CD2-CD2 4.34Å; L2573-Y2601 HydrophobicContact CD2-CG 4.39Å; I2578-Y2601 WeakPolarHBondContact CG2-O 3.41Å; I2599-Y2601 PolarHBondContact O-N 3.33Å; Y2601-R2603 PolarHBondContact O-N 3.05Å
2602	L	89.7	Confident	87.3	Confident	8 Å²	8	45.7 Å²	45.7	4%	0.042	22%	0.219	C	C	.	.			trans	-95.8	37.2	178.7	-61.9	-174.6	0	0	0	113.4	L2386 E2390 T2393 F2394 I2397 I2420 L2442 D2600	L2386-L2602 HydrophobicContact CD2-CD1 3.84Å; E2390-L2602 HydrophobicContact CB-CB 3.99Å; E2390-L2602 HydrophobicContact CB-CD1 4.44Å; E2390-L2602 HydrophobicContact CG-CB 4Å; T2393-L2602 WeakPolarHBondContact CB-O 3.43Å; T2393-L2602 PolarHBondContact OG1-O 2.88Å; F2394-L2602 HydrophobicContact CB-CD2 4.39Å; F2394-L2602 HydrophobicContact CD2-CD2 3.92Å; I2397-L2602 HydrophobicContact CD1-CD2 4.22Å; I2420-L2602 HydrophobicContact CD1-CD1 3.95Å; I2420-L2602 HydrophobicContact CD1-CD2 4Å; I2420-L2602 HydrophobicContact CD1-CG 4.33Å; L2442-L2602 HydrophobicContact CD2-CD1 4.08Å; D2600-L2602 VanDerWaalsContact C-N 3.27Å; D2600-L2602 PolarHBondContact O-N 2.98Å
2603	R	85.9	Confident	86.8	Confident	83 Å²	83	44.4 Å²	44.4	31%	0.313	21%	0.212	S	C	.	.			trans	-140	119.3	177	-161.5	161.7	-176.8	176.7	-1.8	113.5	M2579 Y2601 D2608	M2579-R2603 PolarHBondContact N-O 3.28Å; M2579-R2603 VanDerWaalsContact N-O 3.08Å; Y2601-R2603 PolarHBondContact O-N 3.05Å; R2603-D2608 IonicContact NH2-OD2 3.34Å; R2603-D2608 PolarHBondContact NH2-OD2 3.25Å
2604	K	88.2	Confident	86.2	Confident	35 Å²	35	45.5 Å²	45.5	15%	0.152	22%	0.219	C	C	.	.	B	Isolated β-bridge	trans	-81.4	161.7	175.1	-76.9	179.2	-178.1	179.3	0	113.1	T2393 E2396 L2576 F2577 I2578 T2606	T2393-K2604 HydrophobicContact CG2-CD 4.42Å; T2393-K2604 HydrophobicContact CG2-CG 3.96Å; E2396-K2604 VanDerWaalsContact CB-NZ 3.28Å; E2396-K2604 WeakPolarHBondContact OE2-CD 3.43Å; E2396-K2604 IonicContact OE2-NZ 3.8Å; E2396-K2604 PolarHBondContact OE2-NZ 2.92Å; L2576-K2604 WeakPolarHBondContact O-CE 3.42Å; F2577-K2604 CarbonylContact O-C 3.58Å; F2577-K2604 VanDerWaalsContact O-CA 3.32Å; F2577-K2604 WeakPolarHBondContact O-CA 3.17Å; I2578-K2604 HydrophobicContact CG1-CG 4.18Å; K2604-T2606 VanDerWaalsContact C-N 3.32Å; K2604-T2606 HydrophobicContact CB-CG2 4.37Å; K2604-T2606 PolarHBondContact O-N 2.75Å
2605	F	85.7	Confident	85.4	Confident	43 Å²	43	49.3 Å²	49.3	19%	0.189	24%	0.238	C	C	.	.			trans	-77.3	78.5	169.3	-177	-117.9	0	0	0	111.4	F2577 M2579 K2609 R2610 M2613 I2629 T2631 P2632	F2577-F2605 PolarHBondContact O-N 3.48Å; M2579-F2605 HydrophobicContact CG-CB 4.33Å; M2579-F2605 HydrophobicContact SD-CB 3.79Å; M2579-F2605 HydrophobicContact SD-CD2 3.49Å; M2579-F2605 WeakPolarHBondContact SD-CD2 3.49Å; M2579-F2605 HydrophobicContact SD-CE2 4.46Å; M2579-F2605 HydrophobicContact SD-CG 4.04Å; F2605-K2609 HydrophobicContact CD2-CB 3.9Å; F2605-K2609 HydrophobicContact CE2-CB 4.41Å; F2605-R2610 HydrophobicContact CE1-CB 4.46Å; F2605-R2610 HydrophobicContact CE2-CB 4.1Å; F2605-R2610 HydrophobicContact CZ-CB 3.8Å; F2605-R2610 HydrophobicContact CZ-CG 4.03Å; F2605-M2613 HydrophobicContact CE2-SD 4.37Å; F2605-M2613 HydrophobicContact CZ-CE 4.22Å; F2605-M2613 HydrophobicContact CZ-SD 4.35Å; F2605-I2629 HydrophobicContact CE2-CG2 4.49Å; F2605-T2631 HydrophobicContact CE1-CG2 4.1Å; F2605-T2631 HydrophobicContact CZ-CG2 4.26Å; F2605-P2632 HydrophobicContact CB-CG 3.91Å; F2605-P2632 HydrophobicContact CG-CG 4.5Å
2606	T	84	Confident	84.5	Confident	49 Å²	49	51.7 Å²	51.7	30%	0.301	25%	0.248	S	C	.	.			trans	-85.9	174.7	177.5	42.2	0	0	0	0	112.7	K2604 D2608 K2609 R2610	K2604-T2606 VanDerWaalsContact C-N 3.32Å; K2604-T2606 HydrophobicContact CB-CG2 4.37Å; K2604-T2606 PolarHBondContact O-N 2.75Å; T2606-D2608 VanDerWaalsContact C-N 3.31Å; T2606-D2608 WeakPolarHBondContact CB-OD1 3.48Å; T2606-D2608 PolarHBondContact O-N 3.3Å; T2606-D2608 PolarHBondContact OG1-OD1 3.41Å; T2606-K2609 CarbonylContact O-C 3.41Å; T2606-K2609 WeakPolarHBondContact O-CA 3.37Å; T2606-K2609 WeakPolarHBondContact O-CB 3.04Å; T2606-K2609 PolarHBondContact O-N 2.97Å; T2606-R2610 PolarHBondContact O-N 3.37Å
2607	L	83.6	Confident	83.3	Confident	140 Å²	140	56.8 Å²	56.8	73%	0.733	27%	0.272	S	S	*	.	H	α-helix	trans	-62.9	-33	-178.7	-71.4	177	0	0	0	113.4	K2609 R2610 L2611	L2607-K2609 VanDerWaalsContact C-N 3.33Å; L2607-R2610 PolarHBondContact O-N 3.2Å; L2607-L2611 WeakPolarHBondContact O-CB 3.3Å; L2607-L2611 PolarHBondContact O-N 3.05Å
2608	D	78.6	Confident	82.2	Confident	72 Å²	72	62.1 Å²	62.1	39%	0.385	31%	0.305	S	S	.	.	H	α-helix	trans	-62.8	-38.8	170.2	63.8	-63.4	0	0	0	111.4	R2603 T2606 L2611 E2612	R2603-D2608 IonicContact NH2-OD2 3.34Å; R2603-D2608 PolarHBondContact NH2-OD2 3.25Å; T2606-D2608 VanDerWaalsContact C-N 3.31Å; T2606-D2608 WeakPolarHBondContact CB-OD1 3.48Å; T2606-D2608 PolarHBondContact O-N 3.3Å; T2606-D2608 PolarHBondContact OG1-OD1 3.41Å; D2608-L2611 PolarHBondContact O-N 2.87Å; D2608-E2612 VanDerWaalsContact O-CB 3.32Å; D2608-E2612 WeakPolarHBondContact O-CB 3.32Å; D2608-E2612 PolarHBondContact O-N 2.78Å
2609	K	81.4	Confident	80.7	Confident	4 Å²	4	68.3 Å²	68.3	2%	0.017	34%	0.337	C	S	.	.	H	α-helix	trans	-70.3	-36.5	174.7	-78.5	-72.9	172.8	-170.5	0	112.6	D2580 F2605 T2606 L2607 L2611 E2612 M2613 I2629	D2580-K2609 IonicContact OD2-NZ 2.61Å; D2580-K2609 PolarHBondContact OD2-NZ 3.47Å; F2605-K2609 HydrophobicContact CD2-CB 3.9Å; F2605-K2609 HydrophobicContact CE2-CB 4.41Å; T2606-K2609 CarbonylContact O-C 3.41Å; T2606-K2609 WeakPolarHBondContact O-CA 3.37Å; T2606-K2609 WeakPolarHBondContact O-CB 3.04Å; T2606-K2609 PolarHBondContact O-N 2.97Å; L2607-K2609 VanDerWaalsContact C-N 3.33Å; K2609-L2611 VanDerWaalsContact C-N 3.33Å; K2609-E2612 WeakPolarHBondContact CD-OE2 3.37Å; K2609-E2612 WeakPolarHBondContact CE-OE2 3.06Å; K2609-E2612 IonicContact NZ-OE2 3.94Å; K2609-E2612 PolarHBondContact NZ-OE2 3.2Å; K2609-E2612 PolarHBondContact O-N 2.91Å; K2609-M2613 WeakPolarHBondContact O-CB 3.37Å; K2609-M2613 PolarHBondContact O-N 3.45Å; K2609-I2629 HydrophobicContact CB-CG2 4.39Å; K2609-I2629 HydrophobicContact CD-CD1 3.74Å; K2609-I2629 HydrophobicContact CD-CG1 4.23Å; K2609-I2629 HydrophobicContact CD-CG2 4.1Å; K2609-I2629 WeakPolarHBondContact O-CG2 3.37Å
2610	R	79.9	Confident	78.8	Confident	143 Å²	143	67.8 Å²	67.8	54%	0.54	34%	0.335	S	S	.	.	H	α-helix	trans	-63.9	-39.2	171.4	-172.7	174.4	178.5	169.5	-0.7	111.3	F2605 T2606 L2607 M2613 I2614	F2605-R2610 HydrophobicContact CE1-CB 4.46Å; F2605-R2610 HydrophobicContact CE2-CB 4.1Å; F2605-R2610 HydrophobicContact CZ-CB 3.8Å; F2605-R2610 HydrophobicContact CZ-CG 4.03Å; T2606-R2610 PolarHBondContact O-N 3.37Å; L2607-R2610 PolarHBondContact O-N 3.2Å; R2610-M2613 HydrophobicContact CG-CE 4.41Å; R2610-M2613 WeakPolarHBondContact O-CB 3.35Å; R2610-I2614 HydrophobicContact CG-CD1 4.28Å; R2610-I2614 WeakPolarHBondContact O-CD1 3.36Å; R2610-I2614 VanDerWaalsContact O-CG1 3.27Å; R2610-I2614 WeakPolarHBondContact O-CG1 3.23Å; R2610-I2614 PolarHBondContact O-N 2.72Å
