A0A087Y9N9_POEFO Loading...

Calcium-activated potassium channel subunit alpha-1

AlphaFold DB , UniProt , Accession A0A087Y9N9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,204 aa.

						>A0A087Y9N9_POEFO|A0A087Y9N9
MLAEAHGTDPHGSDSSMRTSSIDNNNNPDSSILISKMEGVVIPYTSEVPCDDYGQRMWWAFLASSMVTFFGGLFIILLWRTLKYLWTVCCHCNIKNKEAQKVNNPANNPTADKTTKGPDEKEEAAASEVGWMTSVKDWAGVMISAQTLTGRVLVVLVFALSIGALGIYFIDSSDPIESCQNFYKDFTLQIDMAFNVFFLLYFGLRFIAANDKLWFWLEVNSVVDFFTVPPVFVSVYLNRSWLGLRFLRALRLIQFSEILQFLNILKTSNSIKLVNLCSIFISTWLTAAGFIHLVENSGDPWENFENSQSLSYWECVYLLMVTMSTVGYGDVYAKTTLGRLFMVFFILGGLAMFASYVPEIIELIGNRKKYGGSYSAVNGRKHIVVCGHITLESVSNFLKDFLHKDRDDVNVEIVFLHNISPNLELEALFKRHFTQVEFYQGSVLNPHDLARVKIESADACLILANKYCADPDAEDASNIMRVISIKNYHPKIRIITQMLQYHNKAHLLNIPSWNWKEGDDAICLAELKAGFIAQSCLAQGLSTMLANLFSMRSFIEIEEDTWQKYYLEGVANEMYTEYLSSAFVGLSFPTVCELCYVKLKLLLIAIEFKSEQRESSILINPGNHVKLQEGTLGFFIASDAKEVKRAFFYCKACHDDITDPKRIKKCGCKRLEDEHPSTLSPKKKQRNGGMRNSPNCSPKMMSRHDPLLIPGNEQIENMDMNVKRYDSTGMFHWCPSKEIEKVILTRSEASMTVLSGHVVVCIFGDVTSALVGLRNLVMPLRASNFHYHELKPIVFVGSLDYLRREWETLHNFPKVSILPGTPLSRADLRAVNINLCDMCVILSANQNNIEDASLQDKECILASLNIKSMQFDDSIGVLQANSQGFTPPGMDRSSPDSSPVHGFVRQASVTTGSNIPIITELVNDSNVQFLDQDDDDDPDTELYLTQPFACGTAFAVSVLDSLMSATYFNDNILTLIRTLVTGGATPELEGLLAEENALRGGYSTPQTLANRDRCRVAQLALYDGPFADLGDGGCYGDLFCKALKTYNMLCFGIYRLRDAHLGTPSQCTKRYVITNPPYEFELVPTDLIFCLMQFDHNAGQSRTSLSHSSHSSHSSSKKSSSVHSVPPSNRQNRSSKSREAREKQNATRMNRMGQEKKWFTDEPENAYPRNIQIKPMSTHMANQVNQYKSTSSLIPPIREVEDEC
					

Structure Viewer

Loading PAE data...

(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	34.9	Very low	31.2	Very low	250 Å²	250	147.8 Å²	147.8	100%	1.232	85%	0.85	S	S	*	*				0	154	0	-77.1	176.3	167.6	0	0	108.5
2	L	31.7	Very low	30.6	Very low	170 Å²	170	141.5 Å²	141.5	89%	0.89	84%	0.841	S	S	*	*			trans	-90.8	151.4	-174.6	-71.9	150.9	0	0	0	112.3
3	A	29.1	Very low	30.2	Very low	104 Å²	104	138.8 Å²	138.8	86%	0.86	83%	0.834	S	S	*	*			trans	-166.6	104.3	142.5	0	0	0	0	0	110.4
4	E	29.9	Very low	29.8	Very low	176 Å²	176	139.3 Å²	139.3	82%	0.822	83%	0.83	S	S	*	*			trans	-101.3	163.1	162.4	-70.4	-178.6	113	0	0	110.1
5	A	27.4	Very low	29.7	Very low	101 Å²	101	138.3 Å²	138.3	84%	0.835	83%	0.832	S	S	*	*			trans	-149.2	121.2	161.2	0	0	0	0	0	111.6
6	H	29.6	Very low	29.7	Very low	180 Å²	180	136.9 Å²	136.9	83%	0.833	83%	0.832	S	S	*	*			trans	-69.8	166	162.7	-59.6	-94.2	0	0	0	110.1
7	G	27.8	Very low	29.6	Very low	71 Å²	71	140.4 Å²	140.4	73%	0.732	84%	0.839	S	S	*	*			cis	-175.1	-145.7	2.4	0	0	0	0	0	107.9
8	T	26.9	Very low	29.6	Very low	134 Å²	134	145.1 Å²	145.1	82%	0.822	84%	0.84	S	S	*	*			cis	-161.9	142.8	-1.2	47.9	0	0	0	0	110.3
9	D	28.9	Very low	29.4	Very low	156 Å²	156	144.4 Å²	144.4	83%	0.834	84%	0.838	S	S	*	*			trans	-76.4	-178.4	163.7	-92.6	-46.9	0	0	0	112.5
10	P	50.5	Low	29.4	Very low	96 Å²	96	141.6 Å²	141.6	62%	0.623	83%	0.827	S	S	*	*			cis	-134	-176.5	-35.9	37.4	-20.8	0	0	0	112.9
11	H	26.1	Very low	29.2	Very low	188 Å²	188	140 Å²	140	87%	0.87	82%	0.824	S	S	*	*				163	137.3	129	-96.6	-72.2	0	0	0	116.4
12	G	24.8	Very low	28.9	Very low	72 Å²	72	134.7 Å²	134.7	74%	0.742	80%	0.799	S	S	*	*			trans	81	155.2	152.2	0	0	0	0	0	118.2
13	S	25.2	Very low	28.7	Very low	107 Å²	107	133 Å²	133	75%	0.748	79%	0.791	S	S	*	*			cis	-166.4	153.9	-13.1	51.1	0	0	0	0	112.1
14	D	25	Very low	28.6	Very low	145 Å²	145	133.8 Å²	133.8	78%	0.775	78%	0.781	S	S	*	*			trans	61.8	112.5	151.2	-67.1	-14.5	0	0	0	123.7
15	S	27.4	Very low	28.3	Very low	124 Å²	124	131 Å²	131	87%	0.867	77%	0.772	S	S	*	*				95	137.9	122.2	77.6	0	0	0	0	120.1
16	S	30.5	Very low	28.2	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	77%	0.767	S	S	*	*			trans	-118	162.8	172.7	58.6	0	0	0	0	110.1
17	M	27.8	Very low	28	Very low	195 Å²	195	131.3 Å²	131.3	96%	0.961	77%	0.765	S	S	*	*			trans	-127.4	151.8	167.2	-140.1	176.1	-171.7	0	0	111.1
18	R	29.3	Very low	28.6	Very low	225 Å²	225	132.7 Å²	132.7	85%	0.849	76%	0.761	S	S	*	*			trans	-94.5	153.1	-160.7	-59.2	167.6	169.8	170.4	-6.2	113.8
19	T	26.4	Very low	28.5	Very low	132 Å²	132	132.9 Å²	132.9	81%	0.81	76%	0.758	S	S	*	*				-154	118.7	113	41.3	0	0	0	0	107.6
20	S	28.3	Very low	28.4	Very low	88 Å²	88	130.6 Å²	130.6	62%	0.615	75%	0.753	S	S	*	*				60.5	133.6	58.3	74.5	0	0	0	0	113.3
21	S	26.3	Very low	27.3	Very low	110 Å²	110	130.7 Å²	130.7	77%	0.769	76%	0.757	S	S	*	*			cis	-132.7	156.9	21	47.2	0	0	0	0	112.3
22	I	28.5	Very low	27.5	Very low	137 Å²	137	129.1 Å²	129.1	70%	0.703	75%	0.753	S	S	*	*			cis	86	139.8	32.1	-58.3	168.2	0	0	0	113.8
23	D	26.5	Very low	27.6	Very low	135 Å²	135	132.9 Å²	132.9	72%	0.722	76%	0.755	S	S	*	*			trans	82.3	140.5	169.7	-70.3	-37.7	0	0	0	120.7
24	N	26.6	Very low	27.7	Very low	120 Å²	120	134.7 Å²	134.7	64%	0.642	76%	0.755	S	S	*	*			cis	-168.9	167.6	-29.3	-140.1	-30	0	0	0	114.1
25	N	24.8	Very low	27.8	Very low	119 Å²	119	132.7 Å²	132.7	64%	0.636	75%	0.752	S	S	*	*			trans	74	132.8	143.9	-75.8	-31.2	0	0	0	125.5
26	N	25.6	Very low	27.7	Very low	136 Å²	136	135.6 Å²	135.6	73%	0.727	75%	0.75	S	S	*	*			trans	78.1	109.7	135.5	-62.2	-13.1	0	0	0	124.1
27	N	25	Very low	27.7	Very low	150 Å²	150	138.5 Å²	138.5	80%	0.802	75%	0.752	S	S	*	*				15.8	155.7	108.1	-76.2	9.2	0	0	0	120.8
28	P	40.1	Very low	27.7	Very low	100 Å²	100	138.3 Å²	138.3	65%	0.649	75%	0.749	S	S	*	*			cis	-142	-166.2	-17.4	40	-19.1	0	0	0	115.1
29	D	25.4	Very low	27.9	Very low	139 Å²	139	131 Å²	131	74%	0.743	74%	0.743	S	S	*	*			trans	65.7	110.8	145.4	-66.7	-29.1	0	0	0	124.2
30	S	26.6	Very low	28.1	Very low	107 Å²	107	130.9 Å²	130.9	75%	0.748	74%	0.742	S	S	*	*				98	143.9	119	79.1	0	0	0	0	123.4
31	S	26.5	Very low	28.4	Very low	99 Å²	99	133.2 Å²	133.2	69%	0.692	75%	0.752	S	S	*	*			trans	81.2	79.1	151.3	66.3	0	0	0	0	123.1
32	I	30.7	Very low	28.8	Very low	155 Å²	155	133.3 Å²	133.3	80%	0.795	74%	0.743	S	S	*	*				67.3	133.4	103.1	-69	170	0	0	0	121.6
33	L	27.9	Very low	29.1	Very low	150 Å²	150	132.9 Å²	132.9	79%	0.785	75%	0.749	S	S	*	*			trans	79.8	97.3	154.7	-85.2	167	0	0	0	122.2
34	I	27.2	Very low	29.4	Very low	145 Å²	145	133.2 Å²	133.2	74%	0.744	74%	0.742	S	S	*	*				164.9	126.2	98.5	-87	157	0	0	0	113.3
35	S	27.1	Very low	29.6	Very low	103 Å²	103	134 Å²	134	72%	0.72	75%	0.751	S	S	*	*			trans	-7.3	143	168.4	64.7	0	0	0	0	119.8
36	K	25.6	Very low	30	Very low	186 Å²	186	132.8 Å²	132.8	81%	0.809	75%	0.752	S	S	*	*				-166.9	134.1	66.8	-149	178.4	-171.5	-178.7	0	115.8
37	M	28.8	Very low	30.3	Very low	177 Å²	177	134.7 Å²	134.7	87%	0.872	76%	0.756	S	S	*	*			trans	57.9	141.5	159.6	-95.9	165.8	161.5	0	0	120.3
38	E	29.5	Very low	31.1	Very low	191 Å²	191	132.7 Å²	132.7	89%	0.893	75%	0.749	S	S	*	*			trans	-93.5	152.9	-167.9	-64.1	147.9	114.3	0	0	114
39	G	31.9	Very low	31.4	Very low	71 Å²	71	132.2 Å²	132.2	73%	0.732	75%	0.746	S	S	*	*			trans	-145.5	114.2	158.3	0	0	0	0	0	108.3
40	V	31.8	Very low	32.7	Very low	130 Å²	130	128 Å²	128	79%	0.788	73%	0.727	S	S	*	*			trans	-77.7	129.8	-175	177.7	0	0	0	0	110.4	I42	V40-I42 HydrophobicContact CG1-CG1 4.21Å
41	V	33.8	Very low	33.9	Very low	137 Å²	137	127.6 Å²	127.6	83%	0.83	72%	0.716	S	S	*	*			trans	-132.5	130.6	172.5	-178.6	0	0	0	0	108.1
42	I	35	Very low	34.8	Very low	113 Å²	113	130.9 Å²	130.9	58%	0.579	73%	0.726	S	S	*	*			trans	-115.6	138.2	-179.9	-62.4	177.6	0	0	0	107.6	V40	V40-I42 HydrophobicContact CG1-CG1 4.21Å
43	P	35.5	Very low	35.8	Very low	127 Å²	127	133.5 Å²	133.5	83%	0.825	73%	0.728	S	S	*	*			trans	-71	166.4	-172	28	-35.7	0	0	0	114.6
44	Y	32.4	Very low	37.1	Very low	143 Å²	143	129 Å²	129	56%	0.561	72%	0.718	S	S	*	*			trans	-122.1	147.7	-163.8	169.4	-103.4	0	0	0	112
45	T	31.2	Very low	38.8	Very low	137 Å²	137	128.6 Å²	128.6	84%	0.84	71%	0.712	S	S	*	*			trans	-121.1	146.3	163.2	46.2	0	0	0	0	109.1
46	S	32.6	Very low	40.7	Very low	93 Å²	93	131.6 Å²	131.6	65%	0.65	71%	0.708	S	S	*	*			trans	-107.8	122.5	-148.8	57.5	0	0	0	0	115.8
47	E	32.2	Very low	43.4	Very low	176 Å²	176	124.9 Å²	124.9	82%	0.822	68%	0.68	S	S	*	*	S	Bend		-157.6	140.4	125.4	-110.5	165.7	-147.8	0	0	110.6
48	V	41.6	Very low	45.9	Very low	107 Å²	107	121.2 Å²	121.2	65%	0.648	66%	0.657	S	S	*	*			trans	44.8	97.3	177.4	-167.4	0	0	0	0	117.2
49	P	45.8	Very low	48.6	Very low	90 Å²	90	118.9 Å²	118.9	58%	0.584	64%	0.64	S	S	*	*			trans	-73.3	141.2	168.9	31.2	-34.2	0	0	0	112.3
50	C	54.1	Low	51.2	Low	50 Å²	50	116.5 Å²	116.5	34%	0.338	61%	0.613	S	S	.	*	S	Bend	trans	-86	-17.2	172.2	-88.2	0	0	0	0	114.2	C179	C50-C179 WeakPolarHBondContact CB-SG 3.38Å; C50-C179 WeakPolarHBondContact SG-CB 3.41Å; C50-C179 CovalentContact SG-SG 2.04Å; C50-C179 PolarHBondContact SG-SG 3.33Å
51	D	50	Low	53.9	Low	99 Å²	99	110.4 Å²	110.4	53%	0.529	58%	0.576	S	S	.	*	S	Bend	trans	-154.5	151.3	-176.8	-84.8	-66.1	0	0	0	110.3	Y53 G54 R239	D51-Y53 PolarHBondContact O-N 3.07Å; D51-G54 PolarHBondContact O-N 3Å; D51-R239 IonicContact OD2-NH2 3.17Å; D51-R239 PolarHBondContact OD2-NH2 3.28Å; D51-R239 VanDerWaalsContact OD2-NH2 3.17Å
52	D	45.8	Very low	56.6	Low	169 Å²	169	106.5 Å²	106.5	90%	0.904	55%	0.55	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-15.5	179.6	-72	-32.8	0	0	0	114.6
53	Y	52.3	Low	59.2	Low	210 Å²	210	103.1 Å²	103.1	82%	0.824	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.3	1.4	179.6	-72.8	-82.5	0	0	0	114.6	D51 Q55	D51-Y53 PolarHBondContact O-N 3.07Å; Y53-Q55 PolarHBondContact O-N 2.91Å
54	G	55.3	Low	61.9	Low	56 Å²	56	98.2 Å²	98.2	58%	0.577	51%	0.508	S	S	*	.			trans	62.5	14.3	169.5	0	0	0	0	0	117.6	D51	D51-G54 PolarHBondContact O-N 3Å
55	Q	62.2	Low	64.8	Low	135 Å²	135	91.5 Å²	91.5	63%	0.631	48%	0.482	S	S	*	.			trans	-74.1	136.9	-173.9	-67.1	-172.5	-13.2	0	0	113.3	Y53 R239	Y53-Q55 PolarHBondContact O-N 2.91Å; Q55-R239 PolarHBondContact O-NH1 3.3Å
56	R	67.3	Low	67.7	Low	167 Å²	167	88.3 Å²	88.3	63%	0.63	46%	0.458	S	S	*	.			trans	-73.3	135.5	171.4	-69.3	-172	-177.9	176.6	0.5	111	E177	R56-E177 WeakPolarHBondContact CB-OE2 3.16Å
57	M	81.6	Confident	70.6	Confident	45 Å²	45	88.9 Å²	88.9	22%	0.222	46%	0.458	C	S	.	.			trans	-120.1	10.6	-170.4	-68.2	-65.1	-76.2	0	0	114.1	W59 A60 F61 E177	M57-W59 HydrophobicContact CE-CH2 4.27Å; M57-W59 HydrophobicContact CE-CZ2 3.6Å; M57-W59 PolarHBondContact O-N 3.12Å; M57-W59 HydrophobicContact SD-CZ2 3.78Å; M57-A60 WeakPolarHBondContact O-CB 3.04Å; M57-A60 PolarHBondContact O-N 3.23Å; M57-F61 WeakPolarHBondContact O-CD2 3.44Å; M57-E177 PolarHBondContact N-OE1 3.44Å; M57-E177 PolarHBondContact N-OE2 3.4Å
58	W	82.5	Confident	73.5	Confident	100 Å²	100	83.2 Å²	83.2	38%	0.379	44%	0.435	S	S	.	.	H	α-helix	trans	-44	-34.6	175.9	67.2	-91.4	0	0	0	115.1	A60 F61 L62 E177 W241	W58-A60 VanDerWaalsContact C-N 3.27Å; W58-A60 PolarHBondContact O-N 3.08Å; W58-F61 WeakPolarHBondContact O-CB 3.11Å; W58-F61 PolarHBondContact O-N 3.05Å; W58-L62 HydrophobicContact CZ3-CD2 4.26Å; W58-L62 PolarHBondContact O-N 3.16Å; W58-E177 PolarHBondContact N-OE2 2.76Å; W58-W241 HydrophobicContact CB-CD2 4.29Å; W58-W241 HydrophobicContact CB-CG 4.27Å; W58-W241 HydrophobicContact CB-CZ2 4.34Å; W58-W241 HydrophobicContact CE3-CZ2 4.29Å
59	W	85	Confident	75.9	Confident	142 Å²	142	79.4 Å²	79.4	54%	0.538	41%	0.41	S	S	.	.	H	α-helix	trans	-62	-30	-179.2	59.6	-92.6	0	0	0	113.2	M57 F61 L62 A63	M57-W59 HydrophobicContact CE-CH2 4.27Å; M57-W59 HydrophobicContact CE-CZ2 3.6Å; M57-W59 PolarHBondContact O-N 3.12Å; M57-W59 HydrophobicContact SD-CZ2 3.78Å; W59-F61 VanDerWaalsContact C-N 3.33Å; W59-F61 PolarHBondContact O-N 3.17Å; W59-L62 PolarHBondContact O-N 2.9Å; W59-A63 WeakPolarHBondContact O-CB 3.46Å; W59-A63 PolarHBondContact O-N 3.08Å
60	A	87.6	Confident	78.2	Confident	21 Å²	21	79.7 Å²	79.7	17%	0.174	40%	0.402	C	S	.	.	H	α-helix	trans	-65.9	-36	178.9	0	0	0	0	0	112.3	M57 W58 S64 V233 L237	M57-A60 WeakPolarHBondContact O-CB 3.04Å; M57-A60 PolarHBondContact O-N 3.23Å; W58-A60 VanDerWaalsContact C-N 3.27Å; W58-A60 PolarHBondContact O-N 3.08Å; A60-S64 PolarHBondContact O-N 2.04Å; A60-V233 HydrophobicContact CB-CG1 4.44Å; A60-L237 HydrophobicContact CB-CD1 4.35Å
61	F	88.6	Confident	80	Confident	1 Å²	1	78.7 Å²	78.7	0%	0.004	40%	0.4	C	S	.	.	H	α-helix	trans	-68.2	-47.4	178.2	-59.9	-103.2	0	0	0	111.1	M57 W58 W59 S64 S65 P230 V233 L237 R239 W241	M57-F61 WeakPolarHBondContact O-CD2 3.44Å; W58-F61 WeakPolarHBondContact O-CB 3.11Å; W58-F61 PolarHBondContact O-N 3.05Å; W59-F61 VanDerWaalsContact C-N 3.33Å; W59-F61 PolarHBondContact O-N 3.17Å; F61-S64 PolarHBondContact O-N 3.05Å; F61-S64 PolarHBondContact O-OG 2.81Å; F61-S65 PolarHBondContact O-N 3.23Å; F61-S65 PolarHBondContact O-OG 3.45Å; F61-P230 HydrophobicContact CB-CB 4.26Å; F61-P230 HydrophobicContact CD1-CB 4.16Å; F61-P230 WeakPolarHBondContact CD1-O 3.41Å; F61-V233 HydrophobicContact CD1-CB 4.09Å; F61-V233 HydrophobicContact CD1-CG1 3.88Å; F61-V233 HydrophobicContact CD2-CG1 4.3Å; F61-V233 HydrophobicContact CE1-CB 4.38Å; F61-V233 HydrophobicContact CE1-CG1 4.02Å; F61-V233 HydrophobicContact CE2-CG1 4.42Å; F61-V233 HydrophobicContact CG-CG1 4.03Å; F61-V233 HydrophobicContact CZ-CG1 4.29Å; F61-L237 HydrophobicContact CE2-CD1 4.18Å; F61-L237 HydrophobicContact CZ-CD1 4.33Å; F61-R239 WeakPolarHBondContact CZ-O 3.28Å; F61-W241 HydrophobicContact CB-CD2 4.22Å; F61-W241 HydrophobicContact CB-CE3 3.34Å; F61-W241 HydrophobicContact CB-CZ3 3.67Å; F61-W241 HydrophobicContact CD1-CB 4.1Å; F61-W241 HydrophobicContact CD1-CE3 4.35Å; F61-W241 HydrophobicContact CD2-CB 4.12Å; F61-W241 HydrophobicContact CD2-CE3 4.42Å; F61-W241 HydrophobicContact CD2-CG 4.47Å; F61-W241 HydrophobicContact CE1-CB 4.02Å; F61-W241 HydrophobicContact CE2-CB 4.06Å; F61-W241 HydrophobicContact CG-CB 4.15Å; F61-W241 HydrophobicContact CG-CD2 4.37Å; F61-W241 AromaticContact CG-CE3 3.84Å; F61-W241 HydrophobicContact CG-CE3 3.84Å; F61-W241 HydrophobicContact CZ-CB 4.01Å
62	L	89.4	Confident	81.9	Confident	55 Å²	55	74.6 Å²	74.6	29%	0.288	38%	0.381	S	S	.	.	H	α-helix	trans	-65.2	-41.5	176.3	-175.9	60.1	0	0	0	111.4	W58 W59 S64 S65 M66 W241 L244	W58-L62 HydrophobicContact CZ3-CD2 4.26Å; W58-L62 PolarHBondContact O-N 3.16Å; W59-L62 PolarHBondContact O-N 2.9Å; L62-S64 PolarHBondContact O-N 3.37Å; L62-S65 PolarHBondContact O-N 2.77Å; L62-M66 HydrophobicContact CD1-CG 4.44Å; L62-M66 HydrophobicContact CG-CG 4.37Å; L62-M66 WeakPolarHBondContact O-CB 3.49Å; L62-M66 VanDerWaalsContact O-CG 3.28Å; L62-M66 WeakPolarHBondContact O-CG 3.38Å; L62-M66 PolarHBondContact O-N 3.23Å; L62-W241 HydrophobicContact CB-CH2 4.19Å; L62-W241 HydrophobicContact CB-CZ3 4.48Å; L62-L244 HydrophobicContact CD1-CD1 3.89Å
63	A	90.1	Very high	84.1	Confident	42 Å²	42	67.9 Å²	67.9	35%	0.347	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-42.3	175.6	0	0	0	0	0	112.2	W59 S65 M66 V67	W59-A63 WeakPolarHBondContact O-CB 3.46Å; W59-A63 PolarHBondContact O-N 3.08Å; A63-S65 VanDerWaalsContact C-N 3.31Å; A63-S65 PolarHBondContact O-N 3.07Å; A63-M66 PolarHBondContact O-N 3.45Å; A63-V67 WeakPolarHBondContact O-CB 3.33Å; A63-V67 VanDerWaalsContact O-CG2 3.28Å; A63-V67 WeakPolarHBondContact O-CG2 3.46Å; A63-V67 PolarHBondContact O-N 2.93Å
64	S	93.1	Very high	86	Confident	25 Å²	25	64 Å²	64	18%	0.175	33%	0.333	C	S	.	.	H	α-helix	trans	-60.6	-39.5	177.1	75.7	0	0	0	0	112.6	A60 F61 L62 T68	A60-S64 PolarHBondContact O-N 2.04Å; F61-S64 PolarHBondContact O-N 3.05Å; F61-S64 PolarHBondContact O-OG 2.81Å; L62-S64 PolarHBondContact O-N 3.37Å; S64-T68 VanDerWaalsContact O-CB 3.31Å; S64-T68 WeakPolarHBondContact O-CB 3.46Å; S64-T68 PolarHBondContact O-N 3.31Å; S64-T68 PolarHBondContact O-OG1 3.47Å
65	S	93.4	Very high	87.8	Confident	1 Å²	1	66.9 Å²	66.9	1%	0.007	33%	0.334	C	S	.	.	H	α-helix	trans	-68.3	-48.3	177.1	-51.3	0	0	0	0	111.1	F61 L62 A63 T68 F69 F225 P230	F61-S65 PolarHBondContact O-N 3.23Å; F61-S65 PolarHBondContact O-OG 3.45Å; L62-S65 PolarHBondContact O-N 2.77Å; A63-S65 VanDerWaalsContact C-N 3.31Å; A63-S65 PolarHBondContact O-N 3.07Å; S65-T68 PolarHBondContact O-N 3.24Å; S65-F69 WeakPolarHBondContact O-CB 3.18Å; S65-F69 PolarHBondContact O-N 3.11Å; S65-F225 WeakPolarHBondContact CB-O 3.37Å; S65-P230 WeakPolarHBondContact OG-CD 3.48Å; S65-P230 VanDerWaalsContact OG-CG 3.25Å; S65-P230 WeakPolarHBondContact OG-CG 3.25Å
66	M	91.8	Very high	89.2	Confident	70 Å²	70	61.4 Å²	61.4	35%	0.345	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-48.9	177.5	-73.4	-80.6	119.9	0	0	112.2	L62 A63 F69 F70 F226	L62-M66 HydrophobicContact CD1-CG 4.44Å; L62-M66 HydrophobicContact CG-CG 4.37Å; L62-M66 WeakPolarHBondContact O-CB 3.49Å; L62-M66 VanDerWaalsContact O-CG 3.28Å; L62-M66 WeakPolarHBondContact O-CG 3.38Å; L62-M66 PolarHBondContact O-N 3.23Å; A63-M66 PolarHBondContact O-N 3.45Å; M66-F69 PolarHBondContact O-N 3.38Å; M66-F70 HydrophobicContact CE-CE2 4.5Å; M66-F70 WeakPolarHBondContact O-CB 3.42Å; M66-F70 WeakPolarHBondContact O-CD2 3.24Å; M66-F70 PolarHBondContact O-N 3.02Å; M66-F70 HydrophobicContact SD-CD2 4.25Å; M66-F70 HydrophobicContact SD-CE2 3.78Å; M66-F226 HydrophobicContact CE-CE1 3.47Å; M66-F226 VanDerWaalsContact CE-CE1 3.47Å; M66-F226 HydrophobicContact CE-CZ 3.47Å; M66-F226 VanDerWaalsContact CE-CZ 3.47Å
67	V	93.8	Very high	90.3	Very high	106 Å²	106	56.9 Å²	56.9	64%	0.642	30%	0.297	S	S	*	.	H	α-helix	trans	-66.2	-38.8	179.8	171.4	0	0	0	0	111	A63 G71	A63-V67 WeakPolarHBondContact O-CB 3.33Å; A63-V67 VanDerWaalsContact O-CG2 3.28Å; A63-V67 WeakPolarHBondContact O-CG2 3.46Å; A63-V67 PolarHBondContact O-N 2.93Å; V67-G71 VanDerWaalsContact O-CA 3.26Å; V67-G71 WeakPolarHBondContact O-CA 3.34Å; V67-G71 PolarHBondContact O-N 3.29Å
68	T	92.2	Very high	90.7	Very high	56 Å²	56	59.4 Å²	59.4	34%	0.344	31%	0.311	S	S	.	.	H	α-helix	trans	-62.4	-51.5	174.9	-58.8	0	0	0	0	111	S64 S65 G72 F225 P229	S64-T68 VanDerWaalsContact O-CB 3.31Å; S64-T68 WeakPolarHBondContact O-CB 3.46Å; S64-T68 PolarHBondContact O-N 3.31Å; S64-T68 PolarHBondContact O-OG1 3.47Å; S65-T68 PolarHBondContact O-N 3.24Å; T68-G72 PolarHBondContact O-N 3.09Å; T68-G72 VanDerWaalsContact O-N 3.11Å; T68-F225 HydrophobicContact CG2-CD1 3.9Å; T68-F225 HydrophobicContact CG2-CE1 4.38Å; T68-P229 HydrophobicContact CG2-CG 4.29Å