2611	L	81.7	Confident	77	Confident	97 Å²	97	67.8 Å²	67.8	51%	0.508	34%	0.34	S	S	.	.	H	α-helix	trans	-69.2	-42.2	173.6	-176.1	61.6	0	0	0	111.8	L2607 D2608 K2609 M2613 I2614 I2615	L2607-L2611 WeakPolarHBondContact O-CB 3.3Å; L2607-L2611 PolarHBondContact O-N 3.05Å; D2608-L2611 PolarHBondContact O-N 2.87Å; K2609-L2611 VanDerWaalsContact C-N 3.33Å; L2611-M2613 VanDerWaalsContact C-N 3.29Å; L2611-M2613 PolarHBondContact O-N 2.79Å; L2611-I2614 PolarHBondContact O-N 3.47Å; L2611-I2615 HydrophobicContact CD1-CD1 4.06Å; L2611-I2615 HydrophobicContact CD1-CG1 4.24Å; L2611-I2615 HydrophobicContact CD2-CD1 4.47Å; L2611-I2615 HydrophobicContact CG-CD1 3.81Å; L2611-I2615 HydrophobicContact CG-CG1 4.4Å; L2611-I2615 WeakPolarHBondContact O-CB 3.43Å; L2611-I2615 VanDerWaalsContact O-CG1 3.31Å; L2611-I2615 WeakPolarHBondContact O-CG1 3.33Å; L2611-I2615 PolarHBondContact O-N 2.58Å
2612	E	77.6	Confident	75	Confident	60 Å²	60	70 Å²	70	28%	0.28	36%	0.36	S	S	.	.	H	α-helix	trans	-62	-36.9	175.4	-161.3	-169.8	161.4	0	0	111.3	D2608 K2609 K2616 I2629	D2608-E2612 VanDerWaalsContact O-CB 3.32Å; D2608-E2612 WeakPolarHBondContact O-CB 3.32Å; D2608-E2612 PolarHBondContact O-N 2.78Å; K2609-E2612 WeakPolarHBondContact CD-OE2 3.37Å; K2609-E2612 WeakPolarHBondContact CE-OE2 3.06Å; K2609-E2612 IonicContact NZ-OE2 3.94Å; K2609-E2612 PolarHBondContact NZ-OE2 3.2Å; K2609-E2612 PolarHBondContact O-N 2.91Å; E2612-K2616 HydrophobicContact CG-CD 4.23Å; E2612-K2616 VanDerWaalsContact O-CB 3.22Å; E2612-K2616 WeakPolarHBondContact O-CB 3.49Å; E2612-K2616 VanDerWaalsContact O-CG 3.22Å; E2612-K2616 WeakPolarHBondContact O-CG 3.44Å; E2612-K2616 PolarHBondContact O-N 2.98Å; E2612-K2616 VanDerWaalsContact OE1-CE 3.22Å; E2612-K2616 WeakPolarHBondContact OE1-CE 3.5Å; E2612-K2616 IonicContact OE1-NZ 3.77Å; E2612-K2616 PolarHBondContact OE1-NZ 2.95Å; E2612-I2629 HydrophobicContact CB-CD1 4.11Å; E2612-I2629 HydrophobicContact CG-CD1 3.77Å; E2612-I2629 VanDerWaalsContact OE1-CD1 3.23Å; E2612-I2629 WeakPolarHBondContact OE1-CD1 3.36Å; E2612-I2629 WeakPolarHBondContact OE2-CD1 3.46Å
2613	M	78	Confident	72.8	Confident	28 Å²	28	73.1 Å²	73.1	14%	0.138	38%	0.375	C	S	.	.	H	α-helix	trans	-62.5	-52.6	170.4	179.6	-177.8	77.9	0	0	111.3	F2605 K2609 R2610 L2611 I2615 K2616 Q2617 I2629	F2605-M2613 HydrophobicContact CE2-SD 4.37Å; F2605-M2613 HydrophobicContact CZ-CE 4.22Å; F2605-M2613 HydrophobicContact CZ-SD 4.35Å; K2609-M2613 WeakPolarHBondContact O-CB 3.37Å; K2609-M2613 PolarHBondContact O-N 3.45Å; R2610-M2613 HydrophobicContact CG-CE 4.41Å; R2610-M2613 WeakPolarHBondContact O-CB 3.35Å; L2611-M2613 VanDerWaalsContact C-N 3.29Å; L2611-M2613 PolarHBondContact O-N 2.79Å; M2613-I2615 PolarHBondContact O-N 2.83Å; M2613-K2616 PolarHBondContact O-N 3.03Å; M2613-Q2617 VanDerWaalsContact O-CB 3.26Å; M2613-Q2617 WeakPolarHBondContact O-CB 3.27Å; M2613-Q2617 PolarHBondContact O-N 2.97Å; M2613-I2629 HydrophobicContact CB-CB 4.47Å; M2613-I2629 HydrophobicContact CB-CG2 3.91Å; M2613-I2629 WeakPolarHBondContact CG-O 3.42Å
2614	I	77.3	Confident	71.1	Confident	76 Å²	76	70.4 Å²	70.4	39%	0.39	37%	0.373	S	S	.	.	H	α-helix	trans	-58.3	-48.8	179	-69.9	162.5	0	0	0	110.3	R2610 L2611 K2616 Q2617 T2618	R2610-I2614 HydrophobicContact CG-CD1 4.28Å; R2610-I2614 WeakPolarHBondContact O-CD1 3.36Å; R2610-I2614 VanDerWaalsContact O-CG1 3.27Å; R2610-I2614 WeakPolarHBondContact O-CG1 3.23Å; R2610-I2614 PolarHBondContact O-N 2.72Å; L2611-I2614 PolarHBondContact O-N 3.47Å; I2614-K2616 PolarHBondContact O-N 2.96Å; I2614-Q2617 CarbonylContact O-C 3.58Å; I2614-Q2617 PolarHBondContact O-N 2.61Å; I2614-Q2617 VanDerWaalsContact O-N 3.15Å; I2614-T2618 WeakPolarHBondContact O-CB 3.35Å; I2614-T2618 PolarHBondContact O-N 2.83Å; I2614-T2618 PolarHBondContact O-OG1 2.82Å
2615	I	76.7	Confident	69.5	Low	80 Å²	80	72.8 Å²	72.8	41%	0.41	39%	0.392	S	S	.	.	H	α-helix	trans	-60.6	-47.4	178	-69.5	170.6	0	0	0	111	L2611 M2613 Q2617 T2618 I2619	L2611-I2615 HydrophobicContact CD1-CD1 4.06Å; L2611-I2615 HydrophobicContact CD1-CG1 4.24Å; L2611-I2615 HydrophobicContact CD2-CD1 4.47Å; L2611-I2615 HydrophobicContact CG-CD1 3.81Å; L2611-I2615 HydrophobicContact CG-CG1 4.4Å; L2611-I2615 WeakPolarHBondContact O-CB 3.43Å; L2611-I2615 VanDerWaalsContact O-CG1 3.31Å; L2611-I2615 WeakPolarHBondContact O-CG1 3.33Å; L2611-I2615 PolarHBondContact O-N 2.58Å; M2613-I2615 PolarHBondContact O-N 2.83Å; I2615-Q2617 VanDerWaalsContact C-N 3.28Å; I2615-Q2617 PolarHBondContact O-N 2.62Å; I2615-T2618 PolarHBondContact O-N 2.91Å; I2615-I2619 HydrophobicContact CG2-CD1 3.57Å; I2615-I2619 HydrophobicContact CG2-CG1 4.31Å; I2615-I2619 WeakPolarHBondContact O-CB 3.47Å; I2615-I2619 VanDerWaalsContact O-CG1 3.3Å; I2615-I2619 WeakPolarHBondContact O-CG1 3.5Å; I2615-I2619 PolarHBondContact O-N 2.79Å
2616	K	71.7	Confident	68.2	Low	54 Å²	54	76.5 Å²	76.5	24%	0.235	41%	0.411	C	S	.	.	H	α-helix	trans	-62.8	-34.4	176.2	-77.6	172.5	174.3	174.3	0	112.1	E2612 M2613 I2614 T2620 P2627 I2629	E2612-K2616 HydrophobicContact CG-CD 4.23Å; E2612-K2616 VanDerWaalsContact O-CB 3.22Å; E2612-K2616 WeakPolarHBondContact O-CB 3.49Å; E2612-K2616 VanDerWaalsContact O-CG 3.22Å; E2612-K2616 WeakPolarHBondContact O-CG 3.44Å; E2612-K2616 PolarHBondContact O-N 2.98Å; E2612-K2616 VanDerWaalsContact OE1-CE 3.22Å; E2612-K2616 WeakPolarHBondContact OE1-CE 3.5Å; E2612-K2616 IonicContact OE1-NZ 3.77Å; E2612-K2616 PolarHBondContact OE1-NZ 2.95Å; M2613-K2616 PolarHBondContact O-N 3.03Å; I2614-K2616 PolarHBondContact O-N 2.96Å; K2616-T2620 WeakPolarHBondContact O-CB 3.24Å; K2616-T2620 PolarHBondContact O-OG1 2.89Å; K2616-P2627 HydrophobicContact CB-CB 4Å; K2616-I2629 HydrophobicContact CD-CD1 4.31Å
2617	Q	69.1	Low	67.3	Low	111 Å²	111	74.9 Å²	74.9	52%	0.519	40%	0.401	S	S	.	.	H	α-helix	trans	-73.2	-39.7	176.1	-169.4	171.9	1.2	0	0	111.7	M2613 I2614 I2615 T2620	M2613-Q2617 VanDerWaalsContact O-CB 3.26Å; M2613-Q2617 WeakPolarHBondContact O-CB 3.27Å; M2613-Q2617 PolarHBondContact O-N 2.97Å; I2614-Q2617 CarbonylContact O-C 3.58Å; I2614-Q2617 PolarHBondContact O-N 2.61Å; I2614-Q2617 VanDerWaalsContact O-N 3.15Å; I2615-Q2617 VanDerWaalsContact C-N 3.28Å; I2615-Q2617 PolarHBondContact O-N 2.62Å; Q2617-T2620 CarbonylContact O-C 3.23Å; Q2617-T2620 PolarHBondContact O-N 2.75Å
2618	T	69	Low	66.5	Low	112 Å²	112	69.3 Å²	69.3	69%	0.687	37%	0.373	S	S	*	.	H	α-helix	trans	-74.4	-39.2	-179.7	-57.9	0	0	0	0	113.4	I2614 I2615 T2620	I2614-T2618 WeakPolarHBondContact O-CB 3.35Å; I2614-T2618 PolarHBondContact O-N 2.83Å; I2614-T2618 PolarHBondContact O-OG1 2.82Å; I2615-T2618 PolarHBondContact O-N 2.91Å; T2618-T2620 PolarHBondContact O-N 2.86Å; T2618-T2620 VanDerWaalsContact O-N 3.15Å
2619	I	64	Low	66.2	Low	130 Å²	130	65.9 Å²	65.9	67%	0.667	36%	0.355	S	S	*	.	S	Bend	trans	-62.8	-18.1	172.2	-69.5	172.4	0	0	0	111.3	I2615	I2615-I2619 HydrophobicContact CG2-CD1 3.57Å; I2615-I2619 HydrophobicContact CG2-CG1 4.31Å; I2615-I2619 WeakPolarHBondContact O-CB 3.47Å; I2615-I2619 VanDerWaalsContact O-CG1 3.3Å; I2615-I2619 WeakPolarHBondContact O-CG1 3.5Å; I2615-I2619 PolarHBondContact O-N 2.79Å
2620	T	52	Low	66.1	Low	18 Å²	18	66.4 Å²	66.4	11%	0.11	36%	0.358	C	S	.	.	S	Bend	trans	-100.7	112.5	-179.9	-50.1	0	0	0	0	109.8	R2465 K2616 Q2617 T2618 A2622	R2465-T2620 VanDerWaalsContact CZ-OG1 3.23Å; R2465-T2620 PolarHBondContact NH1-OG1 3.07Å; R2465-T2620 PolarHBondContact NH2-OG1 3.36Å; K2616-T2620 WeakPolarHBondContact O-CB 3.24Å; K2616-T2620 PolarHBondContact O-OG1 2.89Å; Q2617-T2620 CarbonylContact O-C 3.23Å; Q2617-T2620 PolarHBondContact O-N 2.75Å; T2618-T2620 PolarHBondContact O-N 2.86Å; T2618-T2620 VanDerWaalsContact O-N 3.15Å; T2620-A2622 PolarHBondContact O-N 3.02Å
2621	S	50	Low	66.4	Low	69 Å²	69	62 Å²	62	48%	0.483	35%	0.347	S	S	.	.			trans	-55.5	123.4	165.9	72.6	0	0	0	0	108	K111 Q2623 G2624	K111-S2621 PolarHBondContact NZ-OG 2.84Å; K111-S2621 VanDerWaalsContact NZ-OG 3.1Å; S2621-Q2623 PolarHBondContact O-N 2.81Å; S2621-G2624 PolarHBondContact O-N 2.94Å
2622	A	50.2	Low	66.7	Low	57 Å²	57	57.6 Å²	57.6	47%	0.471	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-21.5	-148.9	0	0	0	0	0	117.9	E108 T2620 G2624	E108-A2622 HydrophobicContact CB-CB 4.01Å; E108-A2622 HydrophobicContact CG-CB 3.69Å; E108-A2622 WeakPolarHBondContact OE1-CB 3.19Å; T2620-A2622 PolarHBondContact O-N 3.02Å; A2622-G2624 PolarHBondContact O-N 3.15Å
2623	Q	43.9	Very low	67.3	Low	75 Å²	75	59.1 Å²	59.1	35%	0.35	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-25.8	167.7	-50.3	-175.1	-105.6	0	0	116.5	E108 N109 S2621	E108-Q2623 HydrophobicContact CB-CG 4.37Å; E108-Q2623 WeakPolarHBondContact O-CG 3.38Å; N109-Q2623 WeakPolarHBondContact OD1-CG 3.09Å; N109-Q2623 PolarHBondContact OD1-NE2 2.76Å; S2621-Q2623 PolarHBondContact O-N 2.81Å
2624	G	50	Low	67.8	Low	26 Å²	26	62 Å²	62	27%	0.268	35%	0.349	S	S	.	.	S	Bend	trans	-70.4	164.4	-165.4	0	0	0	0	0	113.4	S2621 A2622 M2626	S2621-G2624 PolarHBondContact O-N 2.94Å; A2622-G2624 PolarHBondContact O-N 3.15Å; G2624-M2626 PolarHBondContact O-N 3.44Å
2625	P	56	Low	68.5	Low	84 Å²	84	58.3 Å²	58.3	55%	0.545	33%	0.331	S	S	.	.	S	Bend	trans	-56.1	131	-173.1	23.2	-34.2	0	0	0	111.1	R2465	R2465-P2625 HydrophobicContact CB-CB 4.26Å; R2465-P2625 HydrophobicContact CB-CG 4.23Å; R2465-P2625 HydrophobicContact CG-CG 4.07Å; R2465-P2625 PolarHBondContact NH1-O 3.37Å
2626	M	58.4	Low	69.3	Low	122 Å²	122	56.8 Å²	56.8	60%	0.601	32%	0.32	S	S	*	.			trans	-43	142	-170.2	-96.8	-165.1	166.2	0	0	112.7	G2624 T2628 L2630	G2624-M2626 PolarHBondContact O-N 3.44Å; M2626-T2628 PolarHBondContact O-N 3.47Å; M2626-L2630 HydrophobicContact SD-CD1 4.23Å
2627	P	64.9	Low	70.2	Confident	14 Å²	14	59.9 Å²	59.9	9%	0.091	34%	0.335	C	S	.	.			trans	-58.2	136.5	177.7	27.1	-34.2	0	0	0	109.3	K2616 I2629 L2630 R2638	K2616-P2627 HydrophobicContact CB-CB 4Å; P2627-I2629 WeakPolarHBondContact CB-O 3.42Å; P2627-I2629 PolarHBondContact O-N 3.33Å; P2627-L2630 HydrophobicContact CG-CD2 3.83Å; P2627-R2638 PolarHBondContact O-NH1 3.16Å
2628	T	66.6	Low	71.1	Confident	23 Å²	23	56 Å²	56	14%	0.141	32%	0.316	C	S	.	.	S	Bend	trans	-56.7	-27.4	-178.9	-40.9	0	0	0	0	111.7	M2626 Y2635 R2638	M2626-T2628 PolarHBondContact O-N 3.47Å; T2628-Y2635 WeakPolarHBondContact O-CD2 3.27Å; T2628-Y2635 VanDerWaalsContact O-CE2 3.25Å; T2628-Y2635 WeakPolarHBondContact O-CE2 3.49Å; T2628-R2638 PolarHBondContact O-NH1 2.82Å; T2628-R2638 PolarHBondContact O-NH2 2.88Å
2629	I	71	Confident	72.3	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	28%	0.283	C	S	.	.			trans	-108.2	131.2	-179.4	-65.4	159.2	0	0	0	107.7	M2579 F2605 K2609 E2612 M2613 K2616 P2627	M2579-I2629 HydrophobicContact CE-CB 3.91Å; M2579-I2629 HydrophobicContact CE-CG1 4.18Å; M2579-I2629 HydrophobicContact CE-CG2 3.51Å; M2579-I2629 HydrophobicContact SD-CG2 3.98Å; F2605-I2629 HydrophobicContact CE2-CG2 4.49Å; K2609-I2629 HydrophobicContact CB-CG2 4.39Å; K2609-I2629 HydrophobicContact CD-CD1 3.74Å; K2609-I2629 HydrophobicContact CD-CG1 4.23Å; K2609-I2629 HydrophobicContact CD-CG2 4.1Å; K2609-I2629 WeakPolarHBondContact O-CG2 3.37Å; E2612-I2629 HydrophobicContact CB-CD1 4.11Å; E2612-I2629 HydrophobicContact CG-CD1 3.77Å; E2612-I2629 VanDerWaalsContact OE1-CD1 3.23Å; E2612-I2629 WeakPolarHBondContact OE1-CD1 3.36Å; E2612-I2629 WeakPolarHBondContact OE2-CD1 3.46Å; M2613-I2629 HydrophobicContact CB-CB 4.47Å; M2613-I2629 HydrophobicContact CB-CG2 3.91Å; M2613-I2629 WeakPolarHBondContact CG-O 3.42Å; K2616-I2629 HydrophobicContact CD-CD1 4.31Å; P2627-I2629 WeakPolarHBondContact CB-O 3.42Å; P2627-I2629 PolarHBondContact O-N 3.33Å
2630	L	81	Confident	73.7	Confident	16 Å²	16	45.8 Å²	45.8	8%	0.084	26%	0.258	C	S	.	.			trans	-138.1	-179.7	179.2	-66.6	170.9	0	0	0	107.5	M2579 M2626 P2627 L2634 R2638	M2579-L2630 WeakPolarHBondContact CE-O 3.5Å; M2626-L2630 HydrophobicContact SD-CD1 4.23Å; P2627-L2630 HydrophobicContact CG-CD2 3.83Å; L2630-L2634 HydrophobicContact CB-CB 3.92Å; L2630-L2634 HydrophobicContact CD1-CB 4.14Å; L2630-R2638 HydrophobicContact CD1-CB 4.31Å
2631	T	84.8	Confident	75.4	Confident	50 Å²	50	53.4 Å²	53.4	31%	0.307	29%	0.286	S	S	.	.			trans	-62.2	156.1	163.5	55.2	0	0	0	0	110.7	F2605 D2633 L2634 Y2635	F2605-T2631 HydrophobicContact CE1-CG2 4.1Å; F2605-T2631 HydrophobicContact CZ-CG2 4.26Å; T2631-D2633 VanDerWaalsContact C-N 3.33Å; T2631-D2633 PolarHBondContact O-N 2.92Å; T2631-L2634 PolarHBondContact O-N 2.64Å; T2631-L2634 VanDerWaalsContact O-N 3.16Å; T2631-L2634 WeakPolarHBondContact OG1-CD1 3.44Å; T2631-L2634 WeakPolarHBondContact OG1-CG 3.39Å; T2631-Y2635 WeakPolarHBondContact O-CB 3.13Å; T2631-Y2635 PolarHBondContact O-N 2.9Å
2632	P	88.4	Confident	77.2	Confident	4 Å²	4	51.3 Å²	51.3	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-52.9	-43.8	-175.6	-29.4	36.3	0	0	0	114.4	A2574 F2577 F2605 Y2635 R2636	A2574-P2632 HydrophobicContact CB-CB 4.35Å; F2577-P2632 HydrophobicContact CB-CG 4.16Å; F2577-P2632 HydrophobicContact CD1-CG 4.12Å; F2605-P2632 HydrophobicContact CB-CG 3.91Å; F2605-P2632 HydrophobicContact CG-CG 4.5Å; P2632-Y2635 PolarHBondContact O-N 2.72Å; P2632-R2636 VanDerWaalsContact O-CB 3.3Å; P2632-R2636 WeakPolarHBondContact O-CB 3.31Å; P2632-R2636 PolarHBondContact O-N 2.84Å
2633	D	89.5	Confident	79.1	Confident	93 Å²	93	48.7 Å²	48.7	50%	0.497	25%	0.247	S	C	.	.	H	α-helix	trans	-63.9	-46.9	177.4	-55.8	-74.6	0	0	0	112.8	T2631 Y2635 R2636 E2637	T2631-D2633 VanDerWaalsContact C-N 3.33Å; T2631-D2633 PolarHBondContact O-N 2.92Å; D2633-Y2635 VanDerWaalsContact C-N 3.33Å; D2633-Y2635 PolarHBondContact O-N 2.82Å; D2633-R2636 WeakPolarHBondContact O-CB 3.41Å; D2633-R2636 PolarHBondContact O-N 3.05Å; D2633-E2637 WeakPolarHBondContact O-CG 3.4Å; D2633-E2637 PolarHBondContact O-N 3.39Å
2634	L	88.8	Confident	81.2	Confident	87 Å²	87	50.9 Å²	50.9	46%	0.455	26%	0.257	S	S	.	.	H	α-helix	trans	-69.4	-32.2	178.8	-67.2	178.8	0	0	0	111.9	L2630 T2631 R2638	L2630-L2634 HydrophobicContact CB-CB 3.92Å; L2630-L2634 HydrophobicContact CD1-CB 4.14Å; T2631-L2634 PolarHBondContact O-N 2.64Å; T2631-L2634 VanDerWaalsContact O-N 3.16Å; T2631-L2634 WeakPolarHBondContact OG1-CD1 3.44Å; T2631-L2634 WeakPolarHBondContact OG1-CG 3.39Å; L2634-R2638 VanDerWaalsContact O-CB 3.3Å; L2634-R2638 WeakPolarHBondContact O-CB 3.46Å; L2634-R2638 PolarHBondContact O-N 2.84Å