69	F	93.1	Very high	91	Very high	27 Å²	27	63.9 Å²	63.9	12%	0.118	33%	0.327	C	S	.	.	H	α-helix	trans	-64.1	-56.5	-177.6	176.9	-109.3	0	0	0	112.7	S65 M66 L73 W216 L217 V222 F225	S65-F69 WeakPolarHBondContact O-CB 3.18Å; S65-F69 PolarHBondContact O-N 3.11Å; M66-F69 PolarHBondContact O-N 3.38Å; F69-L73 VanDerWaalsContact O-CB 3.29Å; F69-L73 WeakPolarHBondContact O-CB 3.46Å; F69-L73 PolarHBondContact O-N 3.5Å; F69-W216 AromaticContact CD2-NE1 3.82Å; F69-W216 AromaticContact CE2-CD1 3.98Å; F69-W216 PolarHBondContact O-NE1 3.5Å; F69-L217 HydrophobicContact CE2-CD2 4.28Å; F69-L217 HydrophobicContact CZ-CD2 3.98Å; F69-V222 HydrophobicContact CE2-CG2 4.32Å; F69-F225 HydrophobicContact CB-CB 4.49Å; F69-F225 AromaticContact CD2-CD2 3.63Å; F69-F225 HydrophobicContact CD2-CD2 3.63Å; F69-F225 AromaticContact CD2-CE2 4Å; F69-F225 HydrophobicContact CD2-CE2 4Å; F69-F225 HydrophobicContact CD2-CG 4.4Å; F69-F225 HydrophobicContact CE2-CD2 4.37Å
70	F	92.8	Very high	91.3	Very high	96 Å²	96	61.5 Å²	61.5	42%	0.421	32%	0.318	S	S	.	.	H	α-helix	trans	-72.4	-37.6	-177.2	-73.9	-66.2	0	0	0	112.4	M66 L73 F74	M66-F70 HydrophobicContact CE-CE2 4.5Å; M66-F70 WeakPolarHBondContact O-CB 3.42Å; M66-F70 WeakPolarHBondContact O-CD2 3.24Å; M66-F70 PolarHBondContact O-N 3.02Å; M66-F70 HydrophobicContact SD-CD2 4.25Å; M66-F70 HydrophobicContact SD-CE2 3.78Å; F70-L73 HydrophobicContact CD1-CD2 4.4Å; F70-L73 PolarHBondContact O-N 3.35Å; F70-F74 HydrophobicContact CB-CD2 4.47Å; F70-F74 HydrophobicContact CB-CE2 4.45Å; F70-F74 WeakPolarHBondContact O-CB 3.4Å; F70-F74 WeakPolarHBondContact O-CD2 3.34Å; F70-F74 PolarHBondContact O-N 2.6Å
71	G	92.5	Very high	91.2	Very high	29 Å²	29	64.5 Å²	64.5	30%	0.299	34%	0.335	S	S	.	.	H	α-helix	trans	-60.8	-48.6	177	0	0	0	0	0	112	V67 F74 I75	V67-G71 VanDerWaalsContact O-CA 3.26Å; V67-G71 WeakPolarHBondContact O-CA 3.34Å; V67-G71 PolarHBondContact O-N 3.29Å; G71-F74 PolarHBondContact O-N 2.68Å; G71-I75 VanDerWaalsContact O-CG1 3.28Å; G71-I75 WeakPolarHBondContact O-CG1 3.43Å; G71-I75 PolarHBondContact O-N 3.13Å
72	G	90.6	Very high	91.2	Very high	13 Å²	13	69.5 Å²	69.5	13%	0.134	36%	0.361	C	S	.	.	H	α-helix	trans	-66.1	-37	175.3	0	0	0	0	0	113.4	T68 I75 I76 W216	T68-G72 PolarHBondContact O-N 3.09Å; T68-G72 VanDerWaalsContact O-N 3.11Å; G72-I75 PolarHBondContact O-N 3.23Å; G72-I76 WeakPolarHBondContact O-CG1 3.4Å; G72-I76 PolarHBondContact O-N 2.95Å; G72-W216 VanDerWaalsContact CA-CZ2 3.49Å
73	L	91.8	Very high	90.9	Very high	28 Å²	28	73.9 Å²	73.9	15%	0.147	38%	0.378	C	S	.	.	H	α-helix	trans	-61.2	-46.7	173.7	-178.3	62.7	0	0	0	111.5	F69 F70 I75 I76 L77 L213 L217	F69-L73 VanDerWaalsContact O-CB 3.29Å; F69-L73 WeakPolarHBondContact O-CB 3.46Å; F69-L73 PolarHBondContact O-N 3.5Å; F70-L73 HydrophobicContact CD1-CD2 4.4Å; F70-L73 PolarHBondContact O-N 3.35Å; L73-I75 PolarHBondContact O-N 2.97Å; L73-I76 PolarHBondContact O-N 3.03Å; L73-L77 HydrophobicContact CD1-CD1 4.34Å; L73-L77 HydrophobicContact CD1-CG 4.48Å; L73-L77 HydrophobicContact CG-CD1 4.15Å; L73-L77 WeakPolarHBondContact O-CB 3.44Å; L73-L77 VanDerWaalsContact O-CG 3.32Å; L73-L77 WeakPolarHBondContact O-CG 3.03Å; L73-L77 PolarHBondContact O-N 3.3Å; L73-L213 HydrophobicContact CD1-CD1 3.49Å; L73-L213 VanDerWaalsContact CD1-CD1 3.49Å; L73-L217 HydrophobicContact CD1-CD2 4.29Å
74	F	92.1	Very high	90.5	Very high	128 Å²	128	80 Å²	80	56%	0.561	39%	0.393	S	S	*	.	H	α-helix	trans	-62.6	-40.1	174.5	-79.8	-60.4	0	0	0	112	F70 G71 I76 L77 L78	F70-F74 HydrophobicContact CB-CD2 4.47Å; F70-F74 HydrophobicContact CB-CE2 4.45Å; F70-F74 WeakPolarHBondContact O-CB 3.4Å; F70-F74 WeakPolarHBondContact O-CD2 3.34Å; F70-F74 PolarHBondContact O-N 2.6Å; G71-F74 PolarHBondContact O-N 2.68Å; F74-I76 PolarHBondContact O-N 2.81Å; F74-L77 PolarHBondContact O-N 2.85Å; F74-L78 VanDerWaalsContact O-CB 3.24Å; F74-L78 WeakPolarHBondContact O-CB 3.24Å; F74-L78 WeakPolarHBondContact O-CG 3.34Å; F74-L78 PolarHBondContact O-N 3.04Å
75	I	92.7	Very high	89.8	Confident	117 Å²	117	83.5 Å²	83.5	60%	0.6	41%	0.409	S	S	*	.	H	α-helix	trans	-60.9	-43.6	175	-71.2	163.8	0	0	0	111.1	G71 G72 L73 W79	G71-I75 VanDerWaalsContact O-CG1 3.28Å; G71-I75 WeakPolarHBondContact O-CG1 3.43Å; G71-I75 PolarHBondContact O-N 3.13Å; G72-I75 PolarHBondContact O-N 3.23Å; L73-I75 PolarHBondContact O-N 2.97Å; I75-W79 VanDerWaalsContact O-CB 3.24Å; I75-W79 WeakPolarHBondContact O-CB 3.3Å; I75-W79 PolarHBondContact O-N 2.97Å
76	I	90.4	Very high	89	Confident	21 Å²	21	92.2 Å²	92.2	11%	0.108	44%	0.442	C	S	.	.	H	α-helix	trans	-66.1	-42	177.9	-68.9	167.1	0	0	0	111.4	G72 L73 F74 W79 R80 L213 W216	G72-I76 WeakPolarHBondContact O-CG1 3.4Å; G72-I76 PolarHBondContact O-N 2.95Å; L73-I76 PolarHBondContact O-N 3.03Å; F74-I76 PolarHBondContact O-N 2.81Å; I76-W79 PolarHBondContact O-N 2.8Å; I76-R80 WeakPolarHBondContact O-CG 3.39Å; I76-R80 PolarHBondContact O-N 3.14Å; I76-L213 HydrophobicContact CG2-CB 3.88Å; I76-L213 HydrophobicContact CG2-CD1 4.02Å; I76-W216 HydrophobicContact CD1-CB 3.95Å; I76-W216 HydrophobicContact CD1-CD2 3.6Å; I76-W216 HydrophobicContact CD1-CE3 3.45Å; I76-W216 VanDerWaalsContact CD1-CE3 3.45Å; I76-W216 HydrophobicContact CD1-CG 3.82Å; I76-W216 HydrophobicContact CD1-CZ3 4.21Å
77	L	90.5	Very high	88.1	Confident	72 Å²	72	92.6 Å²	92.6	38%	0.377	45%	0.448	S	S	.	.	H	α-helix	trans	-67.1	-44.2	177.4	-69.5	173.6	0	0	0	111.8	L73 F74 R80 T81 L213	L73-L77 HydrophobicContact CD1-CD1 4.34Å; L73-L77 HydrophobicContact CD1-CG 4.48Å; L73-L77 HydrophobicContact CG-CD1 4.15Å; L73-L77 WeakPolarHBondContact O-CB 3.44Å; L73-L77 VanDerWaalsContact O-CG 3.32Å; L73-L77 WeakPolarHBondContact O-CG 3.03Å; L73-L77 PolarHBondContact O-N 3.3Å; F74-L77 PolarHBondContact O-N 2.85Å; L77-R80 WeakPolarHBondContact O-CB 3.34Å; L77-R80 PolarHBondContact O-N 3.2Å; L77-T81 WeakPolarHBondContact O-CG2 3.36Å; L77-T81 PolarHBondContact O-N 2.83Å; L77-T81 PolarHBondContact O-OG1 3.16Å; L77-L213 HydrophobicContact CD2-CD1 4.14Å; L77-L213 HydrophobicContact CD2-CD2 4.1Å
78	L	90	Very high	86.9	Confident	98 Å²	98	92 Å²	92	51%	0.513	44%	0.444	S	S	.	.	H	α-helix	trans	-63.9	-40.2	174.8	-72.8	170	0	0	0	111.8	F74 R80 T81 L82	F74-L78 VanDerWaalsContact O-CB 3.24Å; F74-L78 WeakPolarHBondContact O-CB 3.24Å; F74-L78 WeakPolarHBondContact O-CG 3.34Å; F74-L78 PolarHBondContact O-N 3.04Å; L78-R80 VanDerWaalsContact C-N 3.33Å; L78-R80 PolarHBondContact O-N 2.83Å; L78-T81 WeakPolarHBondContact CA-OG1 3.44Å; L78-T81 PolarHBondContact O-N 3.42Å; L78-T81 PolarHBondContact O-OG1 2.84Å; L78-L82 WeakPolarHBondContact O-CB 3.37Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.5Å
79	W	90.1	Very high	85.6	Confident	193 Å²	193	93 Å²	93	73%	0.731	45%	0.453	S	S	*	.	H	α-helix	trans	-63.7	-39.4	175	-173.5	-98.2	0	0	0	111.9	I75 I76 K83	I75-W79 VanDerWaalsContact O-CB 3.24Å; I75-W79 WeakPolarHBondContact O-CB 3.3Å; I75-W79 PolarHBondContact O-N 2.97Å; I76-W79 PolarHBondContact O-N 2.8Å; W79-K83 VanDerWaalsContact O-CB 3.28Å; W79-K83 WeakPolarHBondContact O-CB 3.27Å; W79-K83 PolarHBondContact O-N 2.93Å
80	R	89.9	Confident	84	Confident	93 Å²	93	95 Å²	95	35%	0.351	47%	0.47	S	S	.	.	H	α-helix	trans	-63	-54.1	172.2	-77.6	-179.7	171.4	-138.9	-9.9	111.5	I76 L77 L78 L82 K83 Y84 D211	I76-R80 WeakPolarHBondContact O-CG 3.39Å; I76-R80 PolarHBondContact O-N 3.14Å; L77-R80 WeakPolarHBondContact O-CB 3.34Å; L77-R80 PolarHBondContact O-N 3.2Å; L78-R80 VanDerWaalsContact C-N 3.33Å; L78-R80 PolarHBondContact O-N 2.83Å; R80-L82 PolarHBondContact O-N 3.45Å; R80-K83 PolarHBondContact O-N 3.34Å; R80-Y84 VanDerWaalsContact O-CD2 3.29Å; R80-Y84 WeakPolarHBondContact O-CD2 3.48Å; R80-Y84 PolarHBondContact O-N 2.75Å; R80-D211 IonicContact CZ-OD1 2.85Å; R80-D211 IonicContact CZ-OD2 2.61Å; R80-D211 IonicContact NH1-OD2 3.58Å; R80-D211 IonicContact NH2-OD1 2.63Å; R80-D211 PolarHBondContact NH2-OD1 2.63Å; R80-D211 IonicContact NH2-OD2 3.85Å; R80-D211 PolarHBondContact NH2-OD2 2.82Å
81	T	86.9	Confident	82	Confident	84 Å²	84	98.1 Å²	98.1	52%	0.515	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-42.6	-177.5	56.1	0	0	0	0	111.6	L77 L78 K83 Y84 L85	L77-T81 WeakPolarHBondContact O-CG2 3.36Å; L77-T81 PolarHBondContact O-N 2.83Å; L77-T81 PolarHBondContact O-OG1 3.16Å; L78-T81 WeakPolarHBondContact CA-OG1 3.44Å; L78-T81 PolarHBondContact O-N 3.42Å; L78-T81 PolarHBondContact O-OG1 2.84Å; T81-K83 PolarHBondContact O-N 3.43Å; T81-Y84 PolarHBondContact O-N 2.95Å; T81-L85 WeakPolarHBondContact O-CB 3.44Å; T81-L85 PolarHBondContact O-N 2.86Å
82	L	87.3	Confident	79.7	Confident	105 Å²	105	101.6 Å²	101.6	55%	0.55	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-40.6	174.7	-71.8	170.3	0	0	0	112.3	L78 R80 L85 W86	L78-L82 WeakPolarHBondContact O-CB 3.37Å; L78-L82 WeakPolarHBondContact O-CG 3.41Å; L78-L82 PolarHBondContact O-N 3.5Å; R80-L82 PolarHBondContact O-N 3.45Å; L82-L85 PolarHBondContact O-N 3.02Å; L82-W86 VanDerWaalsContact O-CB 3.25Å; L82-W86 WeakPolarHBondContact O-CB 3.21Å; L82-W86 PolarHBondContact O-N 2.82Å
83	K	84.1	Confident	77.5	Confident	148 Å²	148	107.7 Å²	107.7	64%	0.643	53%	0.533	S	S	*	.	H	α-helix	trans	-64.2	-45.5	176.7	-171.8	-179.4	-179.8	-175	0	111.9	W79 R80 T81 W86 T87	W79-K83 VanDerWaalsContact O-CB 3.28Å; W79-K83 WeakPolarHBondContact O-CB 3.27Å; W79-K83 PolarHBondContact O-N 2.93Å; R80-K83 PolarHBondContact O-N 3.34Å; T81-K83 PolarHBondContact O-N 3.43Å; K83-W86 PolarHBondContact O-N 3.39Å; K83-T87 PolarHBondContact O-N 2.91Å; K83-T87 PolarHBondContact O-OG1 3.24Å
84	Y	81.3	Confident	75.1	Confident	171 Å²	171	113.6 Å²	113.6	67%	0.671	56%	0.564	S	S	*	*	H	α-helix	trans	-66.2	-42.9	176	-81.7	-72.6	0	0	0	112	R80 T81 W86 T87 V88	R80-Y84 VanDerWaalsContact O-CD2 3.29Å; R80-Y84 WeakPolarHBondContact O-CD2 3.48Å; R80-Y84 PolarHBondContact O-N 2.75Å; T81-Y84 PolarHBondContact O-N 2.95Å; Y84-W86 VanDerWaalsContact C-N 3.32Å; Y84-W86 PolarHBondContact O-N 3.25Å; Y84-T87 WeakPolarHBondContact CA-OG1 3.49Å; Y84-T87 PolarHBondContact O-N 3.02Å; Y84-T87 PolarHBondContact O-OG1 3.28Å; Y84-V88 WeakPolarHBondContact O-CG2 3.48Å; Y84-V88 PolarHBondContact O-N 2.83Å
85	L	79.1	Confident	72.4	Confident	98 Å²	98	116.4 Å²	116.4	51%	0.513	58%	0.575	S	S	.	*	H	α-helix	trans	-63.9	-36.4	177.4	-168.8	71.4	0	0	0	111.6	T81 L82 V88 C89	T81-L85 WeakPolarHBondContact O-CB 3.44Å; T81-L85 PolarHBondContact O-N 2.86Å; L82-L85 PolarHBondContact O-N 3.02Å; L85-V88 PolarHBondContact O-N 2.91Å; L85-C89 VanDerWaalsContact CD1-SG 3.53Å; L85-C89 VanDerWaalsContact O-CB 3.25Å; L85-C89 WeakPolarHBondContact O-CB 3.38Å; L85-C89 PolarHBondContact O-N 3.14Å
86	W	75.9	Confident	69.5	Low	184 Å²	184	118.1 Å²	118.1	70%	0.697	59%	0.586	S	S	*	*	H	α-helix	trans	-63.6	-44.7	174.1	-170.8	-96.1	0	0	0	111.6	L82 K83 Y84 V88 C90	L82-W86 VanDerWaalsContact O-CB 3.25Å; L82-W86 WeakPolarHBondContact O-CB 3.21Å; L82-W86 PolarHBondContact O-N 2.82Å; K83-W86 PolarHBondContact O-N 3.39Å; Y84-W86 VanDerWaalsContact C-N 3.32Å; Y84-W86 PolarHBondContact O-N 3.25Å; W86-V88 PolarHBondContact O-N 3.16Å; W86-C90 HydrophobicContact CD2-CB 4Å; W86-C90 HydrophobicContact CE3-CB 4.29Å; W86-C90 VanDerWaalsContact CE3-SG 3.58Å; W86-C90 HydrophobicContact CG-CB 4.36Å; W86-C90 HydrophobicContact CZ2-CB 4.4Å; W86-C90 WeakPolarHBondContact O-CA 3.26Å; W86-C90 WeakPolarHBondContact O-CB 3.25Å; W86-C90 PolarHBondContact O-N 3.36Å
87	T	72.5	Confident	67.1	Low	77 Å²	77	126.8 Å²	126.8	47%	0.472	62%	0.623	S	S	.	*	H	α-helix	trans	-65.8	-34.2	173.5	38.8	0	0	0	0	113.6	K83 Y84 H91	K83-T87 PolarHBondContact O-N 2.91Å; K83-T87 PolarHBondContact O-OG1 3.24Å; Y84-T87 WeakPolarHBondContact CA-OG1 3.49Å; Y84-T87 PolarHBondContact O-N 3.02Å; Y84-T87 PolarHBondContact O-OG1 3.28Å; T87-H91 VanDerWaalsContact O-CB 3.23Å; T87-H91 WeakPolarHBondContact O-CB 3.41Å
88	V	69.7	Low	64.3	Low	93 Å²	93	133 Å²	133	56%	0.564	65%	0.65	S	S	*	*	H	α-helix	trans	-81.3	-39.6	-178	171.4	0	0	0	0	112.7	Y84 L85 W86 C92	Y84-V88 WeakPolarHBondContact O-CG2 3.48Å; Y84-V88 PolarHBondContact O-N 2.83Å; L85-V88 PolarHBondContact O-N 2.91Å; W86-V88 PolarHBondContact O-N 3.16Å; V88-C92 WeakPolarHBondContact O-CB 3.47Å; V88-C92 PolarHBondContact O-SG 2.93Å
89	C	63.9	Low	61.7	Low	79 Å²	79	132.8 Å²	132.8	53%	0.534	66%	0.662	S	S	.	*	H	α-helix	trans	-94.1	-35.9	-176.3	-64.2	0	0	0	0	113.3	L85	L85-C89 VanDerWaalsContact CD1-SG 3.53Å; L85-C89 VanDerWaalsContact O-CB 3.25Å; L85-C89 WeakPolarHBondContact O-CB 3.38Å; L85-C89 PolarHBondContact O-N 3.14Å
90	C	59.5	Low	58.9	Low	68 Å²	68	132.3 Å²	132.3	46%	0.459	67%	0.668	S	S	.	*	S	Bend	trans	-99.9	-4.6	-174.3	-55.6	0	0	0	0	114	W86	W86-C90 HydrophobicContact CD2-CB 4Å; W86-C90 HydrophobicContact CE3-CB 4.29Å; W86-C90 VanDerWaalsContact CE3-SG 3.58Å; W86-C90 HydrophobicContact CG-CB 4.36Å; W86-C90 HydrophobicContact CZ2-CB 4.4Å; W86-C90 WeakPolarHBondContact O-CA 3.26Å; W86-C90 WeakPolarHBondContact O-CB 3.25Å; W86-C90 PolarHBondContact O-N 3.36Å
91	H	50.4	Low	56	Low	161 Å²	161	136.7 Å²	136.7	75%	0.745	69%	0.69	S	S	*	*	S	Bend	trans	-109.7	-8.7	172	-119.5	48.3	0	0	0	114.5	T87 N93	T87-H91 VanDerWaalsContact O-CB 3.23Å; T87-H91 WeakPolarHBondContact O-CB 3.41Å; H91-N93 VanDerWaalsContact C-N 3.29Å; H91-N93 PolarHBondContact O-N 3.23Å
92	C	45.6	Very low	53.4	Low	103 Å²	103	138.8 Å²	138.8	70%	0.696	70%	0.702	S	S	*	*	S	Bend	trans	-83.5	9.3	176.5	-77.7	0	0	0	0	114.8	V88	V88-C92 WeakPolarHBondContact O-CB 3.47Å; V88-C92 PolarHBondContact O-SG 2.93Å
93	N	44.8	Very low	50.6	Low	140 Å²	140	141.4 Å²	141.4	75%	0.749	72%	0.717	S	S	*	*	S	Bend	trans	-145.5	63.7	-179.3	-157.2	4.1	0	0	0	114.9	H91	H91-N93 VanDerWaalsContact C-N 3.29Å; H91-N93 PolarHBondContact O-N 3.23Å
94	I	41.3	Very low	48.1	Very low	153 Å²	153	141.3 Å²	141.3	79%	0.785	72%	0.723	S	S	*	*	S	Bend	trans	-162.3	118.1	140.8	-100.6	149.8	0	0	0	110.9
95	K	35.4	Very low	46.1	Very low	186 Å²	186	139.1 Å²	139.1	81%	0.809	73%	0.73	S	S	*	*			trans	50.5	106.7	156.9	-63.6	-175.8	178.5	180	0	121.9
96	N	31.4	Very low	43.8	Very low	153 Å²	153	138.2 Å²	138.2	82%	0.818	74%	0.737	S	S	*	*				44.8	121.3	120.7	-69.6	-12.9	0	0	0	122.5
97	K	40.2	Very low	41.6	Very low	203 Å²	203	137.4 Å²	137.4	88%	0.883	75%	0.746	S	S	*	*			trans	24.9	124.8	135.3	-69.3	-175.9	176.5	-179	0	119.3
98	E	31.8	Very low	39.4	Very low	203 Å²	203	141.1 Å²	141.1	95%	0.949	76%	0.763	S	S	*	*				-144.6	167.2	113.8	-127.9	168.5	-138.3	0	0	110.4
99	A	34.1	Very low	38.3	Very low	94 Å²	94	141.5 Å²	141.5	78%	0.777	77%	0.767	S	S	*	*			trans	-150	118.5	-167.4	0	0	0	0	0	114.4
100	Q	31.4	Very low	36.5	Very low	182 Å²	182	144.2 Å²	144.2	85%	0.85	78%	0.781	S	S	*	*			trans	-165.3	153.4	167.5	-94.1	-176.4	34.9	0	0	108.3
101	K	28.9	Very low	35.1	Very low	185 Å²	185	145.3 Å²	145.3	80%	0.804	80%	0.795	S	S	*	*			cis	-160.4	145.2	-25.8	-135.3	-179.2	-173.2	178.9	0	107.3
102	V	33.6	Very low	34.1	Very low	129 Å²	129	144.9 Å²	144.9	78%	0.782	80%	0.799	S	S	*	*			trans	-82.1	141.2	171.9	174.7	0	0	0	0	109.8
103	N	27.1	Very low	33.4	Very low	159 Å²	159	148.1 Å²	148.1	85%	0.85	80%	0.801	S	S	*	*			trans	-161.3	117.5	153.6	-107.5	1.7	0	0	0	112.7
104	N	31.7	Very low	32.5	Very low	147 Å²	147	147.7 Å²	147.7	79%	0.786	80%	0.804	S	S	*	*			trans	-81.5	176.2	146.3	-81.4	-16.3	0	0	0	107.8
105	P	40.5	Very low	31.9	Very low	124 Å²	124	146.8 Å²	146.8	81%	0.805	81%	0.806	S	S	*	*			cis	-144.2	-167.9	21.6	44.6	-23.8	0	0	0	117.2
106	A	30.1	Very low	31.7	Very low	79 Å²	79	147.9 Å²	147.9	65%	0.653	81%	0.81	S	S	*	*			trans	-48.8	155.8	179.3	0	0	0	0	0	119
107	N	29.6	Very low	31.5	Very low	168 Å²	168	143.8 Å²	143.8	90%	0.898	80%	0.804	S	S	*	*				-168.4	158.2	114.8	-98.8	-28.2	0	0	0	115.1
108	N	27.3	Very low	31.2	Very low	155 Å²	155	140.5 Å²	140.5	83%	0.829	80%	0.804	S	S	*	*			trans	-94.2	179.9	173.5	-96	-17.3	0	0	0	110.8
109	P	45.8	Very low	31.3	Very low	100 Å²	100	138.2 Å²	138.2	65%	0.649	80%	0.798	S	S	*	*			cis	-135.9	-167.4	-17.2	35.9	-15.2	0	0	0	114.4
110	T	26.7	Very low	31.2	Very low	136 Å²	136	143 Å²	143	83%	0.834	80%	0.804	S	S	*	*			trans	67.8	146.9	156.2	46.7	0	0	0	0	118.5
111	A	29.1	Very low	31.3	Very low	91 Å²	91	144.2 Å²	144.2	75%	0.752	81%	0.806	S	S	*	*			cis	-154.6	168.3	18.6	0	0	0	0	0	115.3
112	D	29.3	Very low	31.4	Very low	152 Å²	152	144.5 Å²	144.5	81%	0.813	81%	0.811	S	S	*	*			trans	76.2	172	150.6	-118	-41.2	0	0	0	123
113	K	30.5	Very low	31.4	Very low	171 Å²	171	147.6 Å²	147.6	74%	0.743	82%	0.817	S	S	*	*			trans	-114.9	163.3	-150.5	-63.9	163.8	179.9	164.9	0	115.4
114	T	27.4	Very low	31.6	Very low	132 Å²	132	144.5 Å²	144.5	81%	0.81	81%	0.813	S	S	*	*			trans	66.4	145	161.5	41.9	0	0	0	0	115.8
115	T	28.9	Very low	31.6	Very low	134 Å²	134	142.2 Å²	142.2	82%	0.822	81%	0.814	S	S	*	*			cis	-143	-165.3	20.1	-27.1	0	0	0	0	112
116	K	30	Very low	31.2	Very low	209 Å²	209	141 Å²	141	91%	0.909	82%	0.815	S	S	*	*			trans	-73.5	143.8	-173.7	-62.3	175.7	177.3	178.4	0	113.9
117	G	27.1	Very low	31.6	Very low	66 Å²	66	142.2 Å²	142.2	68%	0.68	82%	0.818	S	S	*	*			trans	158.6	105.5	159.5	0	0	0	0	0	112.6
118	P	35.1	Very low	32	Very low	135 Å²	135	143.4 Å²	143.4	88%	0.877	82%	0.819	S	S	*	*			trans	-103.1	61.5	-179.5	39.4	-32.5	0	0	0	112.3
119	D	34.1	Very low	33.4	Very low	154 Å²	154	140.9 Å²	140.9	82%	0.824	81%	0.808	S	S	*	*			trans	-99.7	163.7	155.5	-79.3	-58.1	0	0	0	108.6
120	E	32	Very low	34.7	Very low	195 Å²	195	138.1 Å²	138.1	91%	0.911	80%	0.798	S	S	*	*			trans	61	89.9	-176.1	-59.9	-174.9	175.9	0	0	115
121	K	33	Very low	37.3	Very low	207 Å²	207	142 Å²	142	90%	0.9	80%	0.798	S	S	*	*			trans	-88.3	140	151.3	-92.3	-171.7	172.2	-175	0	109.3
122	E	30.8	Very low	39.6	Very low	191 Å²	191	145.3 Å²	145.3	89%	0.893	80%	0.8	S	S	*	*			trans	-54.9	137.1	177.9	-62.6	162.9	105.3	0	0	112.5	A124	E122-A124 VanDerWaalsContact C-N 3.28Å; E122-A124 PolarHBondContact O-N 2.81Å
123	E	33.2	Very low	42.2	Very low	195 Å²	195	141.1 Å²	141.1	91%	0.911	78%	0.78	S	S	*	*			trans	-70.9	83	167.4	-70.4	-169.5	120.8	0	0	110.4	A125	E123-A125 PolarHBondContact O-N 2.89Å; E123-A125 VanDerWaalsContact O-N 3.08Å
124	A	32.3	Very low	44.8	Very low	93 Å²	93	135.9 Å²	135.9	77%	0.769	76%	0.764	S	S	*	*			trans	-61.7	110.2	159.5	0	0	0	0	0	108.1	E122 A126	E122-A124 VanDerWaalsContact C-N 3.28Å; E122-A124 PolarHBondContact O-N 2.81Å; A124-A126 PolarHBondContact O-N 3.48Å
125	A	30.8	Very low	47.7	Very low	99 Å²	99	132 Å²	132	82%	0.818	74%	0.74	S	S	*	*			trans	-51.2	112	-167.9	0	0	0	0	0	112.8	E123 S127	E123-A125 PolarHBondContact O-N 2.89Å; E123-A125 VanDerWaalsContact O-N 3.08Å; A125-S127 PolarHBondContact O-N 2.92Å