2635	Y	92.2	Very high	82.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-49.4	170.5	-172.2	-79.4	0	0	0	110	M2579 D2580 Y2581 T2628 T2631 P2632 D2633 R2638 F2639	M2579-Y2635 HydrophobicContact CB-CD1 4.44Å; M2579-Y2635 HydrophobicContact CB-CD2 4.37Å; M2579-Y2635 HydrophobicContact CB-CG 4.15Å; M2579-Y2635 HydrophobicContact CE-CD2 3.57Å; M2579-Y2635 HydrophobicContact CE-CE2 4.24Å; M2579-Y2635 HydrophobicContact CE-CG 4.19Å; D2580-Y2635 VanDerWaalsContact CA-CZ 3.5Å; D2580-Y2635 WeakPolarHBondContact CA-OH 3.26Å; Y2581-Y2635 HydrophobicContact CD1-CE1 4.25Å; Y2581-Y2635 HydrophobicContact CD2-CE1 4.1Å; Y2581-Y2635 AromaticContact CE1-CD1 3.97Å; Y2581-Y2635 HydrophobicContact CE1-CD1 3.97Å; Y2581-Y2635 HydrophobicContact CE1-CE1 4.01Å; Y2581-Y2635 HydrophobicContact CE2-CD1 4.26Å; Y2581-Y2635 AromaticContact CE2-CE1 3.83Å; Y2581-Y2635 HydrophobicContact CE2-CE1 3.83Å; Y2581-Y2635 HydrophobicContact CG-CE1 4.3Å; Y2581-Y2635 AromaticContact CZ-CD1 3.78Å; Y2581-Y2635 AromaticContact CZ-CE1 3.79Å; Y2581-Y2635 PolarHBondContact O-OH 3.47Å; T2628-Y2635 WeakPolarHBondContact O-CD2 3.27Å; T2628-Y2635 VanDerWaalsContact O-CE2 3.25Å; T2628-Y2635 WeakPolarHBondContact O-CE2 3.49Å; T2631-Y2635 WeakPolarHBondContact O-CB 3.13Å; T2631-Y2635 PolarHBondContact O-N 2.9Å; P2632-Y2635 PolarHBondContact O-N 2.72Å; D2633-Y2635 VanDerWaalsContact C-N 3.33Å; D2633-Y2635 PolarHBondContact O-N 2.82Å; Y2635-R2638 VanDerWaalsContact CE2-NH2 3.26Å; Y2635-R2638 PolarHBondContact O-N 3.16Å; Y2635-F2639 HydrophobicContact CD1-CB 4.44Å; Y2635-F2639 HydrophobicContact CE1-CB 4.32Å; Y2635-F2639 HydrophobicContact CE1-CD2 4.06Å; Y2635-F2639 HydrophobicContact CE1-CG 4.43Å; Y2635-F2639 WeakPolarHBondContact O-CB 3.22Å; Y2635-F2639 PolarHBondContact O-N 3Å
2636	R	93.5	Very high	84.4	Confident	48 Å²	48	49.2 Å²	49.2	18%	0.181	24%	0.242	C	C	.	.	H	α-helix	trans	-58.2	-48.1	176.7	169.7	178.7	-178.1	-81.9	-8.2	112.1	N2567 T2570 A2574 P2632 D2633 F2639 L2640	N2567-R2636 PolarHBondContact O-NH2 3.32Å; N2567-R2636 PolarHBondContact OD1-NH2 3.16Å; T2570-R2636 WeakPolarHBondContact O-CD 3.44Å; T2570-R2636 PolarHBondContact OG1-NE 3.19Å; A2574-R2636 HydrophobicContact CB-CB 4.41Å; P2632-R2636 VanDerWaalsContact O-CB 3.3Å; P2632-R2636 WeakPolarHBondContact O-CB 3.31Å; P2632-R2636 PolarHBondContact O-N 2.84Å; D2633-R2636 WeakPolarHBondContact O-CB 3.41Å; D2633-R2636 PolarHBondContact O-N 3.05Å; R2636-F2639 PolarHBondContact O-N 3.07Å; R2636-L2640 HydrophobicContact CG-CD1 3.76Å; R2636-L2640 HydrophobicContact CG-CG 4.36Å; R2636-L2640 WeakPolarHBondContact O-CB 3.42Å; R2636-L2640 VanDerWaalsContact O-CG 3.26Å; R2636-L2640 WeakPolarHBondContact O-CG 3.33Å; R2636-L2640 PolarHBondContact O-N 3.23Å
2637	E	90	Very high	86	Confident	119 Å²	119	43.5 Å²	43.5	56%	0.556	21%	0.214	S	C	*	.	H	α-helix	trans	-62.1	-47.5	178.8	-74.5	-173.2	159.7	0	0	111.8	D2633 F2639 L2640 Y2641	D2633-E2637 WeakPolarHBondContact O-CG 3.4Å; D2633-E2637 PolarHBondContact O-N 3.39Å; E2637-F2639 PolarHBondContact O-N 3.38Å; E2637-L2640 PolarHBondContact O-N 3.14Å; E2637-Y2641 VanDerWaalsContact O-CB 3.23Å; E2637-Y2641 WeakPolarHBondContact O-CB 3.3Å; E2637-Y2641 PolarHBondContact O-N 3.44Å
2638	R	89.5	Confident	87.1	Confident	30 Å²	30	43.9 Å²	43.9	11%	0.113	22%	0.216	C	C	.	.	H	α-helix	trans	-59.7	-45.4	175.7	-168.8	-165	77	-138.2	-6	111.6	K2461 G2462 P2627 T2628 L2630 L2634 Y2635 Q2642	K2461-R2638 PolarHBondContact O-NH2 3.36Å; G2462-R2638 WeakPolarHBondContact O-CD 3.22Å; G2462-R2638 PolarHBondContact O-NE 2.83Å; P2627-R2638 PolarHBondContact O-NH1 3.16Å; T2628-R2638 PolarHBondContact O-NH1 2.82Å; T2628-R2638 PolarHBondContact O-NH2 2.88Å; L2630-R2638 HydrophobicContact CD1-CB 4.31Å; L2634-R2638 VanDerWaalsContact O-CB 3.3Å; L2634-R2638 WeakPolarHBondContact O-CB 3.46Å; L2634-R2638 PolarHBondContact O-N 2.84Å; Y2635-R2638 VanDerWaalsContact CE2-NH2 3.26Å; Y2635-R2638 PolarHBondContact O-N 3.16Å; R2638-Q2642 VanDerWaalsContact O-CB 3.27Å; R2638-Q2642 WeakPolarHBondContact O-CB 3.32Å; R2638-Q2642 PolarHBondContact O-N 3.35Å
2639	F	94.1	Very high	88.2	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.2	-51.5	179.9	-176	-93.6	0	0	0	111.3	L2566 T2570 Y2581 L2583 L2598 Y2635 R2636 E2637 Y2641 Q2642 L2643	L2566-F2639 HydrophobicContact CD2-CE1 4.22Å; T2570-F2639 HydrophobicContact CG2-CD1 4.02Å; T2570-F2639 HydrophobicContact CG2-CE1 3.98Å; Y2581-F2639 HydrophobicContact CD2-CD2 4.29Å; Y2581-F2639 HydrophobicContact CD2-CE1 4.08Å; Y2581-F2639 AromaticContact CD2-CE2 3.84Å; Y2581-F2639 HydrophobicContact CD2-CE2 3.84Å; Y2581-F2639 AromaticContact CD2-CZ 3.72Å; Y2581-F2639 HydrophobicContact CD2-CZ 3.72Å; Y2581-F2639 AromaticContact CE2-CD1 3.71Å; Y2581-F2639 HydrophobicContact CE2-CD1 3.71Å; Y2581-F2639 AromaticContact CE2-CD2 3.97Å; Y2581-F2639 HydrophobicContact CE2-CD2 3.97Å; Y2581-F2639 AromaticContact CE2-CE1 3.61Å; Y2581-F2639 HydrophobicContact CE2-CE1 3.61Å; Y2581-F2639 AromaticContact CE2-CE2 3.91Å; Y2581-F2639 HydrophobicContact CE2-CE2 3.91Å; Y2581-F2639 AromaticContact CE2-CG 3.87Å; Y2581-F2639 HydrophobicContact CE2-CG 3.87Å; Y2581-F2639 AromaticContact CE2-CZ 3.72Å; Y2581-F2639 HydrophobicContact CE2-CZ 3.72Å; L2583-F2639 HydrophobicContact CB-CZ 4.04Å; L2598-F2639 HydrophobicContact CD2-CE1 3.96Å; L2598-F2639 HydrophobicContact CD2-CZ 3.62Å; Y2635-F2639 HydrophobicContact CD1-CB 4.44Å; Y2635-F2639 HydrophobicContact CE1-CB 4.32Å; Y2635-F2639 HydrophobicContact CE1-CD2 4.06Å; Y2635-F2639 HydrophobicContact CE1-CG 4.43Å; Y2635-F2639 WeakPolarHBondContact O-CB 3.22Å; Y2635-F2639 PolarHBondContact O-N 3Å; R2636-F2639 PolarHBondContact O-N 3.07Å; E2637-F2639 PolarHBondContact O-N 3.38Å; F2639-Y2641 PolarHBondContact O-N 3.01Å; F2639-Q2642 PolarHBondContact O-N 3.01Å; F2639-L2643 HydrophobicContact CD1-CD1 3.7Å; F2639-L2643 HydrophobicContact CD1-CG 4.33Å; F2639-L2643 HydrophobicContact CE1-CD1 3.25Å; F2639-L2643 HydrophobicContact CE1-CG 4.26Å; F2639-L2643 HydrophobicContact CE2-CD1 4.22Å; F2639-L2643 HydrophobicContact CG-CD1 4.37Å; F2639-L2643 HydrophobicContact CZ-CD1 3.55Å; F2639-L2643 HydrophobicContact CZ-CG 4.44Å; F2639-L2643 WeakPolarHBondContact O-CB 3.39Å; F2639-L2643 VanDerWaalsContact O-CG 3.31Å; F2639-L2643 WeakPolarHBondContact O-CG 3.44Å; F2639-L2643 PolarHBondContact O-N 3.34Å
2640	L	92.1	Very high	89	Confident	26 Å²	26	44.2 Å²	44.2	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-62.4	-43.3	177.9	-70.1	172.9	0	0	0	112.2	L2566 T2570 R2636 E2637 H2644	L2566-L2640 HydrophobicContact CB-CD2 3.72Å; T2570-L2640 HydrophobicContact CG2-CD2 4.34Å; R2636-L2640 HydrophobicContact CG-CD1 3.76Å; R2636-L2640 HydrophobicContact CG-CG 4.36Å; R2636-L2640 WeakPolarHBondContact O-CB 3.42Å; R2636-L2640 VanDerWaalsContact O-CG 3.26Å; R2636-L2640 WeakPolarHBondContact O-CG 3.33Å; R2636-L2640 PolarHBondContact O-N 3.23Å; E2637-L2640 PolarHBondContact O-N 3.14Å; L2640-H2644 WeakPolarHBondContact O-CB 3.22Å; L2640-H2644 PolarHBondContact O-N 3.47Å
2641	Y	88.4	Confident	89.2	Confident	178 Å²	178	43.4 Å²	43.4	70%	0.698	21%	0.213	S	C	*	.	H	α-helix	trans	-60.4	-47.9	176.6	177.9	-92.9	0	0	0	111.7	E2637 F2639 H2644 S2645	E2637-Y2641 VanDerWaalsContact O-CB 3.23Å; E2637-Y2641 WeakPolarHBondContact O-CB 3.3Å; E2637-Y2641 PolarHBondContact O-N 3.44Å; F2639-Y2641 PolarHBondContact O-N 3.01Å; Y2641-H2644 WeakPolarHBondContact O-CB 3.34Å; Y2641-H2644 PolarHBondContact O-N 2.81Å; Y2641-S2645 PolarHBondContact O-N 2.89Å
2642	Q	87.5	Confident	88.7	Confident	25 Å²	25	41.8 Å²	41.8	12%	0.117	20%	0.202	C	C	.	.	H	α-helix	trans	-72.5	-42.1	-175.7	-167.1	65.1	64	0	0	112.2	R2638 F2639 H2644 S2645 Y2646	R2638-Q2642 VanDerWaalsContact O-CB 3.27Å; R2638-Q2642 WeakPolarHBondContact O-CB 3.32Å; R2638-Q2642 PolarHBondContact O-N 3.35Å; F2639-Q2642 PolarHBondContact O-N 3.01Å; Q2642-H2644 VanDerWaalsContact C-N 3.26Å; Q2642-H2644 PolarHBondContact O-N 3.19Å; Q2642-S2645 WeakPolarHBondContact O-CB 3.4Å; Q2642-S2645 PolarHBondContact O-N 3.3Å; Q2642-S2645 VanDerWaalsContact O-N 3.08Å; Q2642-Y2646 HydrophobicContact CG-CD1 4.49Å; Q2642-Y2646 HydrophobicContact CG-CE1 3.72Å; Q2642-Y2646 HydrophobicContact CG-CE2 3.91Å; Q2642-Y2646 VanDerWaalsContact CG-OH 3.25Å; Q2642-Y2646 WeakPolarHBondContact CG-OH 3.29Å; Q2642-Y2646 PolarHBondContact O-N 2.81Å
2643	L	90.9	Very high	87.8	Confident	2 Å²	2	43.4 Å²	43.4	1%	0.01	21%	0.209	C	C	.	.	H	α-helix	trans	-63.6	-32.3	171.4	-68.5	-171.8	0	0	0	112.1	L2460 L2566 L2583 F2639 S2645 Y2646 F2647	L2460-L2643 HydrophobicContact CB-CD2 3.88Å; L2460-L2643 HydrophobicContact CD1-CD2 4.14Å; L2566-L2643 HydrophobicContact CD1-CB 4.44Å; L2566-L2643 HydrophobicContact CD1-CD1 3.73Å; L2566-L2643 HydrophobicContact CD2-CD1 4.16Å; L2583-L2643 HydrophobicContact CB-CD1 4.06Å; L2583-L2643 HydrophobicContact CB-CD2 4.4Å; L2583-L2643 HydrophobicContact CD2-CD1 3.86Å; L2583-L2643 HydrophobicContact CD2-CD2 4.14Å; F2639-L2643 HydrophobicContact CD1-CD1 3.7Å; F2639-L2643 HydrophobicContact CD1-CG 4.33Å; F2639-L2643 HydrophobicContact CE1-CD1 3.25Å; F2639-L2643 HydrophobicContact CE1-CG 4.26Å; F2639-L2643 HydrophobicContact CE2-CD1 4.22Å; F2639-L2643 HydrophobicContact CG-CD1 4.37Å; F2639-L2643 HydrophobicContact CZ-CD1 3.55Å; F2639-L2643 HydrophobicContact CZ-CG 4.44Å; F2639-L2643 WeakPolarHBondContact O-CB 3.39Å; F2639-L2643 VanDerWaalsContact O-CG 3.31Å; F2639-L2643 WeakPolarHBondContact O-CG 3.44Å; F2639-L2643 PolarHBondContact O-N 3.34Å; L2643-S2645 PolarHBondContact O-N 3.38Å; L2643-Y2646 HydrophobicContact CD2-CD2 3.8Å; L2643-Y2646 HydrophobicContact CD2-CE2 4.16Å; L2643-Y2646 PolarHBondContact O-N 2.86Å; L2643-F2647 HydrophobicContact CD2-CE2 4.34Å; L2643-F2647 WeakPolarHBondContact O-CD2 3.17Å
2644	H	86.5	Confident	86.7	Confident	122 Å²	122	39.7 Å²	39.7	57%	0.565	19%	0.189	S	C	*	.	H	α-helix	trans	-61.4	-36.6	173	-176.3	-86.6	0	0	0	111.4	K2559 L2640 Y2641 Q2642	K2559-H2644 PolarHBondContact NZ-O 2.85Å; L2640-H2644 WeakPolarHBondContact O-CB 3.22Å; L2640-H2644 PolarHBondContact O-N 3.47Å; Y2641-H2644 WeakPolarHBondContact O-CB 3.34Å; Y2641-H2644 PolarHBondContact O-N 2.81Å; Q2642-H2644 VanDerWaalsContact C-N 3.26Å; Q2642-H2644 PolarHBondContact O-N 3.19Å
2645	S	84.9	Confident	85.9	Confident	68 Å²	68	37.8 Å²	37.8	48%	0.476	18%	0.176	S	C	.	.	H	α-helix	trans	-74.5	-36.3	177.4	-163.6	0	0	0	0	114.2	Y2641 Q2642 L2643 F2647	Y2641-S2645 PolarHBondContact O-N 2.89Å; Q2642-S2645 WeakPolarHBondContact O-CB 3.4Å; Q2642-S2645 PolarHBondContact O-N 3.3Å; Q2642-S2645 VanDerWaalsContact O-N 3.08Å; L2643-S2645 PolarHBondContact O-N 3.38Å; S2645-F2647 PolarHBondContact O-N 3.4Å
2646	Y	89.6	Confident	84.6	Confident	6 Å²	6	39.1 Å²	39.1	2%	0.024	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-31.3	-176.6	-65.8	-23.9	0	0	0	114.2	L2460 D2540 L2543 L2544 Q2642 L2643 P2648	L2460-Y2646 HydrophobicContact CB-CE2 4.31Å; L2460-Y2646 HydrophobicContact CD1-CD2 4.06Å; L2460-Y2646 HydrophobicContact CD2-CD2 4.18Å; L2460-Y2646 HydrophobicContact CD2-CE2 3.95Å; L2460-Y2646 HydrophobicContact CG-CE2 4.49Å; D2540-Y2646 VanDerWaalsContact CB-OH 3.3Å; D2540-Y2646 WeakPolarHBondContact CB-OH 3.4Å; D2540-Y2646 WeakPolarHBondContact OD1-CE2 3.45Å; D2540-Y2646 PolarHBondContact OD1-OH 3.39Å; L2543-Y2646 HydrophobicContact CD2-CD2 4.07Å; L2543-Y2646 HydrophobicContact CD2-CG 4.02Å; L2544-Y2646 HydrophobicContact CD1-CE1 4.37Å; L2544-Y2646 HydrophobicContact CD2-CD1 3.7Å; L2544-Y2646 HydrophobicContact CD2-CE1 3.64Å; L2544-Y2646 HydrophobicContact CG-CD1 4.28Å; L2544-Y2646 HydrophobicContact CG-CE1 3.76Å; Q2642-Y2646 HydrophobicContact CG-CD1 4.49Å; Q2642-Y2646 HydrophobicContact CG-CE1 3.72Å; Q2642-Y2646 HydrophobicContact CG-CE2 3.91Å; Q2642-Y2646 VanDerWaalsContact CG-OH 3.25Å; Q2642-Y2646 WeakPolarHBondContact CG-OH 3.29Å; Q2642-Y2646 PolarHBondContact O-N 2.81Å; L2643-Y2646 HydrophobicContact CD2-CD2 3.8Å; L2643-Y2646 HydrophobicContact CD2-CE2 4.16Å; L2643-Y2646 PolarHBondContact O-N 2.86Å; Y2646-P2648 WeakPolarHBondContact O-CD 3.45Å
2647	F	91.5	Very high	83	Confident	2 Å²	2	38 Å²	38	1%	0.009	18%	0.182	C	C	.	.	S	Bend	trans	-111.7	83.3	-176.8	-56.7	-67.6	0	0	0	111	L2460 L2543 L2552 L2554 K2559 L2562 L2583 V2585 L2594 L2643 S2645 L2649	L2460-F2647 HydrophobicContact CD1-CE2 4.13Å; L2460-F2647 HydrophobicContact CD1-CZ 3.69Å; L2543-F2647 HydrophobicContact CD2-CZ 4.44Å; L2552-F2647 HydrophobicContact CB-CD1 4.1Å; L2552-F2647 HydrophobicContact CB-CE1 4.35Å; L2552-F2647 HydrophobicContact CD1-CE1 4.02Å; L2554-F2647 HydrophobicContact CD1-CB 3.79Å; L2554-F2647 HydrophobicContact CD1-CG 4.27Å; L2554-F2647 HydrophobicContact CG-CB 4.2Å; K2559-F2647 WeakPolarHBondContact CE-O 3.43Å; K2559-F2647 PolarHBondContact NZ-O 2.78Å; L2562-F2647 HydrophobicContact CD2-CB 4.44Å; L2562-F2647 HydrophobicContact CD2-CD2 3.97Å; L2562-F2647 HydrophobicContact CD2-CG 4.33Å; L2583-F2647 HydrophobicContact CD2-CE2 4.11Å; V2585-F2647 HydrophobicContact CG1-CE1 4.43Å; V2585-F2647 HydrophobicContact CG1-CZ 4.41Å; V2585-F2647 HydrophobicContact CG2-CZ 4.02Å; L2594-F2647 HydrophobicContact CD1-CD1 3.79Å; L2594-F2647 HydrophobicContact CD1-CE1 3.75Å; L2643-F2647 HydrophobicContact CD2-CE2 4.34Å; L2643-F2647 WeakPolarHBondContact O-CD2 3.17Å; S2645-F2647 PolarHBondContact O-N 3.4Å; F2647-L2649 PolarHBondContact O-N 3.29Å
2648	P	88.5	Confident	81.4	Confident	22 Å²	22	34.7 Å²	34.7	14%	0.143	17%	0.168	C	C	.	.	P	Polyproline II helix	trans	-59.5	130.5	-178.8	22.2	-32.5	0	0	0	111.8	L1303 P2551 Y2553 L2554 Y2646 L2650	L1303-P2648 HydrophobicContact CD2-CB 4.19Å; P2551-P2648 HydrophobicContact CB-CG 4.1Å; Y2553-P2648 HydrophobicContact CD1-CB 4.03Å; Y2553-P2648 HydrophobicContact CD1-CG 3.63Å; Y2553-P2648 HydrophobicContact CE1-CB 4.26Å; Y2553-P2648 HydrophobicContact CE1-CG 3.93Å; Y2553-P2648 HydrophobicContact CG-CG 4.37Å; L2554-P2648 PolarHBondContact N-O 3.29Å; Y2646-P2648 WeakPolarHBondContact O-CD 3.45Å; P2648-L2650 PolarHBondContact O-N 3.37Å