126	A	31.4	Very low	50.5	Low	98 Å²	98	128.4 Å²	128.4	81%	0.81	71%	0.713	S	S	*	*			trans	-71.3	101.1	178.7	0	0	0	0	0	110.2	A124 E128	A124-A126 PolarHBondContact O-N 3.48Å; A126-E128 PolarHBondContact O-N 2.69Å
127	S	39	Very low	53.2	Low	105 Å²	105	122.5 Å²	122.5	73%	0.734	69%	0.692	S	S	*	*			trans	-61.8	131.4	154.9	46.2	0	0	0	0	108.3	A125 V129	A125-S127 PolarHBondContact O-N 2.92Å; S127-V129 PolarHBondContact O-N 3.37Å; S127-V129 VanDerWaalsContact O-N 3.07Å
128	E	39.4	Very low	56.1	Low	194 Å²	194	126.3 Å²	126.3	91%	0.907	69%	0.686	S	S	*	*			trans	-56.9	118.3	-174.4	-67.5	-174.7	123.9	0	0	110.9	A126 G130	A126-E128 PolarHBondContact O-N 2.69Å; E128-G130 VanDerWaalsContact C-N 3.27Å; E128-G130 PolarHBondContact O-N 3.48Å
129	V	55.4	Low	58.6	Low	101 Å²	101	119.9 Å²	119.9	61%	0.612	64%	0.644	S	S	*	*			trans	-70.7	88.5	176.5	-177.8	0	0	0	0	107.8	S127 T133	S127-V129 PolarHBondContact O-N 3.37Å; S127-V129 VanDerWaalsContact O-N 3.07Å; V129-T133 VanDerWaalsContact CG1-OG1 3.27Å; V129-T133 WeakPolarHBondContact CG1-OG1 3.33Å
130	G	73.3	Confident	61	Low	42 Å²	42	113.8 Å²	113.8	43%	0.433	62%	0.617	S	S	.	*			trans	-55.7	144	-172	0	0	0	0	0	112.6	E128 M132 T133	E128-G130 VanDerWaalsContact C-N 3.27Å; E128-G130 PolarHBondContact O-N 3.48Å; G130-M132 PolarHBondContact O-N 3.19Å; G130-T133 PolarHBondContact O-N 3.32Å; G130-T133 PolarHBondContact O-OG1 3.13Å
131	W	81.7	Confident	63.6	Low	218 Å²	218	107.2 Å²	107.2	83%	0.826	59%	0.591	S	S	*	*	H	α-helix	trans	-37.7	-42.8	-177.8	179.6	-68.1	0	0	0	114.6	T133 S134 V135	W131-T133 PolarHBondContact O-N 2.82Å; W131-S134 PolarHBondContact O-N 2.91Å; W131-V135 WeakPolarHBondContact O-CG2 3.26Å; W131-V135 PolarHBondContact O-N 3.38Å
132	M	77.1	Confident	66.2	Low	161 Å²	161	98.9 Å²	98.9	79%	0.793	56%	0.555	S	S	*	*	H	α-helix	trans	-72.2	-21.5	-175.9	-167	160.6	62.1	0	0	114.7	G130 K136	G130-M132 PolarHBondContact O-N 3.19Å; M132-K136 VanDerWaalsContact O-CB 3.27Å; M132-K136 WeakPolarHBondContact O-CB 3.34Å; M132-K136 PolarHBondContact O-N 2.93Å
133	T	84.2	Confident	68.8	Low	64 Å²	64	91.5 Å²	91.5	39%	0.393	52%	0.522	S	S	.	.	H	α-helix	trans	-76.8	-47.5	166.9	49.5	0	0	0	0	110.3	V129 G130 W131 V135 K136 D137	V129-T133 VanDerWaalsContact CG1-OG1 3.27Å; V129-T133 WeakPolarHBondContact CG1-OG1 3.33Å; G130-T133 PolarHBondContact O-N 3.32Å; G130-T133 PolarHBondContact O-OG1 3.13Å; W131-T133 PolarHBondContact O-N 2.82Å; T133-V135 VanDerWaalsContact C-N 3.32Å; T133-V135 PolarHBondContact O-N 3.26Å; T133-K136 WeakPolarHBondContact O-CA 3.45Å; T133-K136 WeakPolarHBondContact O-CB 3.4Å; T133-K136 PolarHBondContact O-N 3.05Å; T133-D137 WeakPolarHBondContact O-CB 3.4Å; T133-D137 PolarHBondContact O-N 2.89Å
134	S	84.7	Confident	71	Confident	60 Å²	60	84 Å²	84	42%	0.42	49%	0.491	S	S	.	.	H	α-helix	trans	-56.6	-41.1	178.4	-55.8	0	0	0	0	113.4	W131 W138	W131-S134 PolarHBondContact O-N 2.91Å; S134-W138 WeakPolarHBondContact O-CB 3.29Å; S134-W138 PolarHBondContact O-N 3.26Å
135	V	87.8	Confident	73.1	Confident	51 Å²	51	79.7 Å²	79.7	31%	0.309	46%	0.455	S	S	.	.	H	α-helix	trans	-70.3	-36.6	175.8	169.8	0	0	0	0	112.4	W131 T133 A139 I207	W131-V135 WeakPolarHBondContact O-CG2 3.26Å; W131-V135 PolarHBondContact O-N 3.38Å; T133-V135 VanDerWaalsContact C-N 3.32Å; T133-V135 PolarHBondContact O-N 3.26Å; V135-A139 WeakPolarHBondContact O-CB 3.41Å; V135-A139 PolarHBondContact O-N 3.13Å; V135-I207 HydrophobicContact CG1-CG2 3.94Å
136	K	89	Confident	75.6	Confident	58 Å²	58	81.6 Å²	81.6	25%	0.252	45%	0.447	S	S	.	.	H	α-helix	trans	-65.4	-44.4	174.9	176.5	-166.9	171.7	-134.9	0	111.3	M132 T133 A139 G140 A208 N210	M132-K136 VanDerWaalsContact O-CB 3.27Å; M132-K136 WeakPolarHBondContact O-CB 3.34Å; M132-K136 PolarHBondContact O-N 2.93Å; T133-K136 WeakPolarHBondContact O-CA 3.45Å; T133-K136 WeakPolarHBondContact O-CB 3.4Å; T133-K136 PolarHBondContact O-N 3.05Å; K136-A139 PolarHBondContact O-N 3.27Å; K136-G140 PolarHBondContact O-N 2.61Å; K136-A208 WeakPolarHBondContact CE-O 3.48Å; K136-N210 VanDerWaalsContact CE-OD1 3.25Å; K136-N210 WeakPolarHBondContact CE-OD1 3.5Å; K136-N210 PolarHBondContact NZ-OD1 3.16Å
137	D	86.6	Confident	78.2	Confident	86 Å²	86	79.1 Å²	79.1	46%	0.46	42%	0.422	S	S	.	.	H	α-helix	trans	-70.3	-39.1	-177.6	-60.6	-25.6	0	0	0	110.6	T133 A139 G140 V141	T133-D137 WeakPolarHBondContact O-CB 3.4Å; T133-D137 PolarHBondContact O-N 2.89Å; D137-A139 PolarHBondContact O-N 3.11Å; D137-G140 PolarHBondContact O-N 3.16Å; D137-V141 WeakPolarHBondContact O-CG2 3.3Å; D137-V141 PolarHBondContact O-N 2.87Å
138	W	87.8	Confident	80.4	Confident	145 Å²	145	80.9 Å²	80.9	55%	0.549	42%	0.422	S	S	.	.	H	α-helix	trans	-56.7	-47.8	168.4	173.9	82.7	0	0	0	112.4	S134 G140 V141 M142 L204	S134-W138 WeakPolarHBondContact O-CB 3.29Å; S134-W138 PolarHBondContact O-N 3.26Å; W138-G140 VanDerWaalsContact C-N 3.35Å; W138-G140 PolarHBondContact O-N 3.12Å; W138-V141 PolarHBondContact O-N 3.16Å; W138-M142 HydrophobicContact CH2-SD 3.91Å; W138-M142 HydrophobicContact CZ2-CG 4.34Å; W138-M142 HydrophobicContact CZ2-SD 3.55Å; W138-M142 VanDerWaalsContact CZ2-SD 3.55Å; W138-M142 PolarHBondContact O-N 3.21Å; W138-L204 HydrophobicContact CH2-CD2 4.17Å; W138-L204 HydrophobicContact CZ3-CD2 3.81Å
139	A	86.9	Confident	82.8	Confident	0 Å²	0	75.7 Å²	75.7	0%	0	40%	0.404	C	S	.	.	H	α-helix	trans	-63.7	-39.6	176.7	0	0	0	0	0	111.8	V135 K136 D137 V141 M142 I143 I207 A208	V135-A139 WeakPolarHBondContact O-CB 3.41Å; V135-A139 PolarHBondContact O-N 3.13Å; K136-A139 PolarHBondContact O-N 3.27Å; D137-A139 PolarHBondContact O-N 3.11Å; A139-V141 PolarHBondContact O-N 3.41Å; A139-M142 PolarHBondContact O-N 2.99Å; A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 3.48Å; A139-I207 HydrophobicContact CB-CB 4.26Å; A139-I207 HydrophobicContact CB-CG2 3.72Å; A139-A208 HydrophobicContact CB-CB 3.96Å
140	G	85.4	Confident	84.3	Confident	26 Å²	26	70.9 Å²	70.9	27%	0.268	38%	0.375	S	S	.	.	H	α-helix	trans	-61.3	-40.4	174.1	0	0	0	0	0	113.3	K136 D137 W138 M142 I143 S144	K136-G140 PolarHBondContact O-N 2.61Å; D137-G140 PolarHBondContact O-N 3.16Å; W138-G140 VanDerWaalsContact C-N 3.35Å; W138-G140 PolarHBondContact O-N 3.12Å; G140-M142 VanDerWaalsContact C-N 3.3Å; G140-M142 PolarHBondContact O-N 3.38Å; G140-I143 PolarHBondContact O-N 3.24Å; G140-S144 VanDerWaalsContact O-CB 3.23Å; G140-S144 WeakPolarHBondContact O-CB 3.15Å; G140-S144 PolarHBondContact O-N 3.28Å; G140-S144 PolarHBondContact O-OG 2.99Å
141	V	86.8	Confident	84.9	Confident	58 Å²	58	73.8 Å²	73.8	35%	0.352	37%	0.373	S	S	.	.	H	α-helix	trans	-70.2	-25	175.6	169.5	0	0	0	0	112.6	D137 W138 A139 T147	D137-V141 WeakPolarHBondContact O-CG2 3.3Å; D137-V141 PolarHBondContact O-N 2.87Å; W138-V141 PolarHBondContact O-N 3.16Å; A139-V141 PolarHBondContact O-N 3.41Å; V141-T147 HydrophobicContact CG1-CG2 3.48Å; V141-T147 VanDerWaalsContact CG1-CG2 3.48Å; V141-T147 PolarHBondContact O-OG1 3.1Å
142	M	86.5	Confident	85.2	Confident	32 Å²	32	67.1 Å²	67.1	16%	0.158	36%	0.356	C	S	.	.	H	α-helix	trans	-76.2	-45.8	169.4	-72.3	-142.5	67.7	0	0	112.8	W138 A139 G140 G150 L153	W138-M142 HydrophobicContact CH2-SD 3.91Å; W138-M142 HydrophobicContact CZ2-CG 4.34Å; W138-M142 HydrophobicContact CZ2-SD 3.55Å; W138-M142 VanDerWaalsContact CZ2-SD 3.55Å; W138-M142 PolarHBondContact O-N 3.21Å; A139-M142 PolarHBondContact O-N 2.99Å; G140-M142 VanDerWaalsContact C-N 3.3Å; G140-M142 PolarHBondContact O-N 3.38Å; M142-G150 WeakPolarHBondContact O-CA 3.5Å; M142-L153 HydrophobicContact CB-CD2 4.48Å; M142-L153 HydrophobicContact CE-CD2 4.26Å
143	I	85.3	Confident	85.8	Confident	36 Å²	36	60.5 Å²	60.5	19%	0.185	32%	0.324	C	S	.	.	H	α-helix	trans	-69.5	-37.1	-178.8	-63.2	-60.5	0	0	0	112.1	A139 G140 A145 L153 Y201 L204 R205 A208	A139-I143 WeakPolarHBondContact O-CG1 3.41Å; A139-I143 PolarHBondContact O-N 3.48Å; G140-I143 PolarHBondContact O-N 3.24Å; I143-A145 PolarHBondContact O-N 2.98Å; I143-A145 VanDerWaalsContact O-N 3.1Å; I143-L153 HydrophobicContact CD1-CD2 4.27Å; I143-Y201 HydrophobicContact CD1-CD2 4Å; I143-Y201 HydrophobicContact CD1-CE2 3.44Å; I143-Y201 VanDerWaalsContact CD1-CE2 3.44Å; I143-L204 HydrophobicContact CD1-CB 4.11Å; I143-R205 HydrophobicContact CD1-CG 3.79Å; I143-R205 HydrophobicContact CG1-CG 4.37Å; I143-A208 HydrophobicContact CG1-CB 4.47Å
144	S	79.1	Confident	86	Confident	38 Å²	38	57.7 Å²	57.7	27%	0.266	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	7.3	-174.5	58.6	0	0	0	0	116.1	G140 Q146	G140-S144 VanDerWaalsContact O-CB 3.23Å; G140-S144 WeakPolarHBondContact O-CB 3.15Å; G140-S144 PolarHBondContact O-N 3.28Å; G140-S144 PolarHBondContact O-OG 2.99Å; S144-Q146 PolarHBondContact O-N 3.44Å
145	A	77.8	Confident	86.1	Confident	2 Å²	2	58 Å²	58	2%	0.017	31%	0.305	C	S	.	.	S	Bend	trans	54	17.7	177.7	0	0	0	0	0	116	I143 T147 R151 V154 F261	I143-A145 PolarHBondContact O-N 2.98Å; I143-A145 VanDerWaalsContact O-N 3.1Å; A145-T147 VanDerWaalsContact C-N 3.33Å; A145-R151 HydrophobicContact CB-CG 4Å; A145-R151 VanDerWaalsContact O-CG 3.23Å; A145-R151 WeakPolarHBondContact O-CG 3.16Å; A145-R151 PolarHBondContact O-NE 3.5Å; A145-V154 HydrophobicContact CB-CG2 4.34Å; A145-F261 HydrophobicContact CB-CB 3.77Å; A145-F261 HydrophobicContact CB-CG 4.2Å
146	Q	81.8	Confident	86.2	Confident	139 Å²	139	59.2 Å²	59.2	65%	0.65	31%	0.31	S	S	*	.			trans	-69.5	-35	176.2	-64.7	179.4	4.2	0	0	111.1	S144	S144-Q146 PolarHBondContact O-N 3.44Å
147	T	87.3	Confident	86.2	Confident	46 Å²	46	56.6 Å²	56.6	28%	0.282	30%	0.299	S	S	.	.	S	Bend	trans	-90.8	154.5	176.4	51.9	0	0	0	0	112.3	V141 A145 T149 G150 R151	V141-T147 HydrophobicContact CG1-CG2 3.48Å; V141-T147 VanDerWaalsContact CG1-CG2 3.48Å; V141-T147 PolarHBondContact O-OG1 3.1Å; A145-T147 VanDerWaalsContact C-N 3.33Å; T147-T149 VanDerWaalsContact C-N 3.28Å; T147-T149 PolarHBondContact O-N 2.89Å; T147-T149 PolarHBondContact OG1-OG1 3.27Å; T147-G150 PolarHBondContact O-N 3.02Å; T147-G150 PolarHBondContact OG1-N 3.23Å; T147-G150 VanDerWaalsContact OG1-N 3.1Å; T147-R151 WeakPolarHBondContact O-CG 3.48Å; T147-R151 PolarHBondContact O-N 3.08Å
148	L	85.3	Confident	86.3	Confident	141 Å²	141	55.1 Å²	55.1	74%	0.738	29%	0.288	S	S	*	.	H	α-helix	trans	-58.7	-41.4	172.9	-179.8	63	0	0	0	111.6	R151 V152	L148-R151 PolarHBondContact O-N 3.48Å; L148-V152 WeakPolarHBondContact O-CG2 3.35Å; L148-V152 PolarHBondContact O-N 2.98Å
149	T	88	Confident	86.4	Confident	86 Å²	86	50.8 Å²	50.8	53%	0.528	28%	0.284	S	S	.	.	H	α-helix	trans	-63.8	-39.9	175.4	46.2	0	0	0	0	112.1	T147 V152 L153	T147-T149 VanDerWaalsContact C-N 3.28Å; T147-T149 PolarHBondContact O-N 2.89Å; T147-T149 PolarHBondContact OG1-OG1 3.27Å; T149-V152 PolarHBondContact O-N 2.57Å; T149-L153 WeakPolarHBondContact O-CB 3.43Å; T149-L153 PolarHBondContact O-N 2.97Å
150	G	87.1	Confident	86.7	Confident	0 Å²	0	52.4 Å²	52.4	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-40.4	172.3	0	0	0	0	0	113.4	M142 T147 L153 V154	M142-G150 WeakPolarHBondContact O-CA 3.5Å; T147-G150 PolarHBondContact O-N 3.02Å; T147-G150 PolarHBondContact OG1-N 3.23Å; T147-G150 VanDerWaalsContact OG1-N 3.1Å; G150-L153 WeakPolarHBondContact O-CB 3.35Å; G150-L153 PolarHBondContact O-N 3.31Å; G150-V154 WeakPolarHBondContact O-CB 3.31Å; G150-V154 WeakPolarHBondContact O-CG2 3.43Å; G150-V154 PolarHBondContact O-N 3.25Å
151	R	86.2	Confident	86.9	Confident	102 Å²	102	51.7 Å²	51.7	39%	0.385	28%	0.283	S	S	.	.	H	α-helix	trans	-63.4	-43.2	174.2	-68.9	176	-171.1	-171.7	1.4	112.2	A145 T147 L148 V154 V155 L262	A145-R151 HydrophobicContact CB-CG 4Å; A145-R151 VanDerWaalsContact O-CG 3.23Å; A145-R151 WeakPolarHBondContact O-CG 3.16Å; A145-R151 PolarHBondContact O-NE 3.5Å; T147-R151 WeakPolarHBondContact O-CG 3.48Å; T147-R151 PolarHBondContact O-N 3.08Å; L148-R151 PolarHBondContact O-N 3.48Å; R151-V154 PolarHBondContact O-N 2.62Å; R151-V155 WeakPolarHBondContact O-CG2 3.34Å; R151-V155 PolarHBondContact O-N 2.79Å; R151-L262 HydrophobicContact CB-CD2 4.36Å
152	V	89.1	Confident	87.2	Confident	79 Å²	79	52.7 Å²	52.7	48%	0.479	29%	0.286	S	S	.	.	H	α-helix	trans	-62.7	-43.7	175.2	172	0	0	0	0	110.8	L148 T149 V154 V155 L156	L148-V152 WeakPolarHBondContact O-CG2 3.35Å; L148-V152 PolarHBondContact O-N 2.98Å; T149-V152 PolarHBondContact O-N 2.57Å; V152-V154 PolarHBondContact O-N 2.9Å; V152-V155 PolarHBondContact O-N 3.41Å; V152-L156 HydrophobicContact CG1-CD1 3.9Å; V152-L156 HydrophobicContact CG1-CG 4.42Å; V152-L156 WeakPolarHBondContact O-CB 3.46Å; V152-L156 VanDerWaalsContact O-CG 3.28Å; V152-L156 WeakPolarHBondContact O-CG 3.48Å; V152-L156 PolarHBondContact O-N 3.08Å
153	L	90	Very high	87.5	Confident	22 Å²	22	52.4 Å²	52.4	12%	0.115	29%	0.29	C	S	.	.	H	α-helix	trans	-57.1	-48.5	174.4	179	65.9	0	0	0	111.5	M142 I143 T149 G150 L156 V157 F197 Y201 L204	M142-L153 HydrophobicContact CB-CD2 4.48Å; M142-L153 HydrophobicContact CE-CD2 4.26Å; I143-L153 HydrophobicContact CD1-CD2 4.27Å; T149-L153 WeakPolarHBondContact O-CB 3.43Å; T149-L153 PolarHBondContact O-N 2.97Å; G150-L153 WeakPolarHBondContact O-CB 3.35Å; G150-L153 PolarHBondContact O-N 3.31Å; L153-L156 PolarHBondContact O-N 2.79Å; L153-V157 VanDerWaalsContact O-CG2 3.25Å; L153-V157 WeakPolarHBondContact O-CG2 3.44Å; L153-V157 PolarHBondContact O-N 2.91Å; L153-F197 HydrophobicContact CD1-CE2 4.33Å; L153-F197 HydrophobicContact CD1-CZ 3.94Å; L153-Y201 HydrophobicContact CD1-CD2 4.3Å; L153-Y201 HydrophobicContact CD2-CD2 4.29Å; L153-Y201 HydrophobicContact CD2-CE2 4.37Å; L153-Y201 HydrophobicContact CG-CD2 4.3Å; L153-Y201 HydrophobicContact CG-CE2 4.42Å; L153-L204 HydrophobicContact CD2-CD1 3.94Å
154	V	86.7	Confident	87.8	Confident	4 Å²	4	50.7 Å²	50.7	2%	0.024	28%	0.282	C	S	.	.	H	α-helix	trans	-64.4	-40.4	179.9	165.4	0	0	0	0	112.5	A145 G150 R151 V152 V157 F158 I258	A145-V154 HydrophobicContact CB-CG2 4.34Å; G150-V154 WeakPolarHBondContact O-CB 3.31Å; G150-V154 WeakPolarHBondContact O-CG2 3.43Å; G150-V154 PolarHBondContact O-N 3.25Å; R151-V154 PolarHBondContact O-N 2.62Å; V152-V154 PolarHBondContact O-N 2.9Å; V154-V157 PolarHBondContact O-N 3.11Å; V154-F158 PolarHBondContact O-N 3.47Å; V154-F158 VanDerWaalsContact O-N 3.09Å; V154-I258 HydrophobicContact CG1-CB 4.31Å; V154-I258 HydrophobicContact CG1-CG1 4.01Å; V154-I258 HydrophobicContact CG1-CG2 3.87Å
155	V	87.6	Confident	88.4	Confident	66 Å²	66	49.4 Å²	49.4	40%	0.4	27%	0.272	S	S	.	.	H	α-helix	trans	-64.9	-40.1	173.9	171	0	0	0	0	111.6	R151 V152 F158 A159 L262	R151-V155 WeakPolarHBondContact O-CG2 3.34Å; R151-V155 PolarHBondContact O-N 2.79Å; V152-V155 PolarHBondContact O-N 3.41Å; V155-F158 PolarHBondContact O-N 2.99Å; V155-A159 WeakPolarHBondContact O-CB 3.5Å; V155-A159 PolarHBondContact O-N 2.77Å; V155-L262 HydrophobicContact CG2-CD1 3.85Å; V155-L262 HydrophobicContact CG2-CD2 3.79Å; V155-L262 HydrophobicContact CG2-CG 4.45Å
156	L	90.3	Very high	89.1	Confident	78 Å²	78	50.6 Å²	50.6	41%	0.408	29%	0.285	S	S	.	.	H	α-helix	trans	-65.4	-45.4	176.2	-72.6	169.3	0	0	0	111.5	V152 L153 F158 A159 L160 F197	V152-L156 HydrophobicContact CG1-CD1 3.9Å; V152-L156 HydrophobicContact CG1-CG 4.42Å; V152-L156 WeakPolarHBondContact O-CB 3.46Å; V152-L156 VanDerWaalsContact O-CG 3.28Å; V152-L156 WeakPolarHBondContact O-CG 3.48Å; V152-L156 PolarHBondContact O-N 3.08Å; L153-L156 PolarHBondContact O-N 2.79Å; L156-F158 VanDerWaalsContact C-N 3.26Å; L156-F158 PolarHBondContact O-N 3.38Å; L156-A159 PolarHBondContact O-N 2.93Å; L156-L160 HydrophobicContact CB-CD1 4.36Å; L156-L160 VanDerWaalsContact O-CB 3.24Å; L156-L160 WeakPolarHBondContact O-CB 3.5Å; L156-L160 WeakPolarHBondContact O-CD1 3.42Å; L156-L160 WeakPolarHBondContact O-CG 3.29Å; L156-L160 PolarHBondContact O-N 3.42Å; L156-F197 HydrophobicContact CB-CE2 4.27Å; L156-F197 HydrophobicContact CB-CZ 3.78Å
157	V	89.5	Confident	89.6	Confident	3 Å²	3	44.7 Å²	44.7	2%	0.018	26%	0.257	C	S	.	.	H	α-helix	trans	-54.8	-43.2	174.5	170.3	0	0	0	0	111.3	L153 V154 S161 F197 Y201	L153-V157 VanDerWaalsContact O-CG2 3.25Å; L153-V157 WeakPolarHBondContact O-CG2 3.44Å; L153-V157 PolarHBondContact O-N 2.91Å; V154-V157 PolarHBondContact O-N 3.11Å; V157-S161 VanDerWaalsContact O-CB 3.24Å; V157-S161 WeakPolarHBondContact O-CB 3.45Å; V157-S161 PolarHBondContact O-N 3.17Å; V157-S161 PolarHBondContact O-OG 3.11Å; V157-F197 HydrophobicContact CB-CE1 4.41Å; V157-F197 HydrophobicContact CG2-CE1 3.65Å; V157-F197 HydrophobicContact CG2-CZ 3.98Å; V157-Y201 HydrophobicContact CB-CE1 4.42Å; V157-Y201 HydrophobicContact CG1-CD1 4.08Å; V157-Y201 HydrophobicContact CG1-CE1 3.65Å; V157-Y201 HydrophobicContact CG2-CD1 3.83Å; V157-Y201 HydrophobicContact CG2-CD2 3.51Å; V157-Y201 HydrophobicContact CG2-CE1 3.86Å; V157-Y201 HydrophobicContact CG2-CE2 3.56Å; V157-Y201 HydrophobicContact CG2-CG 3.65Å
158	F	87.1	Confident	89.9	Confident	54 Å²	54	42.6 Å²	42.6	24%	0.237	24%	0.244	C	C	.	.	H	α-helix	trans	-64.8	-55	177.3	179.9	-114.8	0	0	0	112.6	V154 V155 L156 L160 S161 I162 F255 I258	V154-F158 PolarHBondContact O-N 3.47Å; V154-F158 VanDerWaalsContact O-N 3.09Å; V155-F158 PolarHBondContact O-N 2.99Å; L156-F158 VanDerWaalsContact C-N 3.26Å; L156-F158 PolarHBondContact O-N 3.38Å; F158-L160 VanDerWaalsContact C-N 3.34Å; F158-L160 PolarHBondContact O-N 3.39Å; F158-S161 PolarHBondContact O-N 2.91Å; F158-S161 VanDerWaalsContact O-N 3.13Å; F158-I162 HydrophobicContact CD2-CD1 4.47Å; F158-I162 HydrophobicContact CE1-CD1 3.8Å; F158-I162 HydrophobicContact CE2-CD1 3.72Å; F158-I162 HydrophobicContact CE2-CG1 4.35Å; F158-I162 HydrophobicContact CZ-CD1 3.34Å; F158-I162 HydrophobicContact CZ-CG1 4.41Å; F158-I162 PolarHBondContact O-N 3.28Å; F158-I162 VanDerWaalsContact O-N 3.08Å; F158-F255 HydrophobicContact CD2-CD2 4.06Å; F158-F255 HydrophobicContact CE1-CD2 4.31Å; F158-F255 HydrophobicContact CE1-CE2 4Å; F158-F255 HydrophobicContact CE2-CB 4.25Å; F158-F255 AromaticContact CE2-CD2 3.19Å; F158-F255 HydrophobicContact CE2-CD2 3.19Å; F158-F255 AromaticContact CE2-CE2 3.66Å; F158-F255 HydrophobicContact CE2-CE2 3.66Å; F158-F255 AromaticContact CE2-CG 3.93Å; F158-F255 HydrophobicContact CE2-CG 3.93Å; F158-F255 AromaticContact CZ-CD2 3.34Å; F158-F255 HydrophobicContact CZ-CD2 3.34Å; F158-F255 AromaticContact CZ-CE2 3.23Å; F158-F255 HydrophobicContact CZ-CE2 3.23Å; F158-F255 HydrophobicContact CZ-CG 4.31Å; F158-F255 HydrophobicContact CZ-CZ 4.15Å; F158-I258 HydrophobicContact CB-CD1 4.23Å; F158-I258 HydrophobicContact CB-CG2 4.16Å; F158-I258 HydrophobicContact CD2-CD1 4.23Å; F158-I258 HydrophobicContact CG-CG2 4.3Å
159	A	90.8	Very high	90.3	Very high	54 Å²	54	38.2 Å²	38.2	45%	0.446	22%	0.219	S	C	.	.	H	α-helix	trans	-61.2	-41.9	-177.6	0	0	0	0	0	112.2	V155 L156 S161 I162 G163	V155-A159 WeakPolarHBondContact O-CB 3.5Å; V155-A159 PolarHBondContact O-N 2.77Å; L156-A159 PolarHBondContact O-N 2.93Å; A159-S161 VanDerWaalsContact C-N 3.35Å; A159-I162 PolarHBondContact O-N 2.85Å; A159-G163 PolarHBondContact O-N 3.01Å
160	L	92.8	Very high	90.4	Very high	34 Å²	34	39.1 Å²	39.1	18%	0.178	22%	0.22	C	C	.	.	H	α-helix	trans	-71.5	-28.6	177.5	-61.8	169.7	0	0	0	111.9	L156 F158 G163 A164 F194 F197 F198	L156-L160 HydrophobicContact CB-CD1 4.36Å; L156-L160 VanDerWaalsContact O-CB 3.24Å; L156-L160 WeakPolarHBondContact O-CB 3.5Å; L156-L160 WeakPolarHBondContact O-CD1 3.42Å; L156-L160 WeakPolarHBondContact O-CG 3.29Å; L156-L160 PolarHBondContact O-N 3.42Å; F158-L160 VanDerWaalsContact C-N 3.34Å; F158-L160 PolarHBondContact O-N 3.39Å; L160-G163 PolarHBondContact O-N 3.15Å; L160-A164 WeakPolarHBondContact O-CB 3.34Å; L160-A164 PolarHBondContact O-N 3.33Å; L160-F194 HydrophobicContact CD2-CD1 3.58Å; L160-F194 HydrophobicContact CD2-CE1 3.38Å; L160-F194 HydrophobicContact CD2-CG 4.4Å; L160-F194 HydrophobicContact CD2-CZ 4.08Å; L160-F197 HydrophobicContact CD1-CB 4.3Å; L160-F197 HydrophobicContact CD1-CD1 3.43Å; L160-F197 VanDerWaalsContact CD1-CD1 3.43Å; L160-F197 HydrophobicContact CD1-CD2 3.97Å; L160-F197 HydrophobicContact CD1-CE1 3.61Å; L160-F197 HydrophobicContact CD1-CE2 4.11Å; L160-F197 HydrophobicContact CD1-CG 3.63Å; L160-F197 HydrophobicContact CD1-CZ 3.94Å; L160-F198 HydrophobicContact CB-CE1 4.43Å; L160-F198 HydrophobicContact CB-CZ 4.02Å
161	S	90.8	Very high	90.4	Very high	11 Å²	11	39.6 Å²	39.6	8%	0.077	22%	0.223	C	C	.	.	H	α-helix	trans	-69.5	-40.4	174.2	-65	0	0	0	0	111.9	V157 F158 A159 A164 L165 F198 R251	V157-S161 VanDerWaalsContact O-CB 3.24Å; V157-S161 WeakPolarHBondContact O-CB 3.45Å; V157-S161 PolarHBondContact O-N 3.17Å; V157-S161 PolarHBondContact O-OG 3.11Å; F158-S161 PolarHBondContact O-N 2.91Å; F158-S161 VanDerWaalsContact O-N 3.13Å; A159-S161 VanDerWaalsContact C-N 3.35Å; S161-A164 PolarHBondContact O-N 3.41Å; S161-L165 WeakPolarHBondContact O-CB 3.43Å; S161-L165 PolarHBondContact O-N 2.9Å; S161-L165 VanDerWaalsContact O-N 3.08Å; S161-F198 WeakPolarHBondContact OG-CE1 3.46Å; S161-R251 WeakPolarHBondContact OG-CD 3.48Å
162	I	91.7	Very high	90.6	Very high	80 Å²	80	35.1 Å²	35.1	41%	0.41	21%	0.207	S	C	.	.	H	α-helix	trans	-64.7	-42.6	170.3	-69.3	177.3	0	0	0	110.4	F158 A159 A164 L165 G166 L252	F158-I162 HydrophobicContact CD2-CD1 4.47Å; F158-I162 HydrophobicContact CE1-CD1 3.8Å; F158-I162 HydrophobicContact CE2-CD1 3.72Å; F158-I162 HydrophobicContact CE2-CG1 4.35Å; F158-I162 HydrophobicContact CZ-CD1 3.34Å; F158-I162 HydrophobicContact CZ-CG1 4.41Å; F158-I162 PolarHBondContact O-N 3.28Å; F158-I162 VanDerWaalsContact O-N 3.08Å; A159-I162 PolarHBondContact O-N 2.85Å; I162-A164 PolarHBondContact O-N 3.25Å; I162-L165 PolarHBondContact O-N 3.48Å; I162-G166 PolarHBondContact O-N 3.2Å; I162-L252 HydrophobicContact CG1-CD2 4.35Å
163	G	92.8	Very high	90.4	Very high	25 Å²	25	36.2 Å²	36.2	26%	0.258	22%	0.218	S	C	.	.	H	α-helix	trans	-57.8	-47.1	174.9	0	0	0	0	0	113.1	A159 L160 L165 G166 I167	A159-G163 PolarHBondContact O-N 3.01Å; L160-G163 PolarHBondContact O-N 3.15Å; G163-L165 VanDerWaalsContact C-N 3.3Å; G163-L165 PolarHBondContact O-N 3.5Å; G163-G166 PolarHBondContact O-N 3.37Å; G163-I167 WeakPolarHBondContact O-CG1 3.27Å; G163-I167 PolarHBondContact O-N 2.76Å
164	A	91.6	Very high	90	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-68.2	-27.1	178.8	0	0	0	0	0	113.4	L160 S161 I162 Y168 F194 F198 R248	L160-A164 WeakPolarHBondContact O-CB 3.34Å; L160-A164 PolarHBondContact O-N 3.33Å; S161-A164 PolarHBondContact O-N 3.41Å; I162-A164 PolarHBondContact O-N 3.25Å; A164-Y168 PolarHBondContact O-N 3.08Å; A164-F194 HydrophobicContact CB-CD2 3.99Å; A164-F198 HydrophobicContact CB-CE2 3.89Å; A164-F198 HydrophobicContact CB-CZ 4.33Å; A164-R248 VanDerWaalsContact O-CD 3.24Å; A164-R248 WeakPolarHBondContact O-CD 3.47Å; A164-R248 PolarHBondContact O-NH1 3.25Å
165	L	93.2	Very high	89.7	Confident	11 Å²	11	42.9 Å²	42.9	6%	0.058	26%	0.258	C	S	.	.	H	α-helix	trans	-75.4	-38.7	170.5	-178.4	61.9	0	0	0	111.6	S161 I162 G163 I167 Y168 F169 R248 A249 L252	S161-L165 WeakPolarHBondContact O-CB 3.43Å; S161-L165 PolarHBondContact O-N 2.9Å; S161-L165 VanDerWaalsContact O-N 3.08Å; I162-L165 PolarHBondContact O-N 3.48Å; G163-L165 VanDerWaalsContact C-N 3.3Å; G163-L165 PolarHBondContact O-N 3.5Å; L165-I167 VanDerWaalsContact C-N 3.34Å; L165-Y168 HydrophobicContact CD1-CD1 4.06Å; L165-Y168 WeakPolarHBondContact O-CB 3.45Å; L165-Y168 PolarHBondContact O-N 2.69Å; L165-Y168 VanDerWaalsContact O-N 3.15Å; L165-F169 HydrophobicContact CD1-CE1 3.84Å; L165-F169 HydrophobicContact CD1-CE2 4.43Å; L165-F169 HydrophobicContact CD1-CZ 3.77Å; L165-F169 HydrophobicContact CD2-CE2 4.26Å; L165-F169 HydrophobicContact CD2-CZ 3.96Å; L165-F169 HydrophobicContact CG-CE1 4.17Å; L165-F169 HydrophobicContact CG-CE2 3.85Å; L165-F169 HydrophobicContact CG-CZ 3.63Å; L165-F169 WeakPolarHBondContact O-CG 3.24Å; L165-F169 PolarHBondContact O-N 2.76Å; L165-R248 HydrophobicContact CD1-CB 4.47Å; L165-A249 HydrophobicContact CD1-CB 3.89Å; L165-A249 HydrophobicContact CD2-CB 4.44Å; L165-L252 HydrophobicContact CD2-CD1 3.91Å; L165-L252 HydrophobicContact CD2-CD2 4.49Å; L165-L252 HydrophobicContact CD2-CG 4.31Å
166	G	92.4	Very high	89.2	Confident	28 Å²	28	41.9 Å²	41.9	29%	0.289	25%	0.25	S	S	.	.	H	α-helix	trans	-61.7	-39.8	172.3	0	0	0	0	0	112.7	I162 G163 F169 I170	I162-G166 PolarHBondContact O-N 3.2Å; G163-G166 PolarHBondContact O-N 3.37Å; G166-F169 PolarHBondContact O-N 2.98Å; G166-I170 WeakPolarHBondContact O-CG1 3.4Å; G166-I170 PolarHBondContact O-N 3.11Å; G166-I170 VanDerWaalsContact O-N 3.14Å
167	I	92	Very high	88.8	Confident	14 Å²	14	40 Å²	40	7%	0.072	24%	0.24	C	C	.	.	H	α-helix	trans	-58.7	-47.3	169.8	-72.9	172.4	0	0	0	110.7	G163 L165 F169 I170 D171 T187 I190 D191 F194	G163-I167 WeakPolarHBondContact O-CG1 3.27Å; G163-I167 PolarHBondContact O-N 2.76Å; L165-I167 VanDerWaalsContact C-N 3.34Å; I167-F169 VanDerWaalsContact C-N 3.27Å; I167-F169 PolarHBondContact O-N 3.26Å; I167-I170 WeakPolarHBondContact O-CB 3.4Å; I167-I170 PolarHBondContact O-N 2.9Å; I167-D171 VanDerWaalsContact O-CG 3.25Å; I167-D171 PolarHBondContact O-N 3.1Å; I167-T187 HydrophobicContact CG1-CG2 4.47Å; I167-T187 HydrophobicContact CG2-CG2 3.84Å; I167-I190 HydrophobicContact CD1-CB 4.23Å; I167-I190 HydrophobicContact CD1-CG2 3.76Å; I167-D191 HydrophobicContact CD1-CB 4.12Å; I167-D191 HydrophobicContact CG2-CB 4.24Å; I167-F194 HydrophobicContact CD1-CD2 3.72Å; I167-F194 HydrophobicContact CD1-CE2 3.58Å
168	Y	92.4	Very high	88.2	Confident	2 Å²	2	40.8 Å²	40.8	1%	0.008	25%	0.245	C	C	.	.	H	α-helix	trans	-58.6	-37	176.2	166	-105.5	0	0	0	112.9	A164 L165 I170 D171 S172 L242 R245 F246 Y312	A164-Y168 PolarHBondContact O-N 3.08Å; L165-Y168 HydrophobicContact CD1-CD1 4.06Å; L165-Y168 WeakPolarHBondContact O-CB 3.45Å; L165-Y168 PolarHBondContact O-N 2.69Å; L165-Y168 VanDerWaalsContact O-N 3.15Å; Y168-I170 VanDerWaalsContact C-N 3.32Å; Y168-I170 PolarHBondContact O-N 3.14Å; Y168-D171 PolarHBondContact O-N 3.23Å; Y168-S172 VanDerWaalsContact O-CB 3.25Å; Y168-S172 WeakPolarHBondContact O-CB 3.47Å; Y168-S172 PolarHBondContact O-N 3.13Å; Y168-L242 HydrophobicContact CD2-CD1 3.77Å; Y168-L242 HydrophobicContact CE2-CD1 3.63Å; Y168-L242 HydrophobicContact CE2-CG 4.07Å; Y168-R245 HydrophobicContact CD2-CB 3.51Å; Y168-R245 HydrophobicContact CE2-CB 4.2Å; Y168-R245 HydrophobicContact CG-CB 4.24Å; Y168-F246 HydrophobicContact CE1-CB 3.85Å; Y168-F246 HydrophobicContact CE2-CB 4.02Å; Y168-Y312 HydrophobicContact CE1-CD2 4.06Å; Y168-Y312 AromaticContact CE1-CE2 3.7Å; Y168-Y312 HydrophobicContact CE1-CE2 3.7Å; Y168-Y312 AromaticContact CZ-CE2 4Å; Y168-Y312 VanDerWaalsContact OH-CD2 3.26Å; Y168-Y312 WeakPolarHBondContact OH-CD2 3.49Å; Y168-Y312 WeakPolarHBondContact OH-CE2 3.41Å
169	F	93.6	Very high	87.8	Confident	50 Å²	50	41 Å²	41	22%	0.219	25%	0.252	C	S	.	.	H	α-helix	trans	-67.7	-30	175.2	-61	-30.5	0	0	0	113.3	L165 G166 I167 S172 L285 Y312 W313	L165-F169 HydrophobicContact CD1-CE1 3.84Å; L165-F169 HydrophobicContact CD1-CE2 4.43Å; L165-F169 HydrophobicContact CD1-CZ 3.77Å; L165-F169 HydrophobicContact CD2-CE2 4.26Å; L165-F169 HydrophobicContact CD2-CZ 3.96Å; L165-F169 HydrophobicContact CG-CE1 4.17Å; L165-F169 HydrophobicContact CG-CE2 3.85Å; L165-F169 HydrophobicContact CG-CZ 3.63Å; L165-F169 WeakPolarHBondContact O-CG 3.24Å; L165-F169 PolarHBondContact O-N 2.76Å; G166-F169 PolarHBondContact O-N 2.98Å; I167-F169 VanDerWaalsContact C-N 3.27Å; I167-F169 PolarHBondContact O-N 3.26Å; F169-S172 PolarHBondContact O-OG 3.21Å; F169-L285 HydrophobicContact CZ-CD1 4.41Å; F169-Y312 HydrophobicContact CD1-CD1 4.02Å; F169-Y312 AromaticContact CD1-CE1 3.66Å; F169-Y312 HydrophobicContact CD1-CE1 3.66Å; F169-Y312 HydrophobicContact CE1-CD1 4.2Å; F169-Y312 AromaticContact CE1-CE1 3.38Å; F169-Y312 HydrophobicContact CE1-CE1 3.38Å; F169-Y312 AromaticContact CE1-CZ 3.75Å; F169-Y312 HydrophobicContact CZ-CE1 4.35Å; F169-W313 HydrophobicContact CB-CZ2 4.15Å; F169-W313 HydrophobicContact CD1-CH2 4.18Å; F169-W313 HydrophobicContact CD1-CZ2 4.29Å; F169-W313 HydrophobicContact CD2-CH2 4.11Å; F169-W313 HydrophobicContact CD2-CZ2 4.32Å; F169-W313 HydrophobicContact CE1-CH2 4.29Å; F169-W313 HydrophobicContact CE2-CH2 4.2Å; F169-W313 HydrophobicContact CG-CH2 4.11Å; F169-W313 HydrophobicContact CG-CZ2 4.02Å; F169-W313 HydrophobicContact CZ-CH2 4.29Å
170	I	90.3	Very high	87	Confident	105 Å²	105	39.7 Å²	39.7	54%	0.538	24%	0.237	S	C	.	.	H	α-helix	trans	-73.9	-49.9	172.3	-63.5	164.4	0	0	0	109.9	G166 I167 Y168 S172 S173	G166-I170 WeakPolarHBondContact O-CG1 3.4Å; G166-I170 PolarHBondContact O-N 3.11Å; G166-I170 VanDerWaalsContact O-N 3.14Å; I167-I170 WeakPolarHBondContact O-CB 3.4Å; I167-I170 PolarHBondContact O-N 2.9Å; Y168-I170 VanDerWaalsContact C-N 3.32Å; Y168-I170 PolarHBondContact O-N 3.14Å; I170-S172 PolarHBondContact O-N 3.23Å; I170-S172 VanDerWaalsContact O-N 3.11Å; I170-S173 PolarHBondContact O-N 3.45Å; I170-S173 PolarHBondContact O-OG 3.14Å
171	D	88.3	Confident	86.3	Confident	10 Å²	10	41.9 Å²	41.9	5%	0.053	25%	0.249	C	C	.	.	H	α-helix	trans	-56.5	-27.9	175.5	-61.2	-21.7	0	0	0	112.2	I167 Y168 S173 D174 L242 R245	I167-D171 VanDerWaalsContact O-CG 3.25Å; I167-D171 PolarHBondContact O-N 3.1Å; Y168-D171 PolarHBondContact O-N 3.23Å; D171-S173 PolarHBondContact O-N 2.96Å; D171-D174 WeakPolarHBondContact O-CB 3.13Å; D171-D174 PolarHBondContact O-N 3.35Å; D171-D174 VanDerWaalsContact O-N 3.09Å; D171-L242 HydrophobicContact CB-CD1 3.7Å; D171-R245 IonicContact OD1-NH1 3.6Å; D171-R245 WeakPolarHBondContact OD2-CD 3.45Å; D171-R245 IonicContact OD2-CZ 3.66Å; D171-R245 IonicContact OD2-NE 2.69Å; D171-R245 IonicContact OD2-NH1 2.75Å; D171-R245 PolarHBondContact OD2-NH1 3.06Å
172	S	89.1	Confident	85.7	Confident	8 Å²	8	43.7 Å²	43.7	6%	0.056	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.7	-9.7	-176.1	74.9	0	0	0	0	115.2	Y168 F169 I170	Y168-S172 VanDerWaalsContact O-CB 3.25Å; Y168-S172 WeakPolarHBondContact O-CB 3.47Å; Y168-S172 PolarHBondContact O-N 3.13Å; F169-S172 PolarHBondContact O-OG 3.21Å; I170-S172 PolarHBondContact O-N 3.23Å; I170-S172 VanDerWaalsContact O-N 3.11Å
173	S	85.6	Confident	84.9	Confident	102 Å²	102	49 Å²	49	71%	0.713	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.5	-10.6	167.8	46.1	0	0	0	0	114.1	I170 D171	I170-S173 PolarHBondContact O-N 3.45Å; I170-S173 PolarHBondContact O-OG 3.14Å; D171-S173 PolarHBondContact O-N 2.96Å
174	D	82.4	Confident	84.2	Confident	73 Å²	73	56.7 Å²	56.7	39%	0.39	30%	0.298	S	S	.	.	S	Bend	trans	-82.8	156	174.3	-88.3	10.7	0	0	0	111.2	D171 Q180	D171-D174 WeakPolarHBondContact O-CB 3.13Å; D171-D174 PolarHBondContact O-N 3.35Å; D171-D174 VanDerWaalsContact O-N 3.09Å; D174-Q180 PolarHBondContact OD2-NE2 2.84Å; D174-Q180 VanDerWaalsContact OD2-NE2 3.12Å
175	P	78.8	Confident	83.8	Confident	92 Å²	92	58.2 Å²	58.2	60%	0.597	31%	0.306	S	S	*	.			trans	-62	148.6	171.9	26.8	-34.7	0	0	0	112	E177	P175-E177 PolarHBondContact O-N 3.09Å
176	I	78.9	Confident	83.4	Confident	45 Å²	45	64.3 Å²	64.3	23%	0.231	33%	0.333	C	S	.	.	S	Bend	trans	-48.7	-36.5	-168.4	-54.4	173.4	0	0	0	114.4	W241 L242 N296	I176-W241 WeakPolarHBondContact O-CA 3.31Å; I176-W241 VanDerWaalsContact O-CD1 3.28Å; I176-L242 PolarHBondContact O-N 3.28Å; I176-N296 HydrophobicContact CD1-CB 3.85Å; I176-N296 WeakPolarHBondContact CD1-O 3.35Å; I176-N296 HydrophobicContact CG1-CB 4.3Å
177	E	80.1	Confident	83.1	Confident	39 Å²	39	64.8 Å²	64.8	18%	0.182	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	121.2	177.1	-172.3	176.5	161.9	0	0	108.5	R56 M57 W58 P175 R239 S240	R56-E177 WeakPolarHBondContact CB-OE2 3.16Å; M57-E177 PolarHBondContact N-OE1 3.44Å; M57-E177 PolarHBondContact N-OE2 3.4Å; W58-E177 PolarHBondContact N-OE2 2.76Å; P175-E177 PolarHBondContact O-N 3.09Å; E177-R239 HydrophobicContact CG-CG 4.19Å; E177-R239 WeakPolarHBondContact OE1-CD 3.47Å; E177-R239 IonicContact OE1-CZ 2.68Å; E177-R239 IonicContact OE1-NE 3.76Å; E177-R239 IonicContact OE1-NH1 3.44Å; E177-R239 PolarHBondContact OE1-NH1 3.12Å; E177-S240 WeakPolarHBondContact CA-O 3.4Å
178	S	78.5	Confident	82.8	Confident	20 Å²	20	64.2 Å²	64.2	14%	0.14	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.1	145.7	-172.4	71.3	0	0	0	0	113.1	Q180 R239 S240	S178-Q180 PolarHBondContact O-N 3.37Å; S178-R239 CarbonylContact O-C 3.6Å; S178-R239 WeakPolarHBondContact O-CA 3.24Å; S178-R239 VanDerWaalsContact O-CG 3.3Å; S178-R239 WeakPolarHBondContact O-CG 3.39Å; S178-S240 PolarHBondContact N-O 2.7Å; S178-S240 PolarHBondContact O-N 3.32Å
179	C	77.8	Confident	82.6	Confident	57 Å²	57	67.4 Å²	67.4	39%	0.385	34%	0.342	S	S	.	.			trans	-87.4	84.6	-177.1	-71.4	0	0	0	0	111.6	C50	C50-C179 WeakPolarHBondContact CB-SG 3.38Å; C50-C179 WeakPolarHBondContact SG-CB 3.41Å; C50-C179 CovalentContact SG-SG 2.04Å; C50-C179 PolarHBondContact SG-SG 3.33Å
180	Q	73.1	Confident	82.5	Confident	28 Å²	28	67.7 Å²	67.7	13%	0.131	35%	0.345	C	S	.	.			trans	-103.1	110.9	-178.8	-69.9	174.9	-13.5	0	0	111.5	D174 S178 F182 D185 N238 S240	D174-Q180 PolarHBondContact OD2-NE2 2.84Å; D174-Q180 VanDerWaalsContact OD2-NE2 3.12Å; S178-Q180 PolarHBondContact O-N 3.37Å; Q180-F182 PolarHBondContact O-N 3.21Å; Q180-D185 HydrophobicContact CB-CB 4.44Å; Q180-N238 CarbonylContact O-C 3.55Å; Q180-N238 VanDerWaalsContact O-O 3.12Å; Q180-S240 PolarHBondContact OE1-OG 2.8Å
181	N	78.4	Confident	82.5	Confident	80 Å²	80	62.7 Å²	62.7	43%	0.428	32%	0.32	S	S	.	.			trans	-73.7	122.6	174	-179	-38.7	0	0	0	110.2	Y183 K184 D185	N181-Y183 PolarHBondContact O-N 2.94Å; N181-Y183 PolarHBondContact OD1-N 3.03Å; N181-Y183 VanDerWaalsContact OD1-N 3.08Å; N181-K184 PolarHBondContact O-N 3.26Å; N181-D185 PolarHBondContact O-N 3.09Å; N181-D185 VanDerWaalsContact O-N 3.16Å
182	F	78.4	Confident	82.5	Confident	48 Å²	48	63.6 Å²	63.6	21%	0.211	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.2	-31.7	-173.8	179.9	-106	0	0	0	114.8	Q180 K184 L188 Q189 M192 V235 N238	Q180-F182 PolarHBondContact O-N 3.21Å; F182-K184 VanDerWaalsContact C-N 3.35Å; F182-L188 HydrophobicContact CD2-CD2 4.15Å; F182-L188 HydrophobicContact CD2-CG 4.12Å; F182-Q189 HydrophobicContact CD2-CG 4.38Å; F182-Q189 HydrophobicContact CE2-CG 3.98Å; F182-Q189 HydrophobicContact CZ-CG 4.11Å; F182-Q189 WeakPolarHBondContact O-CG 3.44Å; F182-Q189 PolarHBondContact O-NE2 3.49Å; F182-M192 HydrophobicContact CE2-CB 4.26Å; F182-M192 HydrophobicContact CE2-CG 4.45Å; F182-V235 HydrophobicContact CB-CG1 4.43Å; F182-V235 HydrophobicContact CD1-CG1 4.43Å; F182-V235 HydrophobicContact CD2-CB 4.31Å; F182-V235 HydrophobicContact CD2-CG1 3.77Å; F182-V235 HydrophobicContact CD2-CG2 3.59Å; F182-V235 HydrophobicContact CE2-CG1 4.09Å; F182-V235 HydrophobicContact CE2-CG2 3.81Å; F182-V235 HydrophobicContact CG-CG1 3.95Å; F182-V235 HydrophobicContact CG-CG2 4.49Å; F182-N238 PolarHBondContact N-OD1 3.06Å
183	Y	75.6	Confident	82.7	Confident	193 Å²	193	66.1 Å²	66.1	76%	0.757	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-12.2	-180	-65.3	-80.1	0	0	0	114.2	N181	N181-Y183 PolarHBondContact O-N 2.94Å; N181-Y183 PolarHBondContact OD1-N 3.03Å; N181-Y183 VanDerWaalsContact OD1-N 3.08Å
184	K	77.5	Confident	83.1	Confident	185 Å²	185	63 Å²	63	80%	0.804	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-37.9	-178.8	-73.3	-171	174.4	-175	0	113.4	N181 F182	N181-K184 PolarHBondContact O-N 3.26Å; F182-K184 VanDerWaalsContact C-N 3.35Å
185	D	82.8	Confident	83.6	Confident	32 Å²	32	59.6 Å²	59.6	17%	0.171	30%	0.301	C	S	.	.			trans	-84.4	126.5	176.9	176.9	37.9	0	0	0	111.5	Q180 N181 T187 L188 Q189	Q180-D185 HydrophobicContact CB-CB 4.44Å; N181-D185 PolarHBondContact O-N 3.09Å; N181-D185 VanDerWaalsContact O-N 3.16Å; D185-T187 WeakPolarHBondContact OD1-CB 3.43Å; D185-T187 PolarHBondContact OD1-N 3.46Å; D185-T187 PolarHBondContact OD1-OG1 3.43Å; D185-T187 VanDerWaalsContact OD1-OG1 3.07Å; D185-T187 WeakPolarHBondContact OD2-CB 3.36Å; D185-T187 PolarHBondContact OD2-N 2.93Å; D185-L188 WeakPolarHBondContact OD2-CB 3.41Å; D185-L188 PolarHBondContact OD2-N 3.05Å; D185-Q189 WeakPolarHBondContact O-CG 3.48Å; D185-Q189 PolarHBondContact O-NE2 3.03Å
186	F	86.1	Confident	84.3	Confident	140 Å²	140	58.1 Å²	58.1	61%	0.614	29%	0.29	S	S	*	.	H	α-helix	trans	-82.7	-24.9	177.2	-169.7	-123.4	0	0	0	111.9	Q189 I190	F186-Q189 PolarHBondContact O-N 2.7Å; F186-I190 HydrophobicContact CD1-CD1 3.87Å; F186-I190 HydrophobicContact CE1-CD1 3.54Å; F186-I190 HydrophobicContact CE1-CG1 4.39Å; F186-I190 HydrophobicContact CZ-CD1 3.9Å; F186-I190 HydrophobicContact CZ-CG1 4.38Å; F186-I190 WeakPolarHBondContact O-CG1 3.37Å; F186-I190 PolarHBondContact O-N 2.97Å; F186-I190 VanDerWaalsContact O-N 3.08Å