2649	L	89.3	Confident	79.8	Confident	30 Å²	30	34.4 Å²	34.4	16%	0.157	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	123.1	170.6	-165	163.2	0	0	0	108.3	I1323 V2556 K2559 F2647 Y2655	I1323-L2649 HydrophobicContact CD1-CB 4.2Å; I1323-L2649 HydrophobicContact CD1-CD2 3.73Å; I1323-L2649 HydrophobicContact CD1-CG 4.43Å; V2556-L2649 HydrophobicContact CG1-CD1 4.48Å; V2556-L2649 HydrophobicContact CG2-CD2 4.21Å; K2559-L2649 HydrophobicContact CB-CB 4.41Å; K2559-L2649 HydrophobicContact CB-CD1 4.09Å; K2559-L2649 HydrophobicContact CB-CG 4.05Å; K2559-L2649 HydrophobicContact CG-CB 4.01Å; K2559-L2649 HydrophobicContact CG-CD1 3.87Å; K2559-L2649 HydrophobicContact CG-CG 4.05Å; F2647-L2649 PolarHBondContact O-N 3.29Å; L2649-Y2655 HydrophobicContact CD1-CE2 4.44Å; L2649-Y2655 HydrophobicContact CD2-CD2 4.14Å; L2649-Y2655 HydrophobicContact CD2-CE2 3.75Å
2650	L	87.8	Confident	77.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	116	174	-171.1	64.2	0	0	0	110	L1303 I1367 T1369 V1524 V1526 Y2553 L2554 P2648	L1303-L2650 HydrophobicContact CB-CD1 4.39Å; I1367-L2650 HydrophobicContact CB-CD1 3.93Å; I1367-L2650 HydrophobicContact CG2-CD1 3.43Å; I1367-L2650 VanDerWaalsContact CG2-CD1 3.43Å; T1369-L2650 HydrophobicContact CG2-CB 4.49Å; T1369-L2650 HydrophobicContact CG2-CD2 4.02Å; T1369-L2650 HydrophobicContact CG2-CG 4.02Å; V1524-L2650 HydrophobicContact CG1-CD2 3.92Å; V1526-L2650 HydrophobicContact CB-CD2 4.45Å; V1526-L2650 HydrophobicContact CG1-CD2 4.13Å; V1526-L2650 HydrophobicContact CG2-CD2 3.54Å; Y2553-L2650 HydrophobicContact CD1-CB 4.17Å; Y2553-L2650 HydrophobicContact CD1-CD1 4.13Å; Y2553-L2650 HydrophobicContact CD1-CD2 4.43Å; Y2553-L2650 HydrophobicContact CE1-CD1 4.41Å; Y2553-L2650 HydrophobicContact CG-CB 4.43Å; Y2553-L2650 HydrophobicContact CG-CD2 4.15Å; L2554-L2650 PolarHBondContact O-N 3.15Å; P2648-L2650 PolarHBondContact O-N 3.37Å
2651	P	84.3	Confident	75.4	Confident	0 Å²	0	37.6 Å²	37.6	0%	0	19%	0.186	C	C	.	.	P	Polyproline II helix	trans	-68.5	139.9	175.5	29.4	-35.5	0	0	0	110.5	I1323 Q1368 T1369 Y2655	I1323-P2651 HydrophobicContact CG2-CB 4.35Å; I1323-P2651 HydrophobicContact CG2-CG 4.17Å; Q1368-P2651 WeakPolarHBondContact CG-O 3.14Å; T1369-P2651 PolarHBondContact N-O 2.98Å; P2651-Y2655 HydrophobicContact CB-CD1 4.36Å; P2651-Y2655 HydrophobicContact CB-CD2 3.93Å; P2651-Y2655 HydrophobicContact CB-CG 3.75Å
2652	D	76	Confident	73.3	Confident	16 Å²	16	31 Å²	31	9%	0.086	17%	0.165	C	C	.	.			trans	-93.8	177.7	162.5	60.9	8.9	0	0	0	110.3	T1369 W2654 Y2655	T1369-D2652 HydrophobicContact CG2-CB 3.81Å; T1369-D2652 WeakPolarHBondContact OG1-CA 3.4Å; T1369-D2652 WeakPolarHBondContact OG1-CB 3.11Å; D2652-W2654 PolarHBondContact O-N 3.07Å; D2652-W2654 VanDerWaalsContact O-N 3.08Å; D2652-W2654 WeakPolarHBondContact OD1-CA 3.21Å; D2652-W2654 WeakPolarHBondContact OD1-CB 3.35Å; D2652-W2654 PolarHBondContact OD1-N 3Å; D2652-Y2655 WeakPolarHBondContact O-CB 3.31Å; D2652-Y2655 PolarHBondContact O-N 2.52Å; D2652-Y2655 PolarHBondContact OD1-N 2.78Å
2653	Q	68.9	Low	71.3	Confident	37 Å²	37	34 Å²	34	17%	0.173	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-8.7	172.8	71.4	-163.3	34.5	0	0	113.9	F1069 R1070	F1069-Q2653 HydrophobicContact CD1-CB 4.42Å; F1069-Q2653 HydrophobicContact CD1-CG 4.21Å; F1069-Q2653 HydrophobicContact CE1-CB 4.26Å; R1070-Q2653 PolarHBondContact O-NE2 3.47Å
2654	W	66.8	Low	68.9	Low	16 Å²	16	36.7 Å²	36.7	6%	0.061	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-6.9	-178.1	-52.4	102.7	0	0	0	112.5	L1056 R1070 P1072 I1291 Y1297 D2652 D2656 S2657 L2658	L1056-W2654 HydrophobicContact CD2-CH2 4.49Å; R1070-W2654 WeakPolarHBondContact O-CZ2 3.32Å; P1072-W2654 VanDerWaalsContact CA-NE1 3.29Å; P1072-W2654 HydrophobicContact CB-CD2 4.24Å; P1072-W2654 HydrophobicContact CB-CG 4.35Å; P1072-W2654 HydrophobicContact CB-CZ2 4.46Å; P1072-W2654 HydrophobicContact CG-CD2 3.9Å; P1072-W2654 HydrophobicContact CG-CE3 4.2Å; P1072-W2654 HydrophobicContact CG-CH2 3.87Å; P1072-W2654 HydrophobicContact CG-CZ2 3.59Å; P1072-W2654 HydrophobicContact CG-CZ3 4.18Å; I1291-W2654 HydrophobicContact CB-CZ3 4.38Å; I1291-W2654 HydrophobicContact CG1-CE3 4.36Å; I1291-W2654 HydrophobicContact CG1-CZ3 4.45Å; I1291-W2654 HydrophobicContact CG2-CE3 4.35Å; I1291-W2654 HydrophobicContact CG2-CH2 4.44Å; I1291-W2654 HydrophobicContact CG2-CZ3 3.73Å; Y1297-W2654 HydrophobicContact CE1-CE3 4.14Å; Y1297-W2654 AromaticContact CE1-CH2 3.69Å; Y1297-W2654 HydrophobicContact CE1-CH2 3.69Å; Y1297-W2654 HydrophobicContact CE1-CZ2 4.36Å; Y1297-W2654 AromaticContact CE1-CZ3 3.54Å; Y1297-W2654 HydrophobicContact CE1-CZ3 3.54Å; Y1297-W2654 AromaticContact CZ-CH2 3.83Å; Y1297-W2654 AromaticContact CZ-CZ3 3.63Å; Y1297-W2654 WeakPolarHBondContact OH-CH2 2.94Å; Y1297-W2654 WeakPolarHBondContact OH-CZ3 3.4Å; D2652-W2654 PolarHBondContact O-N 3.07Å; D2652-W2654 VanDerWaalsContact O-N 3.08Å; D2652-W2654 WeakPolarHBondContact OD1-CA 3.21Å; D2652-W2654 WeakPolarHBondContact OD1-CB 3.35Å; D2652-W2654 PolarHBondContact OD1-N 3Å; W2654-D2656 PolarHBondContact O-N 2.92Å; W2654-S2657 WeakPolarHBondContact O-CB 3.38Å; W2654-S2657 PolarHBondContact O-N 3.11Å; W2654-L2658 PolarHBondContact O-N 2.78Å
2655	Y	71.3	Confident	66.6	Low	47 Å²	47	35 Å²	35	18%	0.184	18%	0.182	C	C	.	.	H	α-helix	trans	-49	-51.3	-168	179.8	-99	0	0	0	113.7	I1323 V2556 L2649 P2651 D2652 S2657 L2658 A2659	I1323-Y2655 HydrophobicContact CD1-CE2 4.37Å; I1323-Y2655 HydrophobicContact CG2-CD1 4.33Å; I1323-Y2655 HydrophobicContact CG2-CE1 3.9Å; V2556-Y2655 HydrophobicContact CG1-CD2 4.04Å; V2556-Y2655 HydrophobicContact CG1-CE2 4.1Å; V2556-Y2655 HydrophobicContact CG2-CD2 3.76Å; V2556-Y2655 HydrophobicContact CG2-CE2 4.47Å; L2649-Y2655 HydrophobicContact CD1-CE2 4.44Å; L2649-Y2655 HydrophobicContact CD2-CD2 4.14Å; L2649-Y2655 HydrophobicContact CD2-CE2 3.75Å; P2651-Y2655 HydrophobicContact CB-CD1 4.36Å; P2651-Y2655 HydrophobicContact CB-CD2 3.93Å; P2651-Y2655 HydrophobicContact CB-CG 3.75Å; D2652-Y2655 WeakPolarHBondContact O-CB 3.31Å; D2652-Y2655 PolarHBondContact O-N 2.52Å; D2652-Y2655 PolarHBondContact OD1-N 2.78Å; Y2655-S2657 VanDerWaalsContact C-N 3.28Å; Y2655-S2657 PolarHBondContact O-N 3.34Å; Y2655-L2658 PolarHBondContact O-N 2.82Å; Y2655-L2658 VanDerWaalsContact O-N 3.17Å; Y2655-A2659 HydrophobicContact CD1-CB 4.34Å; Y2655-A2659 HydrophobicContact CE1-CB 4Å; Y2655-A2659 HydrophobicContact CE2-CB 4.31Å; Y2655-A2659 WeakPolarHBondContact O-CB 3.37Å; Y2655-A2659 PolarHBondContact O-N 2.76Å