187	T	86.3	Confident	85.1	Confident	38 Å²	38	58.2 Å²	58.2	23%	0.233	29%	0.289	C	S	.	.	H	α-helix	trans	-66.6	-51.1	-178.8	-45.7	0	0	0	0	110.5	I167 D185 Q189 I190 D191	I167-T187 HydrophobicContact CG1-CG2 4.47Å; I167-T187 HydrophobicContact CG2-CG2 3.84Å; D185-T187 WeakPolarHBondContact OD1-CB 3.43Å; D185-T187 PolarHBondContact OD1-N 3.46Å; D185-T187 PolarHBondContact OD1-OG1 3.43Å; D185-T187 VanDerWaalsContact OD1-OG1 3.07Å; D185-T187 WeakPolarHBondContact OD2-CB 3.36Å; D185-T187 PolarHBondContact OD2-N 2.93Å; T187-Q189 VanDerWaalsContact C-N 3.29Å; T187-Q189 PolarHBondContact O-N 3.21Å; T187-I190 PolarHBondContact O-N 3.48Å; T187-D191 WeakPolarHBondContact O-CB 3.48Å; T187-D191 PolarHBondContact O-N 3.38Å
188	L	85.2	Confident	85.7	Confident	2 Å²	2	56.4 Å²	56.4	1%	0.01	28%	0.28	C	S	.	.	H	α-helix	trans	-62.9	-30.6	175	-174.7	61.4	0	0	0	113	F182 D185 M192 V235	F182-L188 HydrophobicContact CD2-CD2 4.15Å; F182-L188 HydrophobicContact CD2-CG 4.12Å; D185-L188 WeakPolarHBondContact OD2-CB 3.41Å; D185-L188 PolarHBondContact OD2-N 3.05Å; L188-M192 VanDerWaalsContact O-CB 3.26Å; L188-M192 WeakPolarHBondContact O-CB 3.47Å; L188-M192 PolarHBondContact O-N 3.25Å; L188-V235 HydrophobicContact CD1-CG2 4.03Å; L188-V235 HydrophobicContact CD2-CG2 4.1Å; L188-V235 HydrophobicContact CG-CG2 3.97Å
189	Q	88.2	Confident	86.4	Confident	68 Å²	68	59.6 Å²	59.6	32%	0.318	30%	0.295	S	S	.	.	H	α-helix	trans	-67.8	-45.2	173.9	-71.8	172.7	23.9	0	0	112	F182 D185 F186 T187 A193	F182-Q189 HydrophobicContact CD2-CG 4.38Å; F182-Q189 HydrophobicContact CE2-CG 3.98Å; F182-Q189 HydrophobicContact CZ-CG 4.11Å; F182-Q189 WeakPolarHBondContact O-CG 3.44Å; F182-Q189 PolarHBondContact O-NE2 3.49Å; D185-Q189 WeakPolarHBondContact O-CG 3.48Å; D185-Q189 PolarHBondContact O-NE2 3.03Å; F186-Q189 PolarHBondContact O-N 2.7Å; T187-Q189 VanDerWaalsContact C-N 3.29Å; T187-Q189 PolarHBondContact O-N 3.21Å; Q189-A193 PolarHBondContact O-N 3.03Å; Q189-A193 VanDerWaalsContact O-N 3.16Å
190	I	90.6	Very high	87.1	Confident	56 Å²	56	62.4 Å²	62.4	29%	0.287	31%	0.306	S	S	.	.	H	α-helix	trans	-67.1	-42.6	175.1	-64.3	175.8	0	0	0	110.3	I167 F186 T187 M192 A193 F194	I167-I190 HydrophobicContact CD1-CB 4.23Å; I167-I190 HydrophobicContact CD1-CG2 3.76Å; F186-I190 HydrophobicContact CD1-CD1 3.87Å; F186-I190 HydrophobicContact CE1-CD1 3.54Å; F186-I190 HydrophobicContact CE1-CG1 4.39Å; F186-I190 HydrophobicContact CZ-CD1 3.9Å; F186-I190 HydrophobicContact CZ-CG1 4.38Å; F186-I190 WeakPolarHBondContact O-CG1 3.37Å; F186-I190 PolarHBondContact O-N 2.97Å; F186-I190 VanDerWaalsContact O-N 3.08Å; T187-I190 PolarHBondContact O-N 3.48Å; I190-M192 VanDerWaalsContact C-N 3.33Å; I190-M192 PolarHBondContact O-N 2.89Å; I190-A193 WeakPolarHBondContact O-CB 3.25Å; I190-A193 PolarHBondContact O-N 3.46Å; I190-A193 VanDerWaalsContact O-N 3.11Å; I190-F194 HydrophobicContact CG2-CD1 4.05Å; I190-F194 HydrophobicContact CG2-CD2 4.11Å; I190-F194 HydrophobicContact CG2-CE1 3.53Å; I190-F194 HydrophobicContact CG2-CE2 3.6Å; I190-F194 HydrophobicContact CG2-CG 4.33Å; I190-F194 HydrophobicContact CG2-CZ 3.3Å; I190-F194 WeakPolarHBondContact O-CG 3.5Å; I190-F194 PolarHBondContact O-N 2.99Å
191	D	90	Very high	88	Confident	0 Å²	0	62 Å²	62	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-64	-38.9	179.9	-160.3	47.7	0	0	0	112	I167 T187 F194 N195 V231 R245 R248	I167-D191 HydrophobicContact CD1-CB 4.12Å; I167-D191 HydrophobicContact CG2-CB 4.24Å; T187-D191 WeakPolarHBondContact O-CB 3.48Å; T187-D191 PolarHBondContact O-N 3.38Å; D191-F194 PolarHBondContact O-N 2.95Å; D191-N195 WeakPolarHBondContact O-CB 3.39Å; D191-N195 PolarHBondContact O-N 3.31Å; D191-N195 PolarHBondContact O-ND2 3.33Å; D191-N195 PolarHBondContact OD1-ND2 3.18Å; D191-N195 VanDerWaalsContact OD1-ND2 3.11Å; D191-N195 PolarHBondContact OD2-ND2 2.94Å; D191-V231 VanDerWaalsContact OD2-CG2 3.27Å; D191-V231 WeakPolarHBondContact OD2-CG2 3.41Å; D191-R245 IonicContact OD2-NH1 2.76Å; D191-R248 VanDerWaalsContact CG-NH2 3.28Å; D191-R248 IonicContact OD1-CZ 3.46Å; D191-R248 IonicContact OD1-NH1 3.87Å; D191-R248 PolarHBondContact OD1-NH1 2.67Å; D191-R248 IonicContact OD1-NH2 3.71Å; D191-R248 PolarHBondContact OD1-NH2 2.97Å; D191-R248 IonicContact OD2-CZ 3.47Å; D191-R248 IonicContact OD2-NH1 3.99Å; D191-R248 IonicContact OD2-NH2 3.19Å; D191-R248 PolarHBondContact OD2-NH2 3.48Å
192	M	89.7	Confident	88.7	Confident	30 Å²	30	59.6 Å²	59.6	15%	0.148	29%	0.289	C	S	.	.	H	α-helix	trans	-58.3	-47.8	170.2	176.1	52.6	68.1	0	0	111.4	F182 L188 I190 F194 N195 V196 V231 F232 V235	F182-M192 HydrophobicContact CE2-CB 4.26Å; F182-M192 HydrophobicContact CE2-CG 4.45Å; L188-M192 VanDerWaalsContact O-CB 3.26Å; L188-M192 WeakPolarHBondContact O-CB 3.47Å; L188-M192 PolarHBondContact O-N 3.25Å; I190-M192 VanDerWaalsContact C-N 3.33Å; I190-M192 PolarHBondContact O-N 2.89Å; M192-F194 VanDerWaalsContact C-N 3.33Å; M192-F194 PolarHBondContact O-N 3.38Å; M192-N195 PolarHBondContact O-N 3.47Å; M192-V196 WeakPolarHBondContact O-CB 3.29Å; M192-V196 WeakPolarHBondContact O-CG2 3.44Å; M192-V196 PolarHBondContact O-N 2.87Å; M192-V196 HydrophobicContact SD-CG2 3.77Å; M192-V231 HydrophobicContact CE-CG1 4.06Å; M192-F232 HydrophobicContact CE-CD1 3.68Å; M192-F232 HydrophobicContact CE-CE1 4.01Å; M192-F232 HydrophobicContact CE-CG 4.46Å; M192-F232 HydrophobicContact SD-CD1 3.92Å; M192-F232 HydrophobicContact SD-CE1 3.58Å; M192-F232 VanDerWaalsContact SD-CE1 3.58Å; M192-F232 HydrophobicContact SD-CZ 4.4Å; M192-V235 HydrophobicContact CE-CB 3.83Å; M192-V235 HydrophobicContact CE-CG1 4.43Å; M192-V235 HydrophobicContact CE-CG2 3.41Å; M192-V235 VanDerWaalsContact CE-CG2 3.41Å
193	A	92.2	Very high	89.3	Confident	61 Å²	61	58.7 Å²	58.7	50%	0.504	29%	0.293	S	S	.	.	H	α-helix	trans	-60.6	-40.5	177.8	0	0	0	0	0	112.7	Q189 I190 F197	Q189-A193 PolarHBondContact O-N 3.03Å; Q189-A193 VanDerWaalsContact O-N 3.16Å; I190-A193 WeakPolarHBondContact O-CB 3.25Å; I190-A193 PolarHBondContact O-N 3.46Å; I190-A193 VanDerWaalsContact O-N 3.11Å; A193-F197 PolarHBondContact O-N 3.44Å
194	F	94.5	Very high	90	Very high	37 Å²	37	51.1 Å²	51.1	16%	0.162	27%	0.265	C	S	.	.	H	α-helix	trans	-66	-44.5	176	-67.9	-3	0	0	0	111.8	L160 A164 I167 I190 D191 M192 F197 F198	L160-F194 HydrophobicContact CD2-CD1 3.58Å; L160-F194 HydrophobicContact CD2-CE1 3.38Å; L160-F194 HydrophobicContact CD2-CG 4.4Å; L160-F194 HydrophobicContact CD2-CZ 4.08Å; A164-F194 HydrophobicContact CB-CD2 3.99Å; I167-F194 HydrophobicContact CD1-CD2 3.72Å; I167-F194 HydrophobicContact CD1-CE2 3.58Å; I190-F194 HydrophobicContact CG2-CD1 4.05Å; I190-F194 HydrophobicContact CG2-CD2 4.11Å; I190-F194 HydrophobicContact CG2-CE1 3.53Å; I190-F194 HydrophobicContact CG2-CE2 3.6Å; I190-F194 HydrophobicContact CG2-CG 4.33Å; I190-F194 HydrophobicContact CG2-CZ 3.3Å; I190-F194 WeakPolarHBondContact O-CG 3.5Å; I190-F194 PolarHBondContact O-N 2.99Å; D191-F194 PolarHBondContact O-N 2.95Å; M192-F194 VanDerWaalsContact C-N 3.33Å; M192-F194 PolarHBondContact O-N 3.38Å; F194-F197 WeakPolarHBondContact O-CB 3.28Å; F194-F197 PolarHBondContact O-N 3.01Å; F194-F198 HydrophobicContact CB-CE2 4.03Å; F194-F198 WeakPolarHBondContact O-CD2 3.33Å; F194-F198 WeakPolarHBondContact O-CG 3.42Å; F194-F198 PolarHBondContact O-N 2.91Å
195	N	92.4	Very high	90.7	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-74.4	-27.1	-178.4	-71.2	-79.9	0	0	0	113.4	D191 M192 F198 L199 V228 V231 R248	D191-N195 WeakPolarHBondContact O-CB 3.39Å; D191-N195 PolarHBondContact O-N 3.31Å; D191-N195 PolarHBondContact O-ND2 3.33Å; D191-N195 PolarHBondContact OD1-ND2 3.18Å; D191-N195 VanDerWaalsContact OD1-ND2 3.11Å; D191-N195 PolarHBondContact OD2-ND2 2.94Å; M192-N195 PolarHBondContact O-N 3.47Å; N195-F198 PolarHBondContact O-N 3.43Å; N195-L199 WeakPolarHBondContact O-CB 3.2Å; N195-L199 PolarHBondContact O-N 2.89Å; N195-V228 HydrophobicContact CB-CG1 4.46Å; N195-V228 HydrophobicContact CB-CG2 4.33Å; N195-V231 HydrophobicContact CB-CB 4.32Å; N195-V231 HydrophobicContact CB-CG1 4.25Å; N195-R248 PolarHBondContact ND2-NH2 3.46Å
196	V	94	Very high	91.1	Very high	62 Å²	62	44.8 Å²	44.8	38%	0.376	24%	0.236	S	C	.	.	H	α-helix	trans	-63.4	-42.3	165.1	168.8	0	0	0	0	111.2	M192 L199 L200 F232	M192-V196 WeakPolarHBondContact O-CB 3.29Å; M192-V196 WeakPolarHBondContact O-CG2 3.44Å; M192-V196 PolarHBondContact O-N 2.87Å; M192-V196 HydrophobicContact SD-CG2 3.77Å; V196-L199 PolarHBondContact O-N 3.08Å; V196-L200 WeakPolarHBondContact O-CG 3.34Å; V196-L200 PolarHBondContact O-N 3.13Å; V196-F232 HydrophobicContact CG2-CE1 4.04Å; V196-F232 HydrophobicContact CG2-CZ 3.98Å
197	F	94.8	Very high	91.3	Very high	46 Å²	46	41.4 Å²	41.4	20%	0.202	22%	0.224	C	C	.	.	H	α-helix	trans	-64.3	-42.8	174.2	177.7	-86.3	0	0	0	112.1	L153 L156 V157 L160 A193 F194 L199 L200 Y201	L153-F197 HydrophobicContact CD1-CE2 4.33Å; L153-F197 HydrophobicContact CD1-CZ 3.94Å; L156-F197 HydrophobicContact CB-CE2 4.27Å; L156-F197 HydrophobicContact CB-CZ 3.78Å; V157-F197 HydrophobicContact CB-CE1 4.41Å; V157-F197 HydrophobicContact CG2-CE1 3.65Å; V157-F197 HydrophobicContact CG2-CZ 3.98Å; L160-F197 HydrophobicContact CD1-CB 4.3Å; L160-F197 HydrophobicContact CD1-CD1 3.43Å; L160-F197 VanDerWaalsContact CD1-CD1 3.43Å; L160-F197 HydrophobicContact CD1-CD2 3.97Å; L160-F197 HydrophobicContact CD1-CE1 3.61Å; L160-F197 HydrophobicContact CD1-CE2 4.11Å; L160-F197 HydrophobicContact CD1-CG 3.63Å; L160-F197 HydrophobicContact CD1-CZ 3.94Å; A193-F197 PolarHBondContact O-N 3.44Å; F194-F197 WeakPolarHBondContact O-CB 3.28Å; F194-F197 PolarHBondContact O-N 3.01Å; F197-L199 VanDerWaalsContact C-N 3.33Å; F197-L199 PolarHBondContact O-N 2.84Å; F197-L200 PolarHBondContact O-N 3.4Å; F197-Y201 PolarHBondContact O-N 3.25Å
198	F	93.6	Very high	91.4	Very high	2 Å²	2	40.5 Å²	40.5	1%	0.009	22%	0.22	C	C	.	.	H	α-helix	trans	-63.4	-36.4	175.7	-65	-52.8	0	0	0	112.7	L160 S161 A164 F194 N195 L200 Y201 F202 V228 R251	L160-F198 HydrophobicContact CB-CE1 4.43Å; L160-F198 HydrophobicContact CB-CZ 4.02Å; S161-F198 WeakPolarHBondContact OG-CE1 3.46Å; A164-F198 HydrophobicContact CB-CE2 3.89Å; A164-F198 HydrophobicContact CB-CZ 4.33Å; F194-F198 HydrophobicContact CB-CE2 4.03Å; F194-F198 WeakPolarHBondContact O-CD2 3.33Å; F194-F198 WeakPolarHBondContact O-CG 3.42Å; F194-F198 PolarHBondContact O-N 2.91Å; N195-F198 PolarHBondContact O-N 3.43Å; F198-L200 PolarHBondContact O-N 3.38Å; F198-Y201 PolarHBondContact O-N 2.94Å; F198-F202 VanDerWaalsContact O-CB 3.29Å; F198-F202 WeakPolarHBondContact O-CB 3.47Å; F198-F202 PolarHBondContact O-N 3.19Å; F198-V228 HydrophobicContact CB-CG2 3.99Å; F198-R251 VanDerWaalsContact CD2-NH1 3.32Å; F198-R251 VanDerWaalsContact CZ-NH1 3.31Å
199	L	93.5	Very high	91.6	Very high	87 Å²	87	41.2 Å²	41.2	46%	0.455	23%	0.227	S	C	.	.	H	α-helix	trans	-61.2	-42.4	173.7	-177.3	62.4	0	0	0	112.2	N195 V196 F197 G203 V228 F232	N195-L199 WeakPolarHBondContact O-CB 3.2Å; N195-L199 PolarHBondContact O-N 2.89Å; V196-L199 PolarHBondContact O-N 3.08Å; F197-L199 VanDerWaalsContact C-N 3.33Å; F197-L199 PolarHBondContact O-N 2.84Å; L199-G203 PolarHBondContact O-N 3.18Å; L199-V228 HydrophobicContact CB-CG1 4.19Å; L199-V228 HydrophobicContact CD1-CG1 4.49Å; L199-F232 HydrophobicContact CD2-CE2 4.05Å; L199-F232 HydrophobicContact CD2-CZ 4.01Å
200	L	92.6	Very high	91.6	Very high	116 Å²	116	45 Å²	45	61%	0.607	25%	0.249	S	C	*	.	H	α-helix	trans	-66.2	-42.3	175.4	-67.1	172.3	0	0	0	111.8	V196 F197 F198 G203 L204	V196-L200 WeakPolarHBondContact O-CG 3.34Å; V196-L200 PolarHBondContact O-N 3.13Å; F197-L200 PolarHBondContact O-N 3.4Å; F198-L200 PolarHBondContact O-N 3.38Å; L200-G203 PolarHBondContact O-N 3.18Å; L200-L204 PolarHBondContact O-N 2.69Å
201	Y	91.4	Very high	91.6	Very high	20 Å²	20	45.1 Å²	45.1	8%	0.078	25%	0.25	C	C	.	.	H	α-helix	trans	-65.1	-43.6	176.8	-178.5	-117.2	0	0	0	112.4	I143 L153 V157 F197 F198 G203 L204 R205	I143-Y201 HydrophobicContact CD1-CD2 4Å; I143-Y201 HydrophobicContact CD1-CE2 3.44Å; I143-Y201 VanDerWaalsContact CD1-CE2 3.44Å; L153-Y201 HydrophobicContact CD1-CD2 4.3Å; L153-Y201 HydrophobicContact CD2-CD2 4.29Å; L153-Y201 HydrophobicContact CD2-CE2 4.37Å; L153-Y201 HydrophobicContact CG-CD2 4.3Å; L153-Y201 HydrophobicContact CG-CE2 4.42Å; V157-Y201 HydrophobicContact CB-CE1 4.42Å; V157-Y201 HydrophobicContact CG1-CD1 4.08Å; V157-Y201 HydrophobicContact CG1-CE1 3.65Å; V157-Y201 HydrophobicContact CG2-CD1 3.83Å; V157-Y201 HydrophobicContact CG2-CD2 3.51Å; V157-Y201 HydrophobicContact CG2-CE1 3.86Å; V157-Y201 HydrophobicContact CG2-CE2 3.56Å; V157-Y201 HydrophobicContact CG2-CG 3.65Å; F197-Y201 PolarHBondContact O-N 3.25Å; F198-Y201 PolarHBondContact O-N 2.94Å; Y201-G203 VanDerWaalsContact C-N 3.29Å; Y201-G203 PolarHBondContact O-N 3.38Å; Y201-L204 PolarHBondContact O-N 3.02Å; Y201-R205 HydrophobicContact CE1-CG 4.16Å; Y201-R205 HydrophobicContact CE2-CG 4.21Å; Y201-R205 WeakPolarHBondContact O-CG 3.26Å; Y201-R205 PolarHBondContact O-N 2.67Å
202	F	92.5	Very high	91.6	Very high	29 Å²	29	48.1 Å²	48.1	13%	0.127	26%	0.263	C	S	.	.	H	α-helix	trans	-55.8	-44.5	170.8	174.1	-90.1	0	0	0	111.1	F198 L204 R205 F206 F215 W216 D224 F225	F198-F202 VanDerWaalsContact O-CB 3.29Å; F198-F202 WeakPolarHBondContact O-CB 3.47Å; F198-F202 PolarHBondContact O-N 3.19Å; F202-L204 PolarHBondContact O-N 3.05Å; F202-R205 PolarHBondContact O-N 3.36Å; F202-F206 HydrophobicContact CE1-CB 4.44Å; F202-F206 WeakPolarHBondContact O-CB 3.46Å; F202-F206 PolarHBondContact O-N 2.98Å; F202-F215 HydrophobicContact CD2-CE1 4.21Å; F202-F215 AromaticContact CD2-CZ 3.99Å; F202-F215 HydrophobicContact CD2-CZ 3.99Å; F202-F215 AromaticContact CE2-CE1 3.61Å; F202-F215 HydrophobicContact CE2-CE1 3.61Å; F202-F215 AromaticContact CE2-CZ 3.83Å; F202-F215 HydrophobicContact CE2-CZ 3.83Å; F202-F215 AromaticContact CZ-CE1 3.86Å; F202-F215 HydrophobicContact CZ-CE1 3.86Å; F202-F215 HydrophobicContact CZ-CZ 4.46Å; F202-W216 HydrophobicContact CZ-CZ3 4.11Å; F202-D224 HydrophobicContact CD2-CB 4.09Å; F202-F225 HydrophobicContact CE1-CE1 4.25Å; F202-F225 AromaticContact CE2-CE1 3.78Å; F202-F225 HydrophobicContact CE2-CE1 3.78Å; F202-F225 HydrophobicContact CE2-CE2 4.41Å; F202-F225 AromaticContact CE2-CZ 3.65Å; F202-F225 HydrophobicContact CE2-CZ 3.65Å; F202-F225 AromaticContact CZ-CE1 3.45Å; F202-F225 HydrophobicContact CZ-CE1 3.45Å; F202-F225 VanDerWaalsContact CZ-CE1 3.45Å; F202-F225 AromaticContact CZ-CZ 3.47Å; F202-F225 HydrophobicContact CZ-CZ 3.47Å; F202-F225 VanDerWaalsContact CZ-CZ 3.47Å
203	G	92.1	Very high	91.6	Very high	28 Å²	28	48.2 Å²	48.2	29%	0.289	26%	0.264	S	S	.	.	H	α-helix	trans	-58.2	-45.3	175	0	0	0	0	0	113.4	L199 L200 Y201 F206 I207	L199-G203 PolarHBondContact O-N 3.18Å; L200-G203 PolarHBondContact O-N 3.18Å; Y201-G203 VanDerWaalsContact C-N 3.29Å; Y201-G203 PolarHBondContact O-N 3.38Å; G203-F206 PolarHBondContact O-N 3.14Å; G203-I207 VanDerWaalsContact O-CG1 3.29Å; G203-I207 WeakPolarHBondContact O-CG1 3.24Å; G203-I207 PolarHBondContact O-N 3.31Å
204	L	90.4	Very high	91.6	Very high	34 Å²	34	55 Å²	55	18%	0.178	28%	0.277	C	S	.	.	H	α-helix	trans	-63.1	-44.7	175.6	-69.3	173.4	0	0	0	112.1	W138 I143 L153 L200 Y201 F202 I207 A208	W138-L204 HydrophobicContact CH2-CD2 4.17Å; W138-L204 HydrophobicContact CZ3-CD2 3.81Å; I143-L204 HydrophobicContact CD1-CB 4.11Å; L153-L204 HydrophobicContact CD2-CD1 3.94Å; L200-L204 PolarHBondContact O-N 2.69Å; Y201-L204 PolarHBondContact O-N 3.02Å; F202-L204 PolarHBondContact O-N 3.05Å; L204-I207 PolarHBondContact O-N 3.06Å; L204-A208 WeakPolarHBondContact O-CB 3.33Å; L204-A208 PolarHBondContact O-N 3.03Å
205	R	91.3	Very high	91.5	Very high	18 Å²	18	53.7 Å²	53.7	7%	0.068	27%	0.271	C	S	.	.	H	α-helix	trans	-62.2	-45	175.4	-66.3	-164	-67.6	142.9	-6.1	111.7	I143 Y201 F202 I207 A208 A209 F215 E218 N220 D224	I143-R205 HydrophobicContact CD1-CG 3.79Å; I143-R205 HydrophobicContact CG1-CG 4.37Å; Y201-R205 HydrophobicContact CE1-CG 4.16Å; Y201-R205 HydrophobicContact CE2-CG 4.21Å; Y201-R205 WeakPolarHBondContact O-CG 3.26Å; Y201-R205 PolarHBondContact O-N 2.67Å; F202-R205 PolarHBondContact O-N 3.36Å; R205-I207 VanDerWaalsContact C-N 3.32Å; R205-I207 PolarHBondContact O-N 3.1Å; R205-A208 PolarHBondContact O-N 2.91Å; R205-A209 PolarHBondContact O-N 2.93Å; R205-F215 HydrophobicContact CB-CE2 3.51Å; R205-F215 HydrophobicContact CB-CZ 3.62Å; R205-E218 IonicContact NH1-OE1 3.4Å; R205-E218 PolarHBondContact NH1-OE1 3.27Å; R205-E218 VanDerWaalsContact NH1-OE1 3.15Å; R205-N220 PolarHBondContact NH2-O 3.3Å; R205-D224 IonicContact CZ-OD2 2.75Å; R205-D224 IonicContact NH2-OD2 2.75Å; R205-D224 PolarHBondContact NH2-OD2 3.5Å
206	F	91.9	Very high	91.5	Very high	67 Å²	67	54.9 Å²	54.9	29%	0.294	28%	0.276	S	S	.	.	H	α-helix	trans	-59.6	-40.7	176.7	-179.1	-94	0	0	0	111.9	F202 G203 K212 F215 W216	F202-F206 HydrophobicContact CE1-CB 4.44Å; F202-F206 WeakPolarHBondContact O-CB 3.46Å; F202-F206 PolarHBondContact O-N 2.98Å; G203-F206 PolarHBondContact O-N 3.14Å; F206-K212 HydrophobicContact CE2-CB 4.24Å; F206-K212 HydrophobicContact CE2-CD 4.39Å; F206-K212 HydrophobicContact CZ-CB 4.45Å; F206-K212 HydrophobicContact CZ-CD 4.33Å; F206-K212 HydrophobicContact CZ-CG 4.42Å; F206-K212 WeakPolarHBondContact O-CD 3.46Å; F206-K212 WeakPolarHBondContact O-CE 3.14Å; F206-K212 PolarHBondContact O-NZ 3.36Å; F206-F215 HydrophobicContact CB-CD1 4.18Å; F206-F215 HydrophobicContact CB-CE1 3.62Å; F206-F215 HydrophobicContact CB-CZ 4.27Å; F206-F215 AromaticContact CD2-CD1 3.72Å; F206-F215 HydrophobicContact CD2-CD1 3.72Å; F206-F215 AromaticContact CD2-CE1 3.8Å; F206-F215 HydrophobicContact CD2-CE1 3.8Å; F206-F215 HydrophobicContact CG-CD1 4.41Å; F206-F215 HydrophobicContact CG-CE1 4.21Å; F206-W216 HydrophobicContact CD2-CE3 4.32Å; F206-W216 HydrophobicContact CD2-CZ3 4.3Å; F206-W216 HydrophobicContact CE2-CE3 4Å; F206-W216 HydrophobicContact CE2-CZ3 4.01Å
207	I	90.3	Very high	91.3	Very high	68 Å²	68	56.5 Å²	56.5	35%	0.349	28%	0.282	S	S	.	.	H	α-helix	trans	-65	-49.6	175.7	-72	166.7	0	0	0	110.8	V135 A139 G203 L204 R205 A209 K212	V135-I207 HydrophobicContact CG1-CG2 3.94Å; A139-I207 HydrophobicContact CB-CB 4.26Å; A139-I207 HydrophobicContact CB-CG2 3.72Å; G203-I207 VanDerWaalsContact O-CG1 3.29Å; G203-I207 WeakPolarHBondContact O-CG1 3.24Å; G203-I207 PolarHBondContact O-N 3.31Å; L204-I207 PolarHBondContact O-N 3.06Å; R205-I207 VanDerWaalsContact C-N 3.32Å; R205-I207 PolarHBondContact O-N 3.1Å; I207-A209 VanDerWaalsContact C-N 3.34Å; I207-A209 PolarHBondContact O-N 2.91Å; I207-K212 PolarHBondContact O-NZ 3.44Å
208	A	88.6	Confident	91.1	Very high	20 Å²	20	57.2 Å²	57.2	17%	0.165	29%	0.285	C	S	.	.	H	α-helix	trans	-63.7	-33.5	-177.8	0	0	0	0	0	113.9	K136 A139 I143 L204 R205 N210	K136-A208 WeakPolarHBondContact CE-O 3.48Å; A139-A208 HydrophobicContact CB-CB 3.96Å; I143-A208 HydrophobicContact CG1-CB 4.47Å; L204-A208 WeakPolarHBondContact O-CB 3.33Å; L204-A208 PolarHBondContact O-N 3.03Å; R205-A208 PolarHBondContact O-N 2.91Å; A208-N210 PolarHBondContact O-N 3.46Å
209	A	89.8	Confident	90.9	Very high	17 Å²	17	61 Å²	61	14%	0.14	31%	0.309	C	S	.	.			trans	-51.9	131.9	-173.2	0	0	0	0	0	114.2	R205 I207 K212 F215	R205-A209 PolarHBondContact O-N 2.93Å; I207-A209 VanDerWaalsContact C-N 3.34Å; I207-A209 PolarHBondContact O-N 2.91Å; A209-K212 HydrophobicContact CB-CD 4.27Å; A209-K212 PolarHBondContact O-NZ 3.18Å; A209-F215 HydrophobicContact CB-CB 3.66Å; A209-F215 HydrophobicContact CB-CD2 4.21Å; A209-F215 HydrophobicContact CB-CG 3.86Å
210	N	87.4	Confident	90.6	Very high	147 Å²	147	58 Å²	58	79%	0.786	29%	0.293	S	S	*	.	S	Bend	trans	-67.8	-48.4	175.3	-75.7	-42.5	0	0	0	112	K136 A208	K136-N210 VanDerWaalsContact CE-OD1 3.25Å; K136-N210 WeakPolarHBondContact CE-OD1 3.5Å; K136-N210 PolarHBondContact NZ-OD1 3.16Å; A208-N210 PolarHBondContact O-N 3.46Å
211	D	90.4	Very high	90.5	Very high	58 Å²	58	52.5 Å²	52.5	31%	0.31	26%	0.264	S	S	.	.			trans	-111.7	118.2	174	-171.5	-40.2	0	0	0	109.6	R80 L213 W214 F215	R80-D211 IonicContact CZ-OD1 2.85Å; R80-D211 IonicContact CZ-OD2 2.61Å; R80-D211 IonicContact NH1-OD2 3.58Å; R80-D211 IonicContact NH2-OD1 2.63Å; R80-D211 PolarHBondContact NH2-OD1 2.63Å; R80-D211 IonicContact NH2-OD2 3.85Å; R80-D211 PolarHBondContact NH2-OD2 2.82Å; D211-L213 WeakPolarHBondContact OD1-CA 3.43Å; D211-L213 WeakPolarHBondContact OD1-CB 3.48Å; D211-L213 PolarHBondContact OD1-N 3.05Å; D211-W214 HydrophobicContact CB-CB 3.92Å; D211-W214 PolarHBondContact OD1-N 3.08Å; D211-W214 VanDerWaalsContact OD1-N 3.07Å; D211-F215 WeakPolarHBondContact O-CB 3.46Å; D211-F215 PolarHBondContact O-N 2.69Å; D211-F215 VanDerWaalsContact O-N 3.13Å
212	K	89.8	Confident	90.4	Very high	64 Å²	64	53.6 Å²	53.6	28%	0.278	27%	0.273	S	S	.	.	H	α-helix	trans	-72	-27.1	-179.6	-51.4	-51.4	-174.8	-166.4	0	113.6	F206 I207 A209 W216	F206-K212 HydrophobicContact CE2-CB 4.24Å; F206-K212 HydrophobicContact CE2-CD 4.39Å; F206-K212 HydrophobicContact CZ-CB 4.45Å; F206-K212 HydrophobicContact CZ-CD 4.33Å; F206-K212 HydrophobicContact CZ-CG 4.42Å; F206-K212 WeakPolarHBondContact O-CD 3.46Å; F206-K212 WeakPolarHBondContact O-CE 3.14Å; F206-K212 PolarHBondContact O-NZ 3.36Å; I207-K212 PolarHBondContact O-NZ 3.44Å; A209-K212 HydrophobicContact CB-CD 4.27Å; A209-K212 PolarHBondContact O-NZ 3.18Å; K212-W216 WeakPolarHBondContact O-CB 3.04Å; K212-W216 PolarHBondContact O-N 3.04Å; K212-W216 VanDerWaalsContact O-N 3.14Å
213	L	90.9	Very high	90.4	Very high	32 Å²	32	52.3 Å²	52.3	17%	0.168	27%	0.267	C	S	.	.	H	α-helix	trans	-77	-42.3	176.9	-179.5	64.6	0	0	0	110.8	L73 I76 L77 D211 W216 L217	L73-L213 HydrophobicContact CD1-CD1 3.49Å; L73-L213 VanDerWaalsContact CD1-CD1 3.49Å; I76-L213 HydrophobicContact CG2-CB 3.88Å; I76-L213 HydrophobicContact CG2-CD1 4.02Å; L77-L213 HydrophobicContact CD2-CD1 4.14Å; L77-L213 HydrophobicContact CD2-CD2 4.1Å; D211-L213 WeakPolarHBondContact OD1-CA 3.43Å; D211-L213 WeakPolarHBondContact OD1-CB 3.48Å; D211-L213 PolarHBondContact OD1-N 3.05Å; L213-W216 PolarHBondContact O-N 3.17Å; L213-L217 HydrophobicContact CD1-CD1 4.48Å; L213-L217 PolarHBondContact O-N 3Å
214	W	91.6	Very high	90.3	Very high	203 Å²	203	51.2 Å²	51.2	77%	0.769	26%	0.255	S	S	*	.	H	α-helix	trans	-60.7	-48.2	174.2	-165.4	-54.7	0	0	0	110.4	D211 W216 L217 E218	D211-W214 HydrophobicContact CB-CB 3.92Å; D211-W214 PolarHBondContact OD1-N 3.08Å; D211-W214 VanDerWaalsContact OD1-N 3.07Å; W214-W216 VanDerWaalsContact C-N 3.27Å; W214-W216 PolarHBondContact O-N 3Å; W214-L217 CarbonylContact O-C 3.6Å; W214-L217 PolarHBondContact O-N 3.41Å; W214-L217 VanDerWaalsContact O-N 3.09Å; W214-E218 PolarHBondContact O-N 3.25Å; W214-E218 VanDerWaalsContact O-N 3.1Å
215	F	92.4	Very high	90.4	Very high	10 Å²	10	50.1 Å²	50.1	4%	0.044	25%	0.249	C	C	.	.	H	α-helix	trans	-60.3	-33.8	176.5	175.1	-97.4	0	0	0	113.3	F202 R205 F206 A209 D211 L217 E218 S221	F202-F215 HydrophobicContact CD2-CE1 4.21Å; F202-F215 AromaticContact CD2-CZ 3.99Å; F202-F215 HydrophobicContact CD2-CZ 3.99Å; F202-F215 AromaticContact CE2-CE1 3.61Å; F202-F215 HydrophobicContact CE2-CE1 3.61Å; F202-F215 AromaticContact CE2-CZ 3.83Å; F202-F215 HydrophobicContact CE2-CZ 3.83Å; F202-F215 AromaticContact CZ-CE1 3.86Å; F202-F215 HydrophobicContact CZ-CE1 3.86Å; F202-F215 HydrophobicContact CZ-CZ 4.46Å; R205-F215 HydrophobicContact CB-CE2 3.51Å; R205-F215 HydrophobicContact CB-CZ 3.62Å; F206-F215 HydrophobicContact CB-CD1 4.18Å; F206-F215 HydrophobicContact CB-CE1 3.62Å; F206-F215 HydrophobicContact CB-CZ 4.27Å; F206-F215 AromaticContact CD2-CD1 3.72Å; F206-F215 HydrophobicContact CD2-CD1 3.72Å; F206-F215 AromaticContact CD2-CE1 3.8Å; F206-F215 HydrophobicContact CD2-CE1 3.8Å; F206-F215 HydrophobicContact CG-CD1 4.41Å; F206-F215 HydrophobicContact CG-CE1 4.21Å; A209-F215 HydrophobicContact CB-CB 3.66Å; A209-F215 HydrophobicContact CB-CD2 4.21Å; A209-F215 HydrophobicContact CB-CG 3.86Å; D211-F215 WeakPolarHBondContact O-CB 3.46Å; D211-F215 PolarHBondContact O-N 2.69Å; D211-F215 VanDerWaalsContact O-N 3.13Å; F215-L217 PolarHBondContact O-N 3.37Å; F215-E218 WeakPolarHBondContact CD2-OE2 3.23Å; F215-E218 WeakPolarHBondContact O-CB 3.46Å; F215-E218 PolarHBondContact O-N 3.24Å; F215-S221 VanDerWaalsContact CE2-OG 3.28Å; F215-S221 WeakPolarHBondContact CE2-OG 3.37Å; F215-S221 VanDerWaalsContact CZ-OG 3.27Å; F215-S221 WeakPolarHBondContact CZ-OG 3.46Å; F215-S221 WeakPolarHBondContact O-CB 3.43Å; F215-S221 PolarHBondContact O-OG 3.04Å
216	W	92.3	Very high	90.5	Very high	25 Å²	25	50.7 Å²	50.7	10%	0.095	25%	0.252	C	S	.	.	H	α-helix	trans	-68	-24.4	176.7	-155.9	-90.6	0	0	0	113.4	F69 G72 I76 F202 F206 K212 L213 W214 F225	F69-W216 AromaticContact CD2-NE1 3.82Å; F69-W216 AromaticContact CE2-CD1 3.98Å; F69-W216 PolarHBondContact O-NE1 3.5Å; G72-W216 VanDerWaalsContact CA-CZ2 3.49Å; I76-W216 HydrophobicContact CD1-CB 3.95Å; I76-W216 HydrophobicContact CD1-CD2 3.6Å; I76-W216 HydrophobicContact CD1-CE3 3.45Å; I76-W216 VanDerWaalsContact CD1-CE3 3.45Å; I76-W216 HydrophobicContact CD1-CG 3.82Å; I76-W216 HydrophobicContact CD1-CZ3 4.21Å; F202-W216 HydrophobicContact CZ-CZ3 4.11Å; F206-W216 HydrophobicContact CD2-CE3 4.32Å; F206-W216 HydrophobicContact CD2-CZ3 4.3Å; F206-W216 HydrophobicContact CE2-CE3 4Å; F206-W216 HydrophobicContact CE2-CZ3 4.01Å; K212-W216 WeakPolarHBondContact O-CB 3.04Å; K212-W216 PolarHBondContact O-N 3.04Å; K212-W216 VanDerWaalsContact O-N 3.14Å; L213-W216 PolarHBondContact O-N 3.17Å; W214-W216 VanDerWaalsContact C-N 3.27Å; W214-W216 PolarHBondContact O-N 3Å; W216-F225 AromaticContact CD2-CE2 3.99Å; W216-F225 HydrophobicContact CD2-CE2 3.99Å; W216-F225 AromaticContact CD2-CZ 3.54Å; W216-F225 HydrophobicContact CD2-CZ 3.54Å; W216-F225 AromaticContact CE2-CE2 3.77Å; W216-F225 AromaticContact CE2-CZ 3.34Å; W216-F225 AromaticContact CE3-CZ 3.71Å; W216-F225 HydrophobicContact CE3-CZ 3.71Å; W216-F225 HydrophobicContact CG-CE2 4.23Å; W216-F225 HydrophobicContact CG-CZ 4.24Å; W216-F225 AromaticContact CH2-CE1 3.59Å; W216-F225 HydrophobicContact CH2-CE1 3.59Å; W216-F225 AromaticContact CH2-CZ 3.54Å; W216-F225 HydrophobicContact CH2-CZ 3.54Å; W216-F225 HydrophobicContact CZ2-CD1 4.49Å; W216-F225 AromaticContact CZ2-CE1 3.54Å; W216-F225 HydrophobicContact CZ2-CE1 3.54Å; W216-F225 HydrophobicContact CZ2-CE2 4.13Å; W216-F225 AromaticContact CZ2-CZ 3.33Å; W216-F225 HydrophobicContact CZ2-CZ 3.33Å; W216-F225 HydrophobicContact CZ3-CE1 4.11Å; W216-F225 AromaticContact CZ3-CZ 3.73Å; W216-F225 HydrophobicContact CZ3-CZ 3.73Å; W216-F225 AromaticContact NE1-CE2 3.91Å; W216-F225 AromaticContact NE1-CZ 3.96Å
217	L	90.7	Very high	90.4	Very high	96 Å²	96	47.6 Å²	47.6	50%	0.503	24%	0.238	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.2	3.7	179	-59.6	175.9	0	0	0	112.8	F69 L73 L213 W214 F215	F69-L217 HydrophobicContact CE2-CD2 4.28Å; F69-L217 HydrophobicContact CZ-CD2 3.98Å; L73-L217 HydrophobicContact CD1-CD2 4.29Å; L213-L217 HydrophobicContact CD1-CD1 4.48Å; L213-L217 PolarHBondContact O-N 3Å; W214-L217 CarbonylContact O-C 3.6Å; W214-L217 PolarHBondContact O-N 3.41Å; W214-L217 VanDerWaalsContact O-N 3.09Å; F215-L217 PolarHBondContact O-N 3.37Å
218	E	90.6	Very high	90.6	Very high	60 Å²	60	44.7 Å²	44.7	28%	0.28	22%	0.224	S	C	.	.	S	Bend	trans	-68	134.6	174.3	-170.2	-168.4	128.6	0	0	110.2	R205 W214 F215 N220 S221 V222	R205-E218 IonicContact NH1-OE1 3.4Å; R205-E218 PolarHBondContact NH1-OE1 3.27Å; R205-E218 VanDerWaalsContact NH1-OE1 3.15Å; W214-E218 PolarHBondContact O-N 3.25Å; W214-E218 VanDerWaalsContact O-N 3.1Å; F215-E218 WeakPolarHBondContact CD2-OE2 3.23Å; F215-E218 WeakPolarHBondContact O-CB 3.46Å; F215-E218 PolarHBondContact O-N 3.24Å; E218-N220 PolarHBondContact O-N 3.45Å; E218-N220 VanDerWaalsContact O-N 3.16Å; E218-N220 WeakPolarHBondContact OE1-CB 3.41Å; E218-N220 PolarHBondContact OE1-ND2 2.86Å; E218-S221 WeakPolarHBondContact O-CA 3.36Å; E218-S221 VanDerWaalsContact O-CB 3.32Å; E218-S221 WeakPolarHBondContact O-CB 3.33Å; E218-S221 PolarHBondContact O-N 3.34Å; E218-V222 PolarHBondContact O-N 2.82Å
219	V	88.2	Confident	90.8	Very high	82 Å²	82	44.7 Å²	44.7	50%	0.497	22%	0.222	S	C	.	.	H	α-helix	trans	-54.3	-40.3	-177.3	-179	0	0	0	0	112	S221 V222 V223 L250	V219-S221 PolarHBondContact O-N 2.95Å; V219-V222 WeakPolarHBondContact O-CB 3.3Å; V219-V222 PolarHBondContact O-N 3.26Å; V219-V223 WeakPolarHBondContact O-CG2 3.29Å; V219-V223 PolarHBondContact O-N 2.88Å; V219-L250 HydrophobicContact CG1-CD1 4.38Å
220	N	86.8	Confident	90.8	Very high	25 Å²	25	44.6 Å²	44.6	13%	0.134	22%	0.22	C	C	.	.	H	α-helix	trans	-68.7	-20.1	178.5	-49.4	-56.2	0	0	0	113.3	R205 E218 Q254	R205-N220 PolarHBondContact NH2-O 3.3Å; E218-N220 PolarHBondContact O-N 3.45Å; E218-N220 VanDerWaalsContact O-N 3.16Å; E218-N220 WeakPolarHBondContact OE1-CB 3.41Å; E218-N220 PolarHBondContact OE1-ND2 2.86Å; N220-Q254 PolarHBondContact ND2-NE2 3Å; N220-Q254 VanDerWaalsContact ND2-NE2 3.19Å
221	S	90.5	Very high	90.9	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-84.5	-39	171.9	-60	0	0	0	0	110.8	F215 E218 V219 V223 D224 F225	F215-S221 VanDerWaalsContact CE2-OG 3.28Å; F215-S221 WeakPolarHBondContact CE2-OG 3.37Å; F215-S221 VanDerWaalsContact CZ-OG 3.27Å; F215-S221 WeakPolarHBondContact CZ-OG 3.46Å; F215-S221 WeakPolarHBondContact O-CB 3.43Å; F215-S221 PolarHBondContact O-OG 3.04Å; E218-S221 WeakPolarHBondContact O-CA 3.36Å; E218-S221 VanDerWaalsContact O-CB 3.32Å; E218-S221 WeakPolarHBondContact O-CB 3.33Å; E218-S221 PolarHBondContact O-N 3.34Å; V219-S221 PolarHBondContact O-N 2.95Å; S221-V223 VanDerWaalsContact C-N 3.33Å; S221-V223 PolarHBondContact O-N 3.45Å; S221-D224 PolarHBondContact O-N 3.09Å; S221-D224 VanDerWaalsContact O-N 3.12Å; S221-F225 WeakPolarHBondContact O-CD2 3.34Å; S221-F225 WeakPolarHBondContact O-CG 3.41Å; S221-F225 PolarHBondContact O-N 3.43Å
222	V	90.6	Very high	90.9	Very high	42 Å²	42	38.6 Å²	38.6	26%	0.255	19%	0.185	S	C	.	.	H	α-helix	trans	-58.2	-44	173.5	176	0	0	0	0	111.1	F69 E218 V219 D224 F225 F226	F69-V222 HydrophobicContact CE2-CG2 4.32Å; E218-V222 PolarHBondContact O-N 2.82Å; V219-V222 WeakPolarHBondContact O-CB 3.3Å; V219-V222 PolarHBondContact O-N 3.26Å; V222-D224 VanDerWaalsContact C-N 3.32Å; V222-D224 PolarHBondContact O-N 3.39Å; V222-F225 PolarHBondContact O-N 2.96Å; V222-F226 HydrophobicContact CG1-CD2 3.78Å; V222-F226 HydrophobicContact CG1-CE2 3.8Å; V222-F226 VanDerWaalsContact O-CD2 3.3Å; V222-F226 WeakPolarHBondContact O-CD2 3.5Å; V222-F226 PolarHBondContact O-N 3.46Å
223	V	91.9	Very high	90.9	Very high	2 Å²	2	36.9 Å²	36.9	1%	0.012	18%	0.179	C	C	.	.	H	α-helix	trans	-58.3	-43	173.9	173.8	0	0	0	0	111.7	V219 S221 F226 T227 L247 L250 R251	V219-V223 WeakPolarHBondContact O-CG2 3.29Å; V219-V223 PolarHBondContact O-N 2.88Å; S221-V223 VanDerWaalsContact C-N 3.33Å; S221-V223 PolarHBondContact O-N 3.45Å; V223-F226 PolarHBondContact O-N 3.16Å; V223-T227 HydrophobicContact CG1-CG2 4.24Å; V223-T227 WeakPolarHBondContact O-CB 3.23Å; V223-T227 VanDerWaalsContact O-CG2 3.29Å; V223-T227 WeakPolarHBondContact O-CG2 3.35Å; V223-T227 PolarHBondContact O-N 3.3Å; V223-T227 VanDerWaalsContact O-N 3.1Å; V223-T227 PolarHBondContact O-OG1 3.38Å; V223-L247 WeakPolarHBondContact CG1-O 3.41Å; V223-L250 HydrophobicContact CG2-CB 3.78Å; V223-L250 HydrophobicContact CG2-CD1 3.93Å; V223-L250 HydrophobicContact CG2-CG 4.46Å; V223-R251 HydrophobicContact CG1-CG 3.96Å
224	D	91	Very high	90.7	Very high	6 Å²	6	35.3 Å²	35.3	3%	0.032	17%	0.171	C	C	.	.	H	α-helix	trans	-64.2	-43.2	178.5	-67.6	-9.4	0	0	0	111.1	F202 R205 S221 V222 F226 T227 V228 P229 R251	F202-D224 HydrophobicContact CD2-CB 4.09Å; R205-D224 IonicContact CZ-OD2 2.75Å; R205-D224 IonicContact NH2-OD2 2.75Å; R205-D224 PolarHBondContact NH2-OD2 3.5Å; S221-D224 PolarHBondContact O-N 3.09Å; S221-D224 VanDerWaalsContact O-N 3.12Å; V222-D224 VanDerWaalsContact C-N 3.32Å; V222-D224 PolarHBondContact O-N 3.39Å; D224-F226 VanDerWaalsContact C-N 3.29Å; D224-F226 PolarHBondContact O-N 3.25Å; D224-T227 PolarHBondContact O-N 2.94Å; D224-V228 WeakPolarHBondContact O-CB 3.37Å; D224-V228 PolarHBondContact O-N 3.27Å; D224-P229 WeakPolarHBondContact O-CD 3.27Å; D224-R251 IonicContact OD1-CZ 3.62Å; D224-R251 IonicContact OD1-NE 3.65Å; D224-R251 PolarHBondContact OD1-NE 3.34Å; D224-R251 IonicContact OD1-NH2 2.69Å; D224-R251 PolarHBondContact OD1-NH2 3.35Å
225	F	92.2	Very high	90.5	Very high	10 Å²	10	27.2 Å²	27.2	4%	0.044	14%	0.144	C	C	.	.	H	α-helix	trans	-63.1	-27.9	177.3	-62.6	-49.3	0	0	0	114.7	S65 T68 F69 F202 W216 S221 V222 P229	S65-F225 WeakPolarHBondContact CB-O 3.37Å; T68-F225 HydrophobicContact CG2-CD1 3.9Å; T68-F225 HydrophobicContact CG2-CE1 4.38Å; F69-F225 HydrophobicContact CB-CB 4.49Å; F69-F225 AromaticContact CD2-CD2 3.63Å; F69-F225 HydrophobicContact CD2-CD2 3.63Å; F69-F225 AromaticContact CD2-CE2 4Å; F69-F225 HydrophobicContact CD2-CE2 4Å; F69-F225 HydrophobicContact CD2-CG 4.4Å; F69-F225 HydrophobicContact CE2-CD2 4.37Å; F202-F225 HydrophobicContact CE1-CE1 4.25Å; F202-F225 AromaticContact CE2-CE1 3.78Å; F202-F225 HydrophobicContact CE2-CE1 3.78Å; F202-F225 HydrophobicContact CE2-CE2 4.41Å; F202-F225 AromaticContact CE2-CZ 3.65Å; F202-F225 HydrophobicContact CE2-CZ 3.65Å; F202-F225 AromaticContact CZ-CE1 3.45Å; F202-F225 HydrophobicContact CZ-CE1 3.45Å; F202-F225 VanDerWaalsContact CZ-CE1 3.45Å; F202-F225 AromaticContact CZ-CZ 3.47Å; F202-F225 HydrophobicContact CZ-CZ 3.47Å; F202-F225 VanDerWaalsContact CZ-CZ 3.47Å; W216-F225 AromaticContact CD2-CE2 3.99Å; W216-F225 HydrophobicContact CD2-CE2 3.99Å; W216-F225 AromaticContact CD2-CZ 3.54Å; W216-F225 HydrophobicContact CD2-CZ 3.54Å; W216-F225 AromaticContact CE2-CE2 3.77Å; W216-F225 AromaticContact CE2-CZ 3.34Å; W216-F225 AromaticContact CE3-CZ 3.71Å; W216-F225 HydrophobicContact CE3-CZ 3.71Å; W216-F225 HydrophobicContact CG-CE2 4.23Å; W216-F225 HydrophobicContact CG-CZ 4.24Å; W216-F225 AromaticContact CH2-CE1 3.59Å; W216-F225 HydrophobicContact CH2-CE1 3.59Å; W216-F225 AromaticContact CH2-CZ 3.54Å; W216-F225 HydrophobicContact CH2-CZ 3.54Å; W216-F225 HydrophobicContact CZ2-CD1 4.49Å; W216-F225 AromaticContact CZ2-CE1 3.54Å; W216-F225 HydrophobicContact CZ2-CE1 3.54Å; W216-F225 HydrophobicContact CZ2-CE2 4.13Å; W216-F225 AromaticContact CZ2-CZ 3.33Å; W216-F225 HydrophobicContact CZ2-CZ 3.33Å; W216-F225 HydrophobicContact CZ3-CE1 4.11Å; W216-F225 AromaticContact CZ3-CZ 3.73Å; W216-F225 HydrophobicContact CZ3-CZ 3.73Å; W216-F225 AromaticContact NE1-CE2 3.91Å; W216-F225 AromaticContact NE1-CZ 3.96Å; S221-F225 WeakPolarHBondContact O-CD2 3.34Å; S221-F225 WeakPolarHBondContact O-CG 3.41Å; S221-F225 PolarHBondContact O-N 3.43Å; V222-F225 PolarHBondContact O-N 2.96Å; F225-P229 VanDerWaalsContact O-CD 3.23Å; F225-P229 WeakPolarHBondContact O-CD 3.31Å; F225-P229 WeakPolarHBondContact O-CG 3.37Å
226	F	92	Very high	90.3	Very high	30 Å²	30	36.2 Å²	36.2	13%	0.132	18%	0.179	C	C	.	.	H	α-helix	trans	-96.1	-7.9	178.4	-76.5	-67.7	0	0	0	114.6	M66 V222 V223 D224 L244 L247	M66-F226 HydrophobicContact CE-CE1 3.47Å; M66-F226 VanDerWaalsContact CE-CE1 3.47Å; M66-F226 HydrophobicContact CE-CZ 3.47Å; M66-F226 VanDerWaalsContact CE-CZ 3.47Å; V222-F226 HydrophobicContact CG1-CD2 3.78Å; V222-F226 HydrophobicContact CG1-CE2 3.8Å; V222-F226 VanDerWaalsContact O-CD2 3.3Å; V222-F226 WeakPolarHBondContact O-CD2 3.5Å; V222-F226 PolarHBondContact O-N 3.46Å; V223-F226 PolarHBondContact O-N 3.16Å; D224-F226 VanDerWaalsContact C-N 3.29Å; D224-F226 PolarHBondContact O-N 3.25Å; F226-L244 HydrophobicContact CB-CD1 4.41Å; F226-L244 HydrophobicContact CD1-CD1 3.47Å; F226-L244 VanDerWaalsContact CD1-CD1 3.47Å; F226-L244 HydrophobicContact CE1-CD1 3.95Å; F226-L244 HydrophobicContact CG-CD1 4.14Å; F226-L247 HydrophobicContact CB-CD1 3.57Å; F226-L247 HydrophobicContact CD2-CD1 4.19Å; F226-L247 HydrophobicContact CG-CD1 4.01Å
227	T	91.3	Very high	89.9	Confident	2 Å²	2	37.7 Å²	37.7	1%	0.012	19%	0.189	C	C	.	.	H	α-helix	trans	-115.7	-30.8	-177.4	57.8	0	0	0	0	113.7	V223 D224 V231 L247 R248 R251	V223-T227 HydrophobicContact CG1-CG2 4.24Å; V223-T227 WeakPolarHBondContact O-CB 3.23Å; V223-T227 VanDerWaalsContact O-CG2 3.29Å; V223-T227 WeakPolarHBondContact O-CG2 3.35Å; V223-T227 PolarHBondContact O-N 3.3Å; V223-T227 VanDerWaalsContact O-N 3.1Å; V223-T227 PolarHBondContact O-OG1 3.38Å; D224-T227 PolarHBondContact O-N 2.94Å; T227-V231 WeakPolarHBondContact O-CG2 3.43Å; T227-L247 HydrophobicContact CG2-CB 4.26Å; T227-R248 HydrophobicContact CG2-CG 3.76Å; T227-R251 PolarHBondContact OG1-NH2 2.84Å