2656	D	65.4	Low	64.3	Low	28 Å²	28	37.9 Å²	37.9	15%	0.15	18%	0.182	C	C	.	.	H	α-helix	trans	-51.4	-46.7	178.1	-74.3	-13.1	0	0	0	112.1	R1289 S1299 S1301 T1325 W2654 L2658 E2660	R1289-D2656 IonicContact NH1-OD2 3.07Å; R1289-D2656 PolarHBondContact NH1-OD2 3.18Å; R1289-D2656 VanDerWaalsContact NH1-OD2 3.17Å; S1299-D2656 PolarHBondContact OG-OD2 2.87Å; S1301-D2656 PolarHBondContact OG-OD1 2.91Å; T1325-D2656 WeakPolarHBondContact CB-OD1 3.47Å; T1325-D2656 VanDerWaalsContact CG2-CG 3.48Å; T1325-D2656 WeakPolarHBondContact CG2-OD1 3.46Å; T1325-D2656 WeakPolarHBondContact CG2-OD2 3.39Å; T1325-D2656 PolarHBondContact OG1-OD1 3.1Å; W2654-D2656 PolarHBondContact O-N 2.92Å; D2656-L2658 PolarHBondContact O-N 2.58Å; D2656-E2660 PolarHBondContact O-N 2.84Å
2657	S	58.8	Low	62.1	Low	25 Å²	25	40.3 Å²	40.3	18%	0.175	20%	0.198	C	C	.	.	H	α-helix	trans	-70.4	-33.4	-175.3	-54.9	0	0	0	0	112	W2654 Y2655	W2654-S2657 WeakPolarHBondContact O-CB 3.38Å; W2654-S2657 PolarHBondContact O-N 3.11Å; Y2655-S2657 VanDerWaalsContact C-N 3.28Å; Y2655-S2657 PolarHBondContact O-N 3.34Å
2658	L	56.7	Low	59.6	Low	49 Å²	49	42.2 Å²	42.2	26%	0.257	21%	0.211	S	C	.	.	H	α-helix	trans	-86.2	-31.2	179.7	-151	73.5	0	0	0	112.3	V2556 W2654 Y2655 D2656 H2661 T2662	V2556-L2658 HydrophobicContact CB-CD2 4.08Å; V2556-L2658 HydrophobicContact CG1-CD2 4.12Å; W2654-L2658 PolarHBondContact O-N 2.78Å; Y2655-L2658 PolarHBondContact O-N 2.82Å; Y2655-L2658 VanDerWaalsContact O-N 3.17Å; D2656-L2658 PolarHBondContact O-N 2.58Å; L2658-H2661 WeakPolarHBondContact O-CB 3.42Å; L2658-H2661 PolarHBondContact O-N 3.01Å; L2658-T2662 WeakPolarHBondContact O-CB 3.49Å; L2658-T2662 PolarHBondContact O-N 3.07Å; L2658-T2662 PolarHBondContact O-OG1 2.85Å
2659	A	56	Low	57.2	Low	24 Å²	24	43.2 Å²	43.2	20%	0.198	22%	0.219	C	C	.	.	H	α-helix	trans	-71.8	-41.5	176.5	0	0	0	0	0	111.6	Y2655 H2661 T2662 E2663	Y2655-A2659 HydrophobicContact CD1-CB 4.34Å; Y2655-A2659 HydrophobicContact CE1-CB 4Å; Y2655-A2659 HydrophobicContact CE2-CB 4.31Å; Y2655-A2659 WeakPolarHBondContact O-CB 3.37Å; Y2655-A2659 PolarHBondContact O-N 2.76Å; A2659-H2661 PolarHBondContact O-N 2.95Å; A2659-T2662 PolarHBondContact O-N 3.1Å; A2659-T2662 VanDerWaalsContact O-N 3.15Å; A2659-E2663 PolarHBondContact O-N 2.8Å
2660	E	49.3	Very low	54.9	Low	50 Å²	50	46 Å²	46	23%	0.234	23%	0.233	C	C	.	.	H	α-helix	trans	-58	-38.4	169.6	-78.5	-172	176.1	0	0	111.1	L1287 D2656 N2664	L1287-E2660 WeakPolarHBondContact CA-OE2 3.44Å; L1287-E2660 HydrophobicContact CD2-CB 4.26Å; D2656-E2660 PolarHBondContact O-N 2.84Å; E2660-N2664 WeakPolarHBondContact O-CB 3.46Å; E2660-N2664 PolarHBondContact O-N 2.73Å; E2660-N2664 PolarHBondContact O-ND2 3.33Å
2661	H	44.3	Very low	52.5	Low	42 Å²	42	51 Å²	51	19%	0.194	26%	0.256	C	S	.	.	H	α-helix	trans	-66	-45.7	173.4	-169.6	90.4	0	0	0	112.3	L2658 A2659 W2665	L2658-H2661 WeakPolarHBondContact O-CB 3.42Å; L2658-H2661 PolarHBondContact O-N 3.01Å; A2659-H2661 PolarHBondContact O-N 2.95Å; H2661-W2665 AromaticContact NE2-CD1 3.61Å; H2661-W2665 PolarHBondContact O-N 3.35Å; H2661-W2665 VanDerWaalsContact O-N 3.08Å
2662	T	45.8	Very low	50.2	Low	41 Å²	41	59 Å²	59	25%	0.252	29%	0.287	S	S	.	.	H	α-helix	trans	-65	-47.5	-175.7	-55.5	0	0	0	0	112.3	N2560 L2658 A2659 N2664 W2665 R2666	N2560-T2662 WeakPolarHBondContact ND2-CG2 3.45Å; N2560-T2662 PolarHBondContact ND2-OG1 3.45Å; L2658-T2662 WeakPolarHBondContact O-CB 3.49Å; L2658-T2662 PolarHBondContact O-N 3.07Å; L2658-T2662 PolarHBondContact O-OG1 2.85Å; A2659-T2662 PolarHBondContact O-N 3.1Å; A2659-T2662 VanDerWaalsContact O-N 3.15Å; T2662-N2664 PolarHBondContact O-N 2.73Å; T2662-W2665 WeakPolarHBondContact O-CA 3.43Å; T2662-W2665 WeakPolarHBondContact O-CB 3.37Å; T2662-W2665 PolarHBondContact O-N 3.47Å; T2662-R2666 PolarHBondContact O-N 3.05Å
2663	E	45.6	Very low	48.3	Very low	86 Å²	86	65.3 Å²	65.3	40%	0.402	31%	0.313	S	S	.	.	H	α-helix	trans	-69.6	-35.8	-177.7	-175	59.4	-167.8	0	0	111.4	A2659 W2665 R2666 V2667	A2659-E2663 PolarHBondContact O-N 2.8Å; E2663-W2665 PolarHBondContact O-N 3.09Å; E2663-R2666 VanDerWaalsContact CD-NE 3.32Å; E2663-R2666 WeakPolarHBondContact O-CB 3.23Å; E2663-R2666 PolarHBondContact O-N 3.48Å; E2663-R2666 VanDerWaalsContact O-N 3.15Å; E2663-R2666 IonicContact OE1-CZ 3.86Å; E2663-R2666 VanDerWaalsContact OE1-CZ 3.3Å; E2663-R2666 IonicContact OE1-NE 2.91Å; E2663-R2666 PolarHBondContact OE1-NE 3.25Å; E2663-R2666 VanDerWaalsContact OE1-NE 3.09Å; E2663-R2666 IonicContact OE1-NH2 2.6Å; E2663-R2666 PolarHBondContact OE1-NH2 3.42Å; E2663-R2666 WeakPolarHBondContact OE2-CD 3.35Å; E2663-R2666 IonicContact OE2-CZ 2.83Å; E2663-R2666 IonicContact OE2-NE 3.19Å; E2663-R2666 PolarHBondContact OE2-NE 3.46Å; E2663-R2666 IonicContact OE2-NH2 2.93Å; E2663-V2667 WeakPolarHBondContact O-CG2 3.28Å; E2663-V2667 PolarHBondContact O-N 2.82Å
2664	N	39.5	Very low	46.9	Very low	60 Å²	60	66.1 Å²	66.1	32%	0.321	32%	0.323	S	S	.	.	H	α-helix	trans	-61.5	-33.5	168.9	-81.2	-60.9	0	0	0	112.1	E2660 T2662 S2668	E2660-N2664 WeakPolarHBondContact O-CB 3.46Å; E2660-N2664 PolarHBondContact O-N 2.73Å; E2660-N2664 PolarHBondContact O-ND2 3.33Å; T2662-N2664 PolarHBondContact O-N 2.73Å; N2664-S2668 VanDerWaalsContact O-CB 3.26Å; N2664-S2668 WeakPolarHBondContact O-CB 3.22Å; N2664-S2668 PolarHBondContact O-N 3.39Å; N2664-S2668 PolarHBondContact O-OG 3.15Å
2665	W	38.3	Very low	45.3	Very low	85 Å²	85	71 Å²	71	32%	0.322	35%	0.349	S	S	.	.	H	α-helix	trans	-65.8	-43.1	172.4	-137.4	104.7	0	0	0	111.5	H2661 T2662 E2663 S2668 S2669	H2661-W2665 AromaticContact NE2-CD1 3.61Å; H2661-W2665 PolarHBondContact O-N 3.35Å; H2661-W2665 VanDerWaalsContact O-N 3.08Å; T2662-W2665 WeakPolarHBondContact O-CA 3.43Å; T2662-W2665 WeakPolarHBondContact O-CB 3.37Å; T2662-W2665 PolarHBondContact O-N 3.47Å; E2663-W2665 PolarHBondContact O-N 3.09Å; W2665-S2668 PolarHBondContact O-N 3.11Å; W2665-S2669 PolarHBondContact O-N 2.94Å; W2665-S2669 PolarHBondContact O-OG 2.94Å
2666	R	37.2	Very low	43.6	Very low	129 Å²	129	71.8 Å²	71.8	49%	0.487	36%	0.362	S	S	.	.	H	α-helix	trans	-64.8	-44.2	177.1	-160.4	-175.9	73.9	86.7	4.8	112.4	T2662 E2663 S2669 I2670	T2662-R2666 PolarHBondContact O-N 3.05Å; E2663-R2666 VanDerWaalsContact CD-NE 3.32Å; E2663-R2666 WeakPolarHBondContact O-CB 3.23Å; E2663-R2666 PolarHBondContact O-N 3.48Å; E2663-R2666 VanDerWaalsContact O-N 3.15Å; E2663-R2666 IonicContact OE1-CZ 3.86Å; E2663-R2666 VanDerWaalsContact OE1-CZ 3.3Å; E2663-R2666 IonicContact OE1-NE 2.91Å; E2663-R2666 PolarHBondContact OE1-NE 3.25Å; E2663-R2666 VanDerWaalsContact OE1-NE 3.09Å; E2663-R2666 IonicContact OE1-NH2 2.6Å; E2663-R2666 PolarHBondContact OE1-NH2 3.42Å; E2663-R2666 WeakPolarHBondContact OE2-CD 3.35Å; E2663-R2666 IonicContact OE2-CZ 2.83Å; E2663-R2666 IonicContact OE2-NE 3.19Å; E2663-R2666 PolarHBondContact OE2-NE 3.46Å; E2663-R2666 IonicContact OE2-NH2 2.93Å; R2666-S2669 PolarHBondContact O-N 2.94Å; R2666-S2669 PolarHBondContact O-OG 2.86Å; R2666-I2670 HydrophobicContact CG-CD1 4.25Å; R2666-I2670 WeakPolarHBondContact O-CD1 3.35Å; R2666-I2670 VanDerWaalsContact O-CG1 3.27Å; R2666-I2670 WeakPolarHBondContact O-CG1 3.39Å; R2666-I2670 PolarHBondContact O-N 2.82Å; R2666-I2670 VanDerWaalsContact O-N 3.1Å