228	V	92.9	Very high	89.5	Confident	7 Å²	7	36.2 Å²	36.2	4%	0.042	18%	0.181	C	C	.	.	S	Bend	trans	-85.5	-50.9	-175.8	175	0	0	0	0	112.9	N195 F198 L199 D224 V231 F232	N195-V228 HydrophobicContact CB-CG1 4.46Å; N195-V228 HydrophobicContact CB-CG2 4.33Å; F198-V228 HydrophobicContact CB-CG2 3.99Å; L199-V228 HydrophobicContact CB-CG1 4.19Å; L199-V228 HydrophobicContact CD1-CG1 4.49Å; D224-V228 WeakPolarHBondContact O-CB 3.37Å; D224-V228 PolarHBondContact O-N 3.27Å; V228-V231 PolarHBondContact O-N 2.97Å; V228-F232 HydrophobicContact CG1-CD2 4.18Å; V228-F232 HydrophobicContact CG1-CE2 3.61Å; V228-F232 WeakPolarHBondContact O-CD2 3.41Å
229	P	93	Very high	89.1	Confident	21 Å²	21	34.3 Å²	34.3	14%	0.136	17%	0.172	C	C	.	.	H	α-helix	trans	-59	-41	179	-22	33.3	0	0	0	115.1	T68 D224 F225 V231 F232 V233	T68-P229 HydrophobicContact CG2-CG 4.29Å; D224-P229 WeakPolarHBondContact O-CD 3.27Å; F225-P229 VanDerWaalsContact O-CD 3.23Å; F225-P229 WeakPolarHBondContact O-CD 3.31Å; F225-P229 WeakPolarHBondContact O-CG 3.37Å; P229-V231 PolarHBondContact O-N 3.09Å; P229-F232 PolarHBondContact O-N 3.46Å; P229-V233 PolarHBondContact O-N 2.67Å; P229-V233 VanDerWaalsContact O-N 3.13Å
230	P	90.6	Very high	88.9	Confident	15 Å²	15	30.7 Å²	30.7	10%	0.097	15%	0.15	C	C	.	.	H	α-helix	trans	-58.1	-31.3	176.1	-30.5	39.4	0	0	0	114.7	F61 S65 V233 S234	F61-P230 HydrophobicContact CB-CB 4.26Å; F61-P230 HydrophobicContact CD1-CB 4.16Å; F61-P230 WeakPolarHBondContact CD1-O 3.41Å; S65-P230 WeakPolarHBondContact OG-CD 3.48Å; S65-P230 VanDerWaalsContact OG-CG 3.25Å; S65-P230 WeakPolarHBondContact OG-CG 3.25Å; P230-V233 PolarHBondContact O-N 3.38Å; P230-S234 WeakPolarHBondContact O-CB 3.45Å; P230-S234 PolarHBondContact O-N 3.01Å
231	V	90.2	Very high	88.9	Confident	1 Å²	1	30.6 Å²	30.6	1%	0.006	15%	0.148	C	C	.	.	H	α-helix	trans	-73.7	-34.5	-179.3	176	0	0	0	0	111.2	D191 M192 N195 T227 V228 P229 S234 V235	D191-V231 VanDerWaalsContact OD2-CG2 3.27Å; D191-V231 WeakPolarHBondContact OD2-CG2 3.41Å; M192-V231 HydrophobicContact CE-CG1 4.06Å; N195-V231 HydrophobicContact CB-CB 4.32Å; N195-V231 HydrophobicContact CB-CG1 4.25Å; T227-V231 WeakPolarHBondContact O-CG2 3.43Å; V228-V231 PolarHBondContact O-N 2.97Å; P229-V231 PolarHBondContact O-N 3.09Å; V231-S234 WeakPolarHBondContact O-CB 3.28Å; V231-S234 PolarHBondContact O-N 3.25Å; V231-V235 PolarHBondContact O-N 3.44Å
232	F	90.6	Very high	88.7	Confident	78 Å²	78	31.1 Å²	31.1	34%	0.342	15%	0.15	S	C	.	.	H	α-helix	trans	-66.8	-39.1	169.5	-67.6	-66.5	0	0	0	112.3	M192 V196 L199 V228 P229 S234 Y236	M192-F232 HydrophobicContact CE-CD1 3.68Å; M192-F232 HydrophobicContact CE-CE1 4.01Å; M192-F232 HydrophobicContact CE-CG 4.46Å; M192-F232 HydrophobicContact SD-CD1 3.92Å; M192-F232 HydrophobicContact SD-CE1 3.58Å; M192-F232 VanDerWaalsContact SD-CE1 3.58Å; M192-F232 HydrophobicContact SD-CZ 4.4Å; V196-F232 HydrophobicContact CG2-CE1 4.04Å; V196-F232 HydrophobicContact CG2-CZ 3.98Å; L199-F232 HydrophobicContact CD2-CE2 4.05Å; L199-F232 HydrophobicContact CD2-CZ 4.01Å; V228-F232 HydrophobicContact CG1-CD2 4.18Å; V228-F232 HydrophobicContact CG1-CE2 3.61Å; V228-F232 WeakPolarHBondContact O-CD2 3.41Å; P229-F232 PolarHBondContact O-N 3.46Å; F232-S234 VanDerWaalsContact C-N 3.32Å; F232-Y236 WeakPolarHBondContact O-CB 3.36Å; F232-Y236 PolarHBondContact O-N 2.9Å
233	V	89.4	Confident	88.5	Confident	27 Å²	27	29.1 Å²	29.1	16%	0.164	14%	0.138	C	C	.	.	H	α-helix	trans	-63.9	-38.3	172	175.7	0	0	0	0	111.4	A60 F61 P229 P230 V235 Y236 L237	A60-V233 HydrophobicContact CB-CG1 4.44Å; F61-V233 HydrophobicContact CD1-CB 4.09Å; F61-V233 HydrophobicContact CD1-CG1 3.88Å; F61-V233 HydrophobicContact CD2-CG1 4.3Å; F61-V233 HydrophobicContact CE1-CB 4.38Å; F61-V233 HydrophobicContact CE1-CG1 4.02Å; F61-V233 HydrophobicContact CE2-CG1 4.42Å; F61-V233 HydrophobicContact CG-CG1 4.03Å; F61-V233 HydrophobicContact CZ-CG1 4.29Å; P229-V233 PolarHBondContact O-N 2.67Å; P229-V233 VanDerWaalsContact O-N 3.13Å; P230-V233 PolarHBondContact O-N 3.38Å; V233-V235 PolarHBondContact O-N 3.23Å; V233-Y236 PolarHBondContact O-N 2.94Å; V233-L237 HydrophobicContact CG1-CD1 3.68Å; V233-L237 HydrophobicContact CG1-CG 4.16Å; V233-L237 WeakPolarHBondContact O-CB 3.31Å; V233-L237 WeakPolarHBondContact O-CG 3.33Å; V233-L237 PolarHBondContact O-N 3.31Å
234	S	86.8	Confident	88.5	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.146	C	C	.	.	H	α-helix	trans	-60.1	-46	179.3	-168.2	0	0	0	0	112.6	P230 V231 F232 N238 R239	P230-S234 WeakPolarHBondContact O-CB 3.45Å; P230-S234 PolarHBondContact O-N 3.01Å; V231-S234 WeakPolarHBondContact O-CB 3.28Å; V231-S234 PolarHBondContact O-N 3.25Å; F232-S234 VanDerWaalsContact C-N 3.32Å; S234-N238 WeakPolarHBondContact O-CA 3.48Å; S234-N238 PolarHBondContact O-N 3.48Å; S234-R239 VanDerWaalsContact CA-O 3.24Å; S234-R239 WeakPolarHBondContact CA-O 3.35Å; S234-R239 WeakPolarHBondContact CB-O 3.33Å; S234-R239 PolarHBondContact O-N 3.27Å; S234-R239 VanDerWaalsContact O-N 3.13Å; S234-R239 PolarHBondContact OG-O 3.15Å
235	V	87.1	Confident	88.5	Confident	33 Å²	33	31 Å²	31	20%	0.2	15%	0.147	C	C	.	.	H	α-helix	trans	-72.8	-33.6	176.7	176.6	0	0	0	0	112	F182 L188 M192 V231 V233 N238	F182-V235 HydrophobicContact CB-CG1 4.43Å; F182-V235 HydrophobicContact CD1-CG1 4.43Å; F182-V235 HydrophobicContact CD2-CB 4.31Å; F182-V235 HydrophobicContact CD2-CG1 3.77Å; F182-V235 HydrophobicContact CD2-CG2 3.59Å; F182-V235 HydrophobicContact CE2-CG1 4.09Å; F182-V235 HydrophobicContact CE2-CG2 3.81Å; F182-V235 HydrophobicContact CG-CG1 3.95Å; F182-V235 HydrophobicContact CG-CG2 4.49Å; L188-V235 HydrophobicContact CD1-CG2 4.03Å; L188-V235 HydrophobicContact CD2-CG2 4.1Å; L188-V235 HydrophobicContact CG-CG2 3.97Å; M192-V235 HydrophobicContact CE-CB 3.83Å; M192-V235 HydrophobicContact CE-CG1 4.43Å; M192-V235 HydrophobicContact CE-CG2 3.41Å; M192-V235 VanDerWaalsContact CE-CG2 3.41Å; V231-V235 PolarHBondContact O-N 3.44Å; V233-V235 PolarHBondContact O-N 3.23Å; V235-N238 PolarHBondContact O-ND2 3.29Å
236	Y	87.4	Confident	88.6	Confident	199 Å²	199	30.8 Å²	30.8	78%	0.78	15%	0.146	S	C	*	.	H	α-helix	trans	-64.4	-39	174	-178.3	-100.4	0	0	0	112.6	F232 V233	F232-Y236 WeakPolarHBondContact O-CB 3.36Å; F232-Y236 PolarHBondContact O-N 2.9Å; V233-Y236 PolarHBondContact O-N 2.94Å
237	L	83.6	Confident	88.6	Confident	56 Å²	56	30.8 Å²	30.8	29%	0.293	15%	0.147	S	C	.	.	H	α-helix	trans	-92.9	-5	-179.4	-61.9	-179.3	0	0	0	114.4	A60 F61 V233 R239	A60-L237 HydrophobicContact CB-CD1 4.35Å; F61-L237 HydrophobicContact CE2-CD1 4.18Å; F61-L237 HydrophobicContact CZ-CD1 4.33Å; V233-L237 HydrophobicContact CG1-CD1 3.68Å; V233-L237 HydrophobicContact CG1-CG 4.16Å; V233-L237 WeakPolarHBondContact O-CB 3.31Å; V233-L237 WeakPolarHBondContact O-CG 3.33Å; V233-L237 PolarHBondContact O-N 3.31Å; L237-R239 HydrophobicContact CB-CB 4.31Å; L237-R239 PolarHBondContact O-N 3.18Å
238	N	82.3	Confident	88.7	Confident	65 Å²	65	30.7 Å²	30.7	35%	0.348	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.1	41.3	-169.4	-71	-90.7	0	0	0	113	Q180 F182 S234 V235	Q180-N238 CarbonylContact O-C 3.55Å; Q180-N238 VanDerWaalsContact O-O 3.12Å; F182-N238 PolarHBondContact N-OD1 3.06Å; S234-N238 WeakPolarHBondContact O-CA 3.48Å; S234-N238 PolarHBondContact O-N 3.48Å; V235-N238 PolarHBondContact O-ND2 3.29Å
239	R	82.6	Confident	88.7	Confident	20 Å²	20	30.4 Å²	30.4	8%	0.075	15%	0.145	C	C	.	.			trans	-141.9	133.3	-176.3	-156.6	-175.2	-61.4	-167.8	0.1	109.1	D51 Q55 F61 E177 S178 S234 L237	D51-R239 IonicContact OD2-NH2 3.17Å; D51-R239 PolarHBondContact OD2-NH2 3.28Å; D51-R239 VanDerWaalsContact OD2-NH2 3.17Å; Q55-R239 PolarHBondContact O-NH1 3.3Å; F61-R239 WeakPolarHBondContact CZ-O 3.28Å; E177-R239 HydrophobicContact CG-CG 4.19Å; E177-R239 WeakPolarHBondContact OE1-CD 3.47Å; E177-R239 IonicContact OE1-CZ 2.68Å; E177-R239 IonicContact OE1-NE 3.76Å; E177-R239 IonicContact OE1-NH1 3.44Å; E177-R239 PolarHBondContact OE1-NH1 3.12Å; S178-R239 CarbonylContact O-C 3.6Å; S178-R239 WeakPolarHBondContact O-CA 3.24Å; S178-R239 VanDerWaalsContact O-CG 3.3Å; S178-R239 WeakPolarHBondContact O-CG 3.39Å; S234-R239 VanDerWaalsContact CA-O 3.24Å; S234-R239 WeakPolarHBondContact CA-O 3.35Å; S234-R239 WeakPolarHBondContact CB-O 3.33Å; S234-R239 PolarHBondContact O-N 3.27Å; S234-R239 VanDerWaalsContact O-N 3.13Å; S234-R239 PolarHBondContact OG-O 3.15Å; L237-R239 HydrophobicContact CB-CB 4.31Å; L237-R239 PolarHBondContact O-N 3.18Å
240	S	84	Confident	88.7	Confident	6 Å²	6	30.9 Å²	30.9	4%	0.042	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	148.6	176.4	-159.6	0	0	0	0	110.5	E177 S178 Q180 R245	E177-S240 WeakPolarHBondContact CA-O 3.4Å; S178-S240 PolarHBondContact N-O 2.7Å; S178-S240 PolarHBondContact O-N 3.32Å; Q180-S240 PolarHBondContact OE1-OG 2.8Å; S240-R245 PolarHBondContact OG-NH2 2.99Å
241	W	87.5	Confident	88.6	Confident	23 Å²	23	31 Å²	31	9%	0.087	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	127.1	172.1	179.3	58.8	0	0	0	108.4	W58 F61 L62 I176 G243 R245	W58-W241 HydrophobicContact CB-CD2 4.29Å; W58-W241 HydrophobicContact CB-CG 4.27Å; W58-W241 HydrophobicContact CB-CZ2 4.34Å; W58-W241 HydrophobicContact CE3-CZ2 4.29Å; F61-W241 HydrophobicContact CB-CD2 4.22Å; F61-W241 HydrophobicContact CB-CE3 3.34Å; F61-W241 HydrophobicContact CB-CZ3 3.67Å; F61-W241 HydrophobicContact CD1-CB 4.1Å; F61-W241 HydrophobicContact CD1-CE3 4.35Å; F61-W241 HydrophobicContact CD2-CB 4.12Å; F61-W241 HydrophobicContact CD2-CE3 4.42Å; F61-W241 HydrophobicContact CD2-CG 4.47Å; F61-W241 HydrophobicContact CE1-CB 4.02Å; F61-W241 HydrophobicContact CE2-CB 4.06Å; F61-W241 HydrophobicContact CG-CB 4.15Å; F61-W241 HydrophobicContact CG-CD2 4.37Å; F61-W241 AromaticContact CG-CE3 3.84Å; F61-W241 HydrophobicContact CG-CE3 3.84Å; F61-W241 HydrophobicContact CZ-CB 4.01Å; L62-W241 HydrophobicContact CB-CH2 4.19Å; L62-W241 HydrophobicContact CB-CZ3 4.48Å; I176-W241 WeakPolarHBondContact O-CA 3.31Å; I176-W241 VanDerWaalsContact O-CD1 3.28Å; W241-G243 VanDerWaalsContact CZ2-CA 3.46Å; W241-R245 PolarHBondContact O-NE 3.41Å; W241-R245 PolarHBondContact O-NH2 3.11Å
242	L	85.9	Confident	88.6	Confident	10 Å²	10	32.4 Å²	32.4	5%	0.052	15%	0.152	C	C	.	.			trans	-68.7	-49.1	-178.1	-172.6	66.5	0	0	0	110.9	Y168 D171 I176 L244 R245	Y168-L242 HydrophobicContact CD2-CD1 3.77Å; Y168-L242 HydrophobicContact CE2-CD1 3.63Å; Y168-L242 HydrophobicContact CE2-CG 4.07Å; D171-L242 HydrophobicContact CB-CD1 3.7Å; I176-L242 PolarHBondContact O-N 3.28Å; L242-L244 PolarHBondContact O-N 2.91Å; L242-R245 VanDerWaalsContact O-CB 3.24Å; L242-R245 WeakPolarHBondContact O-CB 3.41Å; L242-R245 WeakPolarHBondContact O-CG 3.28Å; L242-R245 PolarHBondContact O-N 2.99Å; L242-R245 VanDerWaalsContact O-N 3.11Å
243	G	86.7	Confident	88.6	Confident	1 Å²	1	31.1 Å²	31.1	1%	0.01	15%	0.148	C	C	.	.	G	3₁₀ helix	trans	41.5	-128.8	167.7	0	0	0	0	0	115.4	W241 R245 F246	W241-G243 VanDerWaalsContact CZ2-CA 3.46Å; G243-R245 VanDerWaalsContact C-N 3.3Å; G243-R245 PolarHBondContact O-N 2.96Å; G243-F246 WeakPolarHBondContact O-CD1 3.25Å; G243-F246 WeakPolarHBondContact O-CE1 3.19Å
244	L	91.4	Very high	88.4	Confident	32 Å²	32	30.7 Å²	30.7	17%	0.168	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-87.6	16	-176.8	-59.1	177.1	0	0	0	114	L62 F226 L242 F246 L247 L293	L62-L244 HydrophobicContact CD1-CD1 3.89Å; F226-L244 HydrophobicContact CB-CD1 4.41Å; F226-L244 HydrophobicContact CD1-CD1 3.47Å; F226-L244 VanDerWaalsContact CD1-CD1 3.47Å; F226-L244 HydrophobicContact CE1-CD1 3.95Å; F226-L244 HydrophobicContact CG-CD1 4.14Å; L242-L244 PolarHBondContact O-N 2.91Å; L244-F246 HydrophobicContact CD2-CE1 3.76Å; L244-F246 HydrophobicContact CD2-CZ 3.69Å; L244-F246 PolarHBondContact O-N 3.3Å; L244-F246 VanDerWaalsContact O-N 3.12Å; L244-L247 HydrophobicContact CB-CD1 4Å; L244-L247 HydrophobicContact CB-CG 4.45Å; L244-L247 WeakPolarHBondContact O-CB 3.34Å; L244-L247 WeakPolarHBondContact O-CG 3.29Å; L244-L247 PolarHBondContact O-N 3.41Å; L244-L247 VanDerWaalsContact O-N 3.08Å; L244-L293 HydrophobicContact CD2-CD2 4.15Å
245	R	91.9	Very high	88.4	Confident	16 Å²	16	33.9 Å²	33.9	6%	0.06	16%	0.159	C	C	.	.	G	3₁₀ helix	trans	-57.2	-27.2	178.8	-71.7	178.1	-164.3	-138.2	-4.6	112.8	Y168 D171 D191 S240 W241 L242 G243 L247 R248	Y168-R245 HydrophobicContact CD2-CB 3.51Å; Y168-R245 HydrophobicContact CE2-CB 4.2Å; Y168-R245 HydrophobicContact CG-CB 4.24Å; D171-R245 IonicContact OD1-NH1 3.6Å; D171-R245 WeakPolarHBondContact OD2-CD 3.45Å; D171-R245 IonicContact OD2-CZ 3.66Å; D171-R245 IonicContact OD2-NE 2.69Å; D171-R245 IonicContact OD2-NH1 2.75Å; D171-R245 PolarHBondContact OD2-NH1 3.06Å; D191-R245 IonicContact OD2-NH1 2.76Å; S240-R245 PolarHBondContact OG-NH2 2.99Å; W241-R245 PolarHBondContact O-NE 3.41Å; W241-R245 PolarHBondContact O-NH2 3.11Å; L242-R245 VanDerWaalsContact O-CB 3.24Å; L242-R245 WeakPolarHBondContact O-CB 3.41Å; L242-R245 WeakPolarHBondContact O-CG 3.28Å; L242-R245 PolarHBondContact O-N 2.99Å; L242-R245 VanDerWaalsContact O-N 3.11Å; G243-R245 VanDerWaalsContact C-N 3.3Å; G243-R245 PolarHBondContact O-N 2.96Å; R245-L247 PolarHBondContact O-N 3.09Å; R245-L247 VanDerWaalsContact O-N 3.14Å; R245-R248 VanDerWaalsContact O-CB 3.31Å; R245-R248 WeakPolarHBondContact O-CB 3.25Å; R245-R248 WeakPolarHBondContact O-CD 3.42Å; R245-R248 WeakPolarHBondContact O-CG 3.4Å; R245-R248 PolarHBondContact O-N 3.29Å; R245-R248 VanDerWaalsContact O-N 3.1Å
246	F	92.8	Very high	88.4	Confident	5 Å²	5	32.5 Å²	32.5	2%	0.022	15%	0.15	C	C	.	.	G	3₁₀ helix	trans	-58.9	-24	176.4	63.8	-97.6	0	0	0	114.4	Y168 G243 L244 R248 A249 T286 G289 F290 L293	Y168-F246 HydrophobicContact CE1-CB 3.85Å; Y168-F246 HydrophobicContact CE2-CB 4.02Å; G243-F246 WeakPolarHBondContact O-CD1 3.25Å; G243-F246 WeakPolarHBondContact O-CE1 3.19Å; L244-F246 HydrophobicContact CD2-CE1 3.76Å; L244-F246 HydrophobicContact CD2-CZ 3.69Å; L244-F246 PolarHBondContact O-N 3.3Å; L244-F246 VanDerWaalsContact O-N 3.12Å; F246-R248 PolarHBondContact O-N 3Å; F246-A249 WeakPolarHBondContact O-CB 3.3Å; F246-A249 PolarHBondContact O-N 3.42Å; F246-T286 HydrophobicContact CD2-CG2 3.9Å; F246-T286 WeakPolarHBondContact CD2-O 3.14Å; F246-T286 HydrophobicContact CE2-CG2 4.12Å; F246-G289 WeakPolarHBondContact CD1-O 3.24Å; F246-F290 HydrophobicContact CE2-CB 4.02Å; F246-F290 HydrophobicContact CE2-CD2 4.48Å; F246-F290 HydrophobicContact CZ-CB 4.01Å; F246-F290 AromaticContact CZ-CD2 3.96Å; F246-F290 HydrophobicContact CZ-CD2 3.96Å; F246-F290 HydrophobicContact CZ-CG 4.48Å; F246-L293 HydrophobicContact CE1-CB 4.3Å; F246-L293 HydrophobicContact CE1-CD2 4.02Å
247	L	93.1	Very high	88.3	Confident	29 Å²	29	27.6 Å²	27.6	15%	0.152	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-60.8	-16.8	176.2	-65.5	176.1	0	0	0	112.9	V223 F226 T227 L244 R245 A249 L250 T286	V223-L247 WeakPolarHBondContact CG1-O 3.41Å; F226-L247 HydrophobicContact CB-CD1 3.57Å; F226-L247 HydrophobicContact CD2-CD1 4.19Å; F226-L247 HydrophobicContact CG-CD1 4.01Å; T227-L247 HydrophobicContact CG2-CB 4.26Å; L244-L247 HydrophobicContact CB-CD1 4Å; L244-L247 HydrophobicContact CB-CG 4.45Å; L244-L247 WeakPolarHBondContact O-CB 3.34Å; L244-L247 WeakPolarHBondContact O-CG 3.29Å; L244-L247 PolarHBondContact O-N 3.41Å; L244-L247 VanDerWaalsContact O-N 3.08Å; R245-L247 PolarHBondContact O-N 3.09Å; R245-L247 VanDerWaalsContact O-N 3.14Å; L247-A249 PolarHBondContact O-N 3.09Å; L247-L250 HydrophobicContact CD2-CD1 4.06Å; L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.12Å; L247-T286 HydrophobicContact CD2-CG2 3.97Å
248	R	92.8	Very high	88.4	Confident	1 Å²	1	25.5 Å²	25.5	0%	0.004	12%	0.124	C	C	.	.	G	3₁₀ helix	trans	-54.7	-29.7	169.5	-66.8	170.8	-176.9	-164	-2	112.4	A164 L165 D191 N195 T227 R245 F246 L250 R251	A164-R248 VanDerWaalsContact O-CD 3.24Å; A164-R248 WeakPolarHBondContact O-CD 3.47Å; A164-R248 PolarHBondContact O-NH1 3.25Å; L165-R248 HydrophobicContact CD1-CB 4.47Å; D191-R248 VanDerWaalsContact CG-NH2 3.28Å; D191-R248 IonicContact OD1-CZ 3.46Å; D191-R248 IonicContact OD1-NH1 3.87Å; D191-R248 PolarHBondContact OD1-NH1 2.67Å; D191-R248 IonicContact OD1-NH2 3.71Å; D191-R248 PolarHBondContact OD1-NH2 2.97Å; D191-R248 IonicContact OD2-CZ 3.47Å; D191-R248 IonicContact OD2-NH1 3.99Å; D191-R248 IonicContact OD2-NH2 3.19Å; D191-R248 PolarHBondContact OD2-NH2 3.48Å; N195-R248 PolarHBondContact ND2-NH2 3.46Å; T227-R248 HydrophobicContact CG2-CG 3.76Å; R245-R248 VanDerWaalsContact O-CB 3.31Å; R245-R248 WeakPolarHBondContact O-CB 3.25Å; R245-R248 WeakPolarHBondContact O-CD 3.42Å; R245-R248 WeakPolarHBondContact O-CG 3.4Å; R245-R248 PolarHBondContact O-N 3.29Å; R245-R248 VanDerWaalsContact O-N 3.1Å; F246-R248 PolarHBondContact O-N 3Å; R248-L250 VanDerWaalsContact C-N 3.25Å; R248-L250 PolarHBondContact O-N 3.27Å; R248-R251 WeakPolarHBondContact O-CB 3.17Å; R248-R251 PolarHBondContact O-N 3.45Å; R248-R251 VanDerWaalsContact O-N 3.14Å
249	A	92.7	Very high	88.6	Confident	1 Å²	1	23.7 Å²	23.7	1%	0.008	11%	0.113	C	C	.	.	G	3₁₀ helix	trans	-63.6	-26.5	177	0	0	0	0	0	113.5	L165 F246 L247 R251 L252 S282 L285	L165-A249 HydrophobicContact CD1-CB 3.89Å; L165-A249 HydrophobicContact CD2-CB 4.44Å; F246-A249 WeakPolarHBondContact O-CB 3.3Å; F246-A249 PolarHBondContact O-N 3.42Å; L247-A249 PolarHBondContact O-N 3.09Å; A249-R251 PolarHBondContact O-N 2.94Å; A249-L252 WeakPolarHBondContact O-CB 3.36Å; A249-L252 WeakPolarHBondContact O-CG 3.32Å; A249-L252 PolarHBondContact O-N 3.41Å; A249-S282 WeakPolarHBondContact O-CB 3.41Å; A249-L285 HydrophobicContact CB-CB 3.9Å