2667	V	43.1	Very low	42.3	Very low	57 Å²	57	74 Å²	74	35%	0.345	38%	0.377	S	S	.	.	H	α-helix	trans	-63.9	-42.3	174	173.9	0	0	0	0	110.8	E2663 S2669 I2670 Q2671	E2663-V2667 WeakPolarHBondContact O-CG2 3.28Å; E2663-V2667 PolarHBondContact O-N 2.82Å; V2667-S2669 VanDerWaalsContact C-N 3.34Å; V2667-S2669 PolarHBondContact O-N 2.99Å; V2667-I2670 PolarHBondContact O-N 3Å; V2667-Q2671 HydrophobicContact CG1-CG 4.36Å; V2667-Q2671 WeakPolarHBondContact O-CB 3.4Å; V2667-Q2671 WeakPolarHBondContact O-CG 3.35Å; V2667-Q2671 PolarHBondContact O-N 2.83Å
2668	S	38.9	Very low	41.1	Very low	42 Å²	42	78.3 Å²	78.3	29%	0.294	40%	0.397	S	S	.	.	H	α-helix	trans	-66.1	-29.9	179.5	-60.8	0	0	0	0	114.1	N2664 W2665 R2672	N2664-S2668 VanDerWaalsContact O-CB 3.26Å; N2664-S2668 WeakPolarHBondContact O-CB 3.22Å; N2664-S2668 PolarHBondContact O-N 3.39Å; N2664-S2668 PolarHBondContact O-OG 3.15Å; W2665-S2668 PolarHBondContact O-N 3.11Å; S2668-R2672 PolarHBondContact O-N 2.76Å
2669	S	37.8	Very low	39.8	Very low	44 Å²	44	84.7 Å²	84.7	31%	0.308	42%	0.423	S	S	.	.	H	α-helix	trans	-80.9	-36	175.3	62	0	0	0	0	112	W2665 R2666 V2667 R2672 K2673	W2665-S2669 PolarHBondContact O-N 2.94Å; W2665-S2669 PolarHBondContact O-OG 2.94Å; R2666-S2669 PolarHBondContact O-N 2.94Å; R2666-S2669 PolarHBondContact O-OG 2.86Å; V2667-S2669 VanDerWaalsContact C-N 3.34Å; V2667-S2669 PolarHBondContact O-N 2.99Å; S2669-R2672 PolarHBondContact O-N 3.2Å; S2669-K2673 PolarHBondContact O-N 3.06Å; S2669-K2673 VanDerWaalsContact O-N 3.13Å
2670	I	41.1	Very low	38.8	Very low	87 Å²	87	89.1 Å²	89.1	45%	0.446	45%	0.448	S	S	.	.	H	α-helix	trans	-63.5	-45	171.3	-68.4	166.6	0	0	0	110.9	R2666 V2667 R2672 K2673 S2674	R2666-I2670 HydrophobicContact CG-CD1 4.25Å; R2666-I2670 WeakPolarHBondContact O-CD1 3.35Å; R2666-I2670 VanDerWaalsContact O-CG1 3.27Å; R2666-I2670 WeakPolarHBondContact O-CG1 3.39Å; R2666-I2670 PolarHBondContact O-N 2.82Å; R2666-I2670 VanDerWaalsContact O-N 3.1Å; V2667-I2670 PolarHBondContact O-N 3Å; I2670-R2672 VanDerWaalsContact C-N 3.32Å; I2670-R2672 PolarHBondContact O-N 2.91Å; I2670-K2673 PolarHBondContact O-N 2.96Å; I2670-K2673 VanDerWaalsContact O-N 3.07Å; I2670-S2674 PolarHBondContact O-N 3.33Å; I2670-S2674 PolarHBondContact O-OG 3.46Å
2671	Q	37.6	Very low	37.9	Very low	106 Å²	106	97.3 Å²	97.3	50%	0.495	48%	0.483	S	S	.	.	H	α-helix	trans	-61.2	-37.5	176.8	-78.9	-178.5	-20.5	0	0	112.7	V2667 S2674 L2675	V2667-Q2671 HydrophobicContact CG1-CG 4.36Å; V2667-Q2671 WeakPolarHBondContact O-CB 3.4Å; V2667-Q2671 WeakPolarHBondContact O-CG 3.35Å; V2667-Q2671 PolarHBondContact O-N 2.83Å; Q2671-S2674 WeakPolarHBondContact CA-OG 3.29Å; Q2671-S2674 PolarHBondContact O-N 2.93Å; Q2671-S2674 PolarHBondContact O-OG 3.33Å; Q2671-L2675 WeakPolarHBondContact O-CB 3.18Å; Q2671-L2675 WeakPolarHBondContact O-CG 3.18Å; Q2671-L2675 PolarHBondContact O-N 3.23Å
2672	R	36.6	Very low	37.6	Very low	169 Å²	169	100.1 Å²	100.1	64%	0.638	50%	0.497	S	S	*	.	H	α-helix	trans	-64.1	-39.4	172.2	-84.1	-172	-79.5	170.7	-4.3	112.3	S2668 S2669 I2670 L2675 S2676	S2668-R2672 PolarHBondContact O-N 2.76Å; S2669-R2672 PolarHBondContact O-N 3.2Å; I2670-R2672 VanDerWaalsContact C-N 3.32Å; I2670-R2672 PolarHBondContact O-N 2.91Å; R2672-L2675 PolarHBondContact O-N 3.05Å; R2672-S2676 PolarHBondContact O-N 3.33Å; R2672-S2676 PolarHBondContact O-OG 2.8Å
2673	K	36	Very low	37.2	Very low	147 Å²	147	103.2 Å²	103.2	64%	0.639	51%	0.51	S	S	*	.	H	α-helix	trans	-68.8	-36.4	174.4	-73.9	-165.3	173.4	-167.6	0	113.6	S2669 I2670 S2676 V2677	S2669-K2673 PolarHBondContact O-N 3.06Å; S2669-K2673 VanDerWaalsContact O-N 3.13Å; I2670-K2673 PolarHBondContact O-N 2.96Å; I2670-K2673 VanDerWaalsContact O-N 3.07Å; K2673-S2676 PolarHBondContact O-OG 2.83Å; K2673-V2677 WeakPolarHBondContact O-CG2 3Å; K2673-V2677 PolarHBondContact O-N 3.3Å; K2673-V2677 VanDerWaalsContact O-N 3.12Å
2674	S	37.9	Very low	36.7	Very low	54 Å²	54	104.1 Å²	104.1	38%	0.378	52%	0.516	S	S	.	.	H	α-helix	trans	-70.3	-35.8	174.3	57.8	0	0	0	0	112.3	I2670 Q2671 V2677 N2678	I2670-S2674 PolarHBondContact O-N 3.33Å; I2670-S2674 PolarHBondContact O-OG 3.46Å; Q2671-S2674 WeakPolarHBondContact CA-OG 3.29Å; Q2671-S2674 PolarHBondContact O-N 2.93Å; Q2671-S2674 PolarHBondContact O-OG 3.33Å; S2674-V2677 PolarHBondContact O-N 3.28Å; S2674-N2678 WeakPolarHBondContact O-CB 3.12Å; S2674-N2678 PolarHBondContact O-N 3.45Å
2675	L	34.3	Very low	36.5	Very low	118 Å²	118	106.7 Å²	106.7	62%	0.618	53%	0.528	S	S	*	.	H	α-helix	trans	-70.5	-28.1	175.5	-78.6	165	0	0	0	113.4	Q2671 R2672	Q2671-L2675 WeakPolarHBondContact O-CB 3.18Å; Q2671-L2675 WeakPolarHBondContact O-CG 3.18Å; Q2671-L2675 PolarHBondContact O-N 3.23Å; R2672-L2675 PolarHBondContact O-N 3.05Å
2676	S	36.2	Very low	36.4	Very low	64 Å²	64	108.1 Å²	108.1	45%	0.448	54%	0.54	S	S	.	.	H	α-helix	trans	-74.6	-42.9	171.1	60.9	0	0	0	0	111.9	R2672 K2673 N2678 K2679 T2680	R2672-S2676 PolarHBondContact O-N 3.33Å; R2672-S2676 PolarHBondContact O-OG 2.8Å; K2673-S2676 PolarHBondContact O-OG 2.83Å; S2676-N2678 VanDerWaalsContact C-N 3.32Å; S2676-N2678 PolarHBondContact O-N 2.79Å; S2676-K2679 PolarHBondContact O-N 2.71Å; S2676-T2680 PolarHBondContact O-N 2.76Å
2677	V	36.7	Very low	36.4	Very low	76 Å²	76	106.7 Å²	106.7	46%	0.461	54%	0.544	S	S	.	.	H	α-helix	trans	-66.2	-34	178.1	172.6	0	0	0	0	112.1	K2673 S2674 K2679 T2680 K2681	K2673-V2677 WeakPolarHBondContact O-CG2 3Å; K2673-V2677 PolarHBondContact O-N 3.3Å; K2673-V2677 VanDerWaalsContact O-N 3.12Å; S2674-V2677 PolarHBondContact O-N 3.28Å; V2677-K2679 PolarHBondContact O-N 3.17Å; V2677-T2680 PolarHBondContact O-N 2.77Å; V2677-T2680 PolarHBondContact O-OG1 3.01Å; V2677-T2680 VanDerWaalsContact O-OG1 3.13Å; V2677-K2681 PolarHBondContact O-N 2.62Å
2678	N	33.4	Very low	35.9	Very low	114 Å²	114	110.2 Å²	110.2	61%	0.61	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	16.6	172.6	-65.9	1.8	0	0	0	113.5	S2674 S2676	S2674-N2678 WeakPolarHBondContact O-CB 3.12Å; S2674-N2678 PolarHBondContact O-N 3.45Å; S2676-N2678 VanDerWaalsContact C-N 3.32Å; S2676-N2678 PolarHBondContact O-N 2.79Å
2679	K	31.3	Very low	35.7	Very low	183 Å²	183	115.5 Å²	115.5	80%	0.796	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.8	-8.8	163	-83.3	-169.4	169.9	-165.5	0	112.8	S2676 V2677	S2676-K2679 PolarHBondContact O-N 2.71Å; V2677-K2679 PolarHBondContact O-N 3.17Å
2680	T	33.8	Very low	35.5	Very low	118 Å²	118	121.4 Å²	121.4	72%	0.724	60%	0.601	S	S	*	*			trans	-106.5	20.1	170.8	57.5	0	0	0	0	111.5	S2676 V2677	S2676-T2680 PolarHBondContact O-N 2.76Å; V2677-T2680 PolarHBondContact O-N 2.77Å; V2677-T2680 PolarHBondContact O-OG1 3.01Å; V2677-T2680 VanDerWaalsContact O-OG1 3.13Å
2681	K	30.9	Very low	35	Very low	221 Å²	221	124.5 Å²	124.5	96%	0.961	62%	0.615	S	S	*	*			trans	-144	0	170.6	-75.2	-169	175.2	-171.2	0	107.6	V2677	V2677-K2681 PolarHBondContact O-N 2.62Å

Retrieved 2,681 of 2,681 residues in 2692.3 ms (Link to these results)

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