250	L	92.4	Very high	88.7	Confident	30 Å²	30	27.3 Å²	27.3	16%	0.157	13%	0.131	C	C	.	.	G	3₁₀ helix	trans	-66.2	-22	175.1	-66.4	177.9	0	0	0	113	V219 V223 L247 R248 L252 I253 T286	V219-L250 HydrophobicContact CG1-CD1 4.38Å; V223-L250 HydrophobicContact CG2-CB 3.78Å; V223-L250 HydrophobicContact CG2-CD1 3.93Å; V223-L250 HydrophobicContact CG2-CG 4.46Å; L247-L250 HydrophobicContact CD2-CD1 4.06Å; L247-L250 WeakPolarHBondContact O-CB 3.43Å; L247-L250 PolarHBondContact O-N 3.12Å; R248-L250 VanDerWaalsContact C-N 3.25Å; R248-L250 PolarHBondContact O-N 3.27Å; L250-L252 PolarHBondContact O-N 3.34Å; L250-L252 VanDerWaalsContact O-N 3.15Å; L250-I253 HydrophobicContact CD2-CD1 4.22Å; L250-I253 WeakPolarHBondContact O-CB 3.29Å; L250-I253 VanDerWaalsContact O-CG1 3.32Å; L250-I253 WeakPolarHBondContact O-CG1 3.24Å; L250-I253 PolarHBondContact O-N 2.88Å; L250-I253 VanDerWaalsContact O-N 3.11Å; L250-T286 HydrophobicContact CD1-CG2 4.18Å; L250-T286 HydrophobicContact CD2-CG2 4.01Å; L250-T286 VanDerWaalsContact CD2-OG1 3.31Å; L250-T286 WeakPolarHBondContact CD2-OG1 3.46Å; L250-T286 HydrophobicContact CG-CG2 3.89Å; L250-T286 WeakPolarHBondContact CG-OG1 3.26Å
251	R	90.4	Very high	88.7	Confident	17 Å²	17	31 Å²	31	6%	0.064	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-63.9	-17.6	174.6	-63.3	-168.3	179.9	135.7	0.3	112.9	S161 F198 V223 D224 T227 R248 A249 I253 Q254	S161-R251 WeakPolarHBondContact OG-CD 3.48Å; F198-R251 VanDerWaalsContact CD2-NH1 3.32Å; F198-R251 VanDerWaalsContact CZ-NH1 3.31Å; V223-R251 HydrophobicContact CG1-CG 3.96Å; D224-R251 IonicContact OD1-CZ 3.62Å; D224-R251 IonicContact OD1-NE 3.65Å; D224-R251 PolarHBondContact OD1-NE 3.34Å; D224-R251 IonicContact OD1-NH2 2.69Å; D224-R251 PolarHBondContact OD1-NH2 3.35Å; T227-R251 PolarHBondContact OG1-NH2 2.84Å; R248-R251 WeakPolarHBondContact O-CB 3.17Å; R248-R251 PolarHBondContact O-N 3.45Å; R248-R251 VanDerWaalsContact O-N 3.14Å; A249-R251 PolarHBondContact O-N 2.94Å; R251-I253 PolarHBondContact O-N 3.43Å; R251-Q254 PolarHBondContact O-N 3.11Å
252	L	89.6	Confident	88.3	Confident	32 Å²	32	32.3 Å²	32.3	17%	0.168	16%	0.155	C	C	.	.	G	3₁₀ helix	trans	-64	-21.5	173.7	-62.7	176.4	0	0	0	113	I162 L165 A249 L250 Q254 F255 I281 L285	I162-L252 HydrophobicContact CG1-CD2 4.35Å; L165-L252 HydrophobicContact CD2-CD1 3.91Å; L165-L252 HydrophobicContact CD2-CD2 4.49Å; L165-L252 HydrophobicContact CD2-CG 4.31Å; A249-L252 WeakPolarHBondContact O-CB 3.36Å; A249-L252 WeakPolarHBondContact O-CG 3.32Å; A249-L252 PolarHBondContact O-N 3.41Å; L250-L252 PolarHBondContact O-N 3.34Å; L250-L252 VanDerWaalsContact O-N 3.15Å; L252-Q254 PolarHBondContact O-N 3.48Å; L252-F255 WeakPolarHBondContact O-CB 3.42Å; L252-F255 PolarHBondContact O-N 2.93Å; L252-I281 HydrophobicContact CD1-CG2 4.19Å; L252-L285 HydrophobicContact CD1-CD1 4.14Å
253	I	89.8	Confident	88.2	Confident	50 Å²	50	36.3 Å²	36.3	26%	0.256	18%	0.177	S	C	.	.	G	3₁₀ helix	trans	-57.9	-36.5	176.2	-63.3	171.5	0	0	0	111.2	L250 R251 F255 S256 I279 S282	L250-I253 HydrophobicContact CD2-CD1 4.22Å; L250-I253 WeakPolarHBondContact O-CB 3.29Å; L250-I253 VanDerWaalsContact O-CG1 3.32Å; L250-I253 WeakPolarHBondContact O-CG1 3.24Å; L250-I253 PolarHBondContact O-N 2.88Å; L250-I253 VanDerWaalsContact O-N 3.11Å; R251-I253 PolarHBondContact O-N 3.43Å; I253-F255 PolarHBondContact O-N 2.73Å; I253-F255 VanDerWaalsContact O-N 3.17Å; I253-S256 PolarHBondContact O-OG 2.83Å; I253-I279 HydrophobicContact CG2-CG1 4.37Å; I253-S282 WeakPolarHBondContact CG1-OG 3.4Å
254	Q	86.6	Confident	88.2	Confident	19 Å²	19	41.4 Å²	41.4	9%	0.089	20%	0.202	C	C	.	.	G	3₁₀ helix	trans	-70.2	-7.2	179.9	-62.7	-170.8	-40.7	0	0	113.8	N220 R251 L252 S256 E257 I258	N220-Q254 PolarHBondContact ND2-NE2 3Å; N220-Q254 VanDerWaalsContact ND2-NE2 3.19Å; R251-Q254 PolarHBondContact O-N 3.11Å; L252-Q254 PolarHBondContact O-N 3.48Å; Q254-S256 VanDerWaalsContact C-N 3.31Å; Q254-S256 PolarHBondContact O-N 3.09Å; Q254-E257 PolarHBondContact O-N 3.37Å; Q254-I258 HydrophobicContact CB-CD1 3.8Å; Q254-I258 HydrophobicContact CB-CG1 4.39Å; Q254-I258 WeakPolarHBondContact O-CB 3.4Å; Q254-I258 WeakPolarHBondContact O-CD1 3.27Å; Q254-I258 WeakPolarHBondContact O-CG1 3.35Å; Q254-I258 PolarHBondContact O-N 3.39Å
255	F	85.9	Confident	88	Confident	67 Å²	67	40.9 Å²	40.9	29%	0.294	20%	0.2	S	C	.	.	H	α-helix	trans	-60.9	-37.1	-175.2	-179.5	-139	0	0	0	113.3	F158 L252 I253 L259 V274	F158-F255 HydrophobicContact CD2-CD2 4.06Å; F158-F255 HydrophobicContact CE1-CD2 4.31Å; F158-F255 HydrophobicContact CE1-CE2 4Å; F158-F255 HydrophobicContact CE2-CB 4.25Å; F158-F255 AromaticContact CE2-CD2 3.19Å; F158-F255 HydrophobicContact CE2-CD2 3.19Å; F158-F255 AromaticContact CE2-CE2 3.66Å; F158-F255 HydrophobicContact CE2-CE2 3.66Å; F158-F255 AromaticContact CE2-CG 3.93Å; F158-F255 HydrophobicContact CE2-CG 3.93Å; F158-F255 AromaticContact CZ-CD2 3.34Å; F158-F255 HydrophobicContact CZ-CD2 3.34Å; F158-F255 AromaticContact CZ-CE2 3.23Å; F158-F255 HydrophobicContact CZ-CE2 3.23Å; F158-F255 HydrophobicContact CZ-CG 4.31Å; F158-F255 HydrophobicContact CZ-CZ 4.15Å; L252-F255 WeakPolarHBondContact O-CB 3.42Å; L252-F255 PolarHBondContact O-N 2.93Å; I253-F255 PolarHBondContact O-N 2.73Å; I253-F255 VanDerWaalsContact O-N 3.17Å; F255-L259 HydrophobicContact CD1-CD1 4.48Å; F255-L259 HydrophobicContact CD2-CD1 3.91Å; F255-L259 HydrophobicContact CD2-CG 3.89Å; F255-L259 HydrophobicContact CE1-CD1 4.04Å; F255-L259 HydrophobicContact CE2-CD1 3.41Å; F255-L259 VanDerWaalsContact CE2-CD1 3.41Å; F255-L259 HydrophobicContact CE2-CD2 4Å; F255-L259 HydrophobicContact CE2-CG 3.62Å; F255-L259 HydrophobicContact CG-CD1 4.44Å; F255-L259 HydrophobicContact CZ-CD1 3.5Å; F255-L259 VanDerWaalsContact CZ-CD1 3.5Å; F255-L259 HydrophobicContact CZ-CG 4.24Å; F255-L259 WeakPolarHBondContact O-CB 3.3Å; F255-L259 WeakPolarHBondContact O-CG 3.45Å; F255-L259 PolarHBondContact O-N 3.12Å; F255-V274 HydrophobicContact CD1-CG1 3.93Å; F255-V274 HydrophobicContact CE1-CG1 4.16Å
256	S	86.9	Confident	87.6	Confident	4 Å²	4	48.3 Å²	48.3	3%	0.028	23%	0.232	C	C	.	.	H	α-helix	trans	-62.9	-49.2	175.4	53.7	0	0	0	0	111.9	I253 Q254 L259 Q260 N275	I253-S256 PolarHBondContact O-OG 2.83Å; Q254-S256 VanDerWaalsContact C-N 3.31Å; Q254-S256 PolarHBondContact O-N 3.09Å; S256-L259 PolarHBondContact O-N 3.28Å; S256-Q260 WeakPolarHBondContact O-CB 3.11Å; S256-Q260 PolarHBondContact O-N 2.67Å; S256-N275 WeakPolarHBondContact CB-OD1 3.39Å; S256-N275 PolarHBondContact OG-OD1 3.37Å
257	E	85.6	Confident	87.3	Confident	96 Å²	96	52 Å²	52	45%	0.449	26%	0.255	S	S	.	.	H	α-helix	trans	-61.5	-45.6	176.8	-56.9	-175.6	150.5	0	0	111.5	Q254 L259 Q260 F261	Q254-E257 PolarHBondContact O-N 3.37Å; E257-L259 PolarHBondContact O-N 3.27Å; E257-Q260 WeakPolarHBondContact O-CB 3.3Å; E257-Q260 PolarHBondContact O-N 3.46Å; E257-Q260 VanDerWaalsContact O-N 3.15Å; E257-F261 HydrophobicContact CB-CE2 4.11Å; E257-F261 WeakPolarHBondContact O-CD2 3.42Å; E257-F261 WeakPolarHBondContact O-CG 3.24Å; E257-F261 PolarHBondContact O-N 3.29Å
258	I	85.5	Confident	87	Confident	12 Å²	12	55 Å²	55	6%	0.062	28%	0.279	C	S	.	.	H	α-helix	trans	-60.5	-46.3	179.7	-72.1	165.5	0	0	0	111.2	V154 F158 Q254 Q260 F261 L262	V154-I258 HydrophobicContact CG1-CB 4.31Å; V154-I258 HydrophobicContact CG1-CG1 4.01Å; V154-I258 HydrophobicContact CG1-CG2 3.87Å; F158-I258 HydrophobicContact CB-CD1 4.23Å; F158-I258 HydrophobicContact CB-CG2 4.16Å; F158-I258 HydrophobicContact CD2-CD1 4.23Å; F158-I258 HydrophobicContact CG-CG2 4.3Å; Q254-I258 HydrophobicContact CB-CD1 3.8Å; Q254-I258 HydrophobicContact CB-CG1 4.39Å; Q254-I258 WeakPolarHBondContact O-CB 3.4Å; Q254-I258 WeakPolarHBondContact O-CD1 3.27Å; Q254-I258 WeakPolarHBondContact O-CG1 3.35Å; Q254-I258 PolarHBondContact O-N 3.39Å; I258-Q260 VanDerWaalsContact C-N 3.3Å; I258-Q260 PolarHBondContact O-N 3.41Å; I258-F261 PolarHBondContact O-N 3.2Å; I258-L262 HydrophobicContact CG2-CD1 4.22Å; I258-L262 VanDerWaalsContact O-CG 3.32Å; I258-L262 WeakPolarHBondContact O-CG 3.42Å; I258-L262 PolarHBondContact O-N 3.03Å; I258-L262 VanDerWaalsContact O-N 3.1Å
259	L	85.8	Confident	86.6	Confident	26 Å²	26	59.2 Å²	59.2	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-69.3	-27.2	176.7	-72	179.3	0	0	0	113.2	F255 S256 E257 N263 I264 L265 V274	F255-L259 HydrophobicContact CD1-CD1 4.48Å; F255-L259 HydrophobicContact CD2-CD1 3.91Å; F255-L259 HydrophobicContact CD2-CG 3.89Å; F255-L259 HydrophobicContact CE1-CD1 4.04Å; F255-L259 HydrophobicContact CE2-CD1 3.41Å; F255-L259 VanDerWaalsContact CE2-CD1 3.41Å; F255-L259 HydrophobicContact CE2-CD2 4Å; F255-L259 HydrophobicContact CE2-CG 3.62Å; F255-L259 HydrophobicContact CG-CD1 4.44Å; F255-L259 HydrophobicContact CZ-CD1 3.5Å; F255-L259 VanDerWaalsContact CZ-CD1 3.5Å; F255-L259 HydrophobicContact CZ-CG 4.24Å; F255-L259 WeakPolarHBondContact O-CB 3.3Å; F255-L259 WeakPolarHBondContact O-CG 3.45Å; F255-L259 PolarHBondContact O-N 3.12Å; S256-L259 PolarHBondContact O-N 3.28Å; E257-L259 PolarHBondContact O-N 3.27Å; L259-N263 PolarHBondContact O-N 3.21Å; L259-I264 HydrophobicContact CD2-CB 4.32Å; L259-I264 HydrophobicContact CD2-CD1 3.68Å; L259-I264 HydrophobicContact CD2-CG2 4.34Å; L259-I264 PolarHBondContact O-N 2.94Å; L259-L265 HydrophobicContact CB-CD1 3.61Å; L259-L265 HydrophobicContact CB-CG 3.8Å; L259-L265 HydrophobicContact CD1-CD1 4.02Å; L259-L265 HydrophobicContact CD1-CG 4.32Å; L259-L265 PolarHBondContact O-N 3.35Å; L259-V274 HydrophobicContact CD1-CG1 4.23Å
260	Q	86.4	Confident	86.4	Confident	96 Å²	96	60.6 Å²	60.6	45%	0.449	31%	0.311	S	S	.	.	H	α-helix	trans	-70.6	-44.9	172	-170.8	179.5	4.6	0	0	111.2	S256 E257 I258 L262 N263	S256-Q260 WeakPolarHBondContact O-CB 3.11Å; S256-Q260 PolarHBondContact O-N 2.67Å; E257-Q260 WeakPolarHBondContact O-CB 3.3Å; E257-Q260 PolarHBondContact O-N 3.46Å; E257-Q260 VanDerWaalsContact O-N 3.15Å; I258-Q260 VanDerWaalsContact C-N 3.3Å; I258-Q260 PolarHBondContact O-N 3.41Å; Q260-L262 PolarHBondContact O-N 2.92Å; Q260-N263 WeakPolarHBondContact O-CA 3.47Å; Q260-N263 PolarHBondContact O-N 2.94Å
261	F	83.2	Confident	86.3	Confident	85 Å²	85	61.2 Å²	61.2	37%	0.373	31%	0.314	S	S	.	.	H	α-helix	trans	-59.1	-33.4	174.2	-68.2	-39.1	0	0	0	112.9	A145 E257 I258 N263	A145-F261 HydrophobicContact CB-CB 3.77Å; A145-F261 HydrophobicContact CB-CG 4.2Å; E257-F261 HydrophobicContact CB-CE2 4.11Å; E257-F261 WeakPolarHBondContact O-CD2 3.42Å; E257-F261 WeakPolarHBondContact O-CG 3.24Å; E257-F261 PolarHBondContact O-N 3.29Å; I258-F261 PolarHBondContact O-N 3.2Å; F261-N263 PolarHBondContact O-N 3.4Å; F261-N263 PolarHBondContact O-ND2 3Å
262	L	80	Confident	86.3	Confident	49 Å²	49	64.7 Å²	64.7	26%	0.257	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	0.5	174.3	-64.2	171.5	0	0	0	114	R151 V155 I258 Q260 I264	R151-L262 HydrophobicContact CB-CD2 4.36Å; V155-L262 HydrophobicContact CG2-CD1 3.85Å; V155-L262 HydrophobicContact CG2-CD2 3.79Å; V155-L262 HydrophobicContact CG2-CG 4.45Å; I258-L262 HydrophobicContact CG2-CD1 4.22Å; I258-L262 VanDerWaalsContact O-CG 3.32Å; I258-L262 WeakPolarHBondContact O-CG 3.42Å; I258-L262 PolarHBondContact O-N 3.03Å; I258-L262 VanDerWaalsContact O-N 3.1Å; Q260-L262 PolarHBondContact O-N 2.92Å; L262-I264 HydrophobicContact CB-CD1 3.85Å; L262-I264 HydrophobicContact CB-CG1 4.05Å; L262-I264 HydrophobicContact CD1-CD1 4.25Å; L262-I264 PolarHBondContact O-N 2.99Å
263	N	82.4	Confident	86.4	Confident	95 Å²	95	65.1 Å²	65.1	51%	0.508	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.1	26	-176.3	-69.2	-93.7	0	0	0	114.2	L259 Q260 F261 K266	L259-N263 PolarHBondContact O-N 3.21Å; Q260-N263 WeakPolarHBondContact O-CA 3.47Å; Q260-N263 PolarHBondContact O-N 2.94Å; F261-N263 PolarHBondContact O-N 3.4Å; F261-N263 PolarHBondContact O-ND2 3Å; N263-K266 WeakPolarHBondContact O-CE 3.26Å
264	I	86.5	Confident	86.5	Confident	107 Å²	107	64.1 Å²	64.1	55%	0.549	33%	0.328	S	S	.	.			trans	-80.6	-47.6	176.6	-65.4	168.6	0	0	0	109.4	L259 L262	L259-I264 HydrophobicContact CD2-CB 4.32Å; L259-I264 HydrophobicContact CD2-CD1 3.68Å; L259-I264 HydrophobicContact CD2-CG2 4.34Å; L259-I264 PolarHBondContact O-N 2.94Å; L262-I264 HydrophobicContact CB-CD1 3.85Å; L262-I264 HydrophobicContact CB-CG1 4.05Å; L262-I264 HydrophobicContact CD1-CD1 4.25Å; L262-I264 PolarHBondContact O-N 2.99Å
265	L	87.5	Confident	86.8	Confident	22 Å²	22	66 Å²	66	12%	0.115	34%	0.339	C	S	.	.			trans	-86.8	118.5	174.4	-59.6	174	0	0	0	110	L259 I271 V274	L259-L265 HydrophobicContact CB-CD1 3.61Å; L259-L265 HydrophobicContact CB-CG 3.8Å; L259-L265 HydrophobicContact CD1-CD1 4.02Å; L259-L265 HydrophobicContact CD1-CG 4.32Å; L259-L265 PolarHBondContact O-N 3.35Å; L265-I271 HydrophobicContact CB-CG1 3.71Å; L265-V274 HydrophobicContact CD1-CB 3.87Å; L265-V274 HydrophobicContact CD1-CG1 4.03Å; L265-V274 HydrophobicContact CD1-CG2 3.94Å; L265-V274 HydrophobicContact CD2-CG2 3.91Å
266	K	84.2	Confident	87.1	Confident	171 Å²	171	63.4 Å²	63.4	74%	0.743	33%	0.328	S	S	*	.			trans	-121.2	-20.3	-173.8	-64.2	-177.2	-176.9	178.1	0	114.7	N263	N263-K266 WeakPolarHBondContact O-CE 3.26Å
267	T	85.3	Confident	87.3	Confident	82 Å²	82	65.1 Å²	65.1	50%	0.503	34%	0.339	S	S	.	.	S	Bend	trans	-107.6	145.7	-179.1	72.7	0	0	0	0	110.6	N269 S270 I271	T267-N269 VanDerWaalsContact C-N 3.26Å; T267-N269 PolarHBondContact O-N 3.28Å; T267-S270 PolarHBondContact N-OG 2.96Å; T267-S270 PolarHBondContact O-N 3.19Å; T267-S270 PolarHBondContact O-OG 3.26Å; T267-S270 VanDerWaalsContact OG1-CB 3.31Å; T267-S270 WeakPolarHBondContact OG1-CB 3.07Å; T267-S270 PolarHBondContact OG1-N 2.92Å; T267-S270 PolarHBondContact OG1-OG 3.33Å; T267-S270 VanDerWaalsContact OG1-OG 3.05Å; T267-I271 WeakPolarHBondContact O-CG1 3.15Å; T267-I271 PolarHBondContact O-N 3.23Å
268	S	86.7	Confident	87.6	Confident	93 Å²	93	60.9 Å²	60.9	65%	0.65	32%	0.32	S	S	*	.	H	α-helix	trans	-51.1	-47	177.3	-171.6	0	0	0	0	111.7	S270 I271 K272	S268-S270 PolarHBondContact O-N 3.37Å; S268-I271 PolarHBondContact O-N 3.38Å; S268-K272 WeakPolarHBondContact O-CB 2.92Å; S268-K272 PolarHBondContact O-N 3.1Å
269	N	86	Confident	88	Confident	89 Å²	89	62 Å²	62	48%	0.476	33%	0.326	S	S	.	.	H	α-helix	trans	-60.3	-41.4	178.4	-60	30.5	0	0	0	112.3	T267 L273 L363	T267-N269 VanDerWaalsContact C-N 3.26Å; T267-N269 PolarHBondContact O-N 3.28Å; N269-L273 WeakPolarHBondContact O-CB 3.04Å; N269-L273 PolarHBondContact O-N 3.1Å; N269-L363 HydrophobicContact CB-CD2 3.98Å
270	S	87.6	Confident	88.3	Confident	30 Å²	30	62.1 Å²	62.1	21%	0.21	33%	0.326	C	S	.	.	H	α-helix	trans	-67.7	-38.8	177.5	68.6	0	0	0	0	112.8	T267 S268 V274	T267-S270 PolarHBondContact N-OG 2.96Å; T267-S270 PolarHBondContact O-N 3.19Å; T267-S270 PolarHBondContact O-OG 3.26Å; T267-S270 VanDerWaalsContact OG1-CB 3.31Å; T267-S270 WeakPolarHBondContact OG1-CB 3.07Å; T267-S270 PolarHBondContact OG1-N 2.92Å; T267-S270 PolarHBondContact OG1-OG 3.33Å; T267-S270 VanDerWaalsContact OG1-OG 3.05Å; S268-S270 PolarHBondContact O-N 3.37Å; S270-V274 WeakPolarHBondContact O-CG2 3.45Å; S270-V274 PolarHBondContact O-N 3.41Å; S270-V274 VanDerWaalsContact O-N 3.15Å
271	I	90	Very high	88.6	Confident	44 Å²	44	61 Å²	61	23%	0.226	32%	0.322	C	S	.	.	H	α-helix	trans	-67.1	-48.2	176.8	-64.2	166.2	0	0	0	109.6	L265 T267 S268 V274 N275	L265-I271 HydrophobicContact CB-CG1 3.71Å; T267-I271 WeakPolarHBondContact O-CG1 3.15Å; T267-I271 PolarHBondContact O-N 3.23Å; S268-I271 PolarHBondContact O-N 3.38Å; I271-V274 PolarHBondContact O-N 3.02Å; I271-N275 VanDerWaalsContact O-CB 3.27Å; I271-N275 WeakPolarHBondContact O-CB 3.45Å; I271-N275 PolarHBondContact O-N 3.48Å
272	K	90.9	Very high	89.1	Confident	89 Å²	89	57 Å²	57	39%	0.387	30%	0.304	S	S	.	.	H	α-helix	trans	-60.3	-47.4	178.8	-169.6	179.8	179	-170.2	0	111.8	S268 N275 L276 E359 L363	S268-K272 WeakPolarHBondContact O-CB 2.92Å; S268-K272 PolarHBondContact O-N 3.1Å; K272-N275 PolarHBondContact O-N 2.9Å; K272-L276 HydrophobicContact CG-CD1 4.06Å; K272-L276 WeakPolarHBondContact O-CG 3.35Å; K272-L276 PolarHBondContact O-N 3.36Å; K272-E359 WeakPolarHBondContact CE-OE1 3.46Å; K272-E359 WeakPolarHBondContact CE-OE2 3.49Å; K272-E359 VanDerWaalsContact NZ-CD 3.28Å; K272-E359 IonicContact NZ-OE1 3.22Å; K272-E359 PolarHBondContact NZ-OE1 3.08Å; K272-E359 IonicContact NZ-OE2 2.76Å; K272-L363 HydrophobicContact CB-CD1 4.32Å; K272-L363 HydrophobicContact CD-CD1 4.11Å; K272-L363 HydrophobicContact CG-CD1 4.06Å
273	L	91.4	Very high	89.7	Confident	42 Å²	42	56.6 Å²	56.6	22%	0.22	30%	0.304	C	S	.	.	H	α-helix	trans	-58.5	-52.5	178.1	177.7	61.4	0	0	0	111.7	N269 N275 L276 C277 I360 L363 I364	N269-L273 WeakPolarHBondContact O-CB 3.04Å; N269-L273 PolarHBondContact O-N 3.1Å; L273-N275 VanDerWaalsContact C-N 3.29Å; L273-N275 PolarHBondContact O-N 3.45Å; L273-L276 PolarHBondContact O-N 2.93Å; L273-C277 PolarHBondContact O-N 3.04Å; L273-C277 PolarHBondContact O-SG 2.95Å; L273-I360 HydrophobicContact CD1-CB 4.38Å; L273-I360 HydrophobicContact CD1-CG1 4.28Å; L273-I360 HydrophobicContact CD1-CG2 3.98Å; L273-L363 HydrophobicContact CB-CB 4.46Å; L273-L363 HydrophobicContact CB-CD1 4.17Å; L273-L363 HydrophobicContact CD1-CB 4.23Å; L273-I364 HydrophobicContact CD1-CD1 4.28Å; L273-I364 HydrophobicContact CD1-CG1 4.07Å; L273-I364 HydrophobicContact CD2-CG1 4.1Å
274	V	92.1	Very high	90.2	Very high	29 Å²	29	54.7 Å²	54.7	18%	0.176	29%	0.29	C	S	.	.	H	α-helix	trans	-62.8	-37.6	178.8	173.7	0	0	0	0	111.3	F255 L259 L265 S270 I271 S278	F255-V274 HydrophobicContact CD1-CG1 3.93Å; F255-V274 HydrophobicContact CE1-CG1 4.16Å; L259-V274 HydrophobicContact CD1-CG1 4.23Å; L265-V274 HydrophobicContact CD1-CB 3.87Å; L265-V274 HydrophobicContact CD1-CG1 4.03Å; L265-V274 HydrophobicContact CD1-CG2 3.94Å; L265-V274 HydrophobicContact CD2-CG2 3.91Å; S270-V274 WeakPolarHBondContact O-CG2 3.45Å; S270-V274 PolarHBondContact O-N 3.41Å; S270-V274 VanDerWaalsContact O-N 3.15Å; I271-V274 PolarHBondContact O-N 3.02Å; V274-S278 VanDerWaalsContact O-CB 3.26Å; V274-S278 WeakPolarHBondContact O-CB 3.32Å; V274-S278 PolarHBondContact O-N 3.48Å; V274-S278 PolarHBondContact O-OG 3.47Å
275	N	92.2	Very high	90.7	Very high	59 Å²	59	50.5 Å²	50.5	32%	0.316	27%	0.269	S	S	.	.	H	α-helix	trans	-64.6	-46.5	178.6	-161.9	58	0	0	0	112.6	S256 I271 K272 L273 S278 I279	S256-N275 WeakPolarHBondContact CB-OD1 3.39Å; S256-N275 PolarHBondContact OG-OD1 3.37Å; I271-N275 VanDerWaalsContact O-CB 3.27Å; I271-N275 WeakPolarHBondContact O-CB 3.45Å; I271-N275 PolarHBondContact O-N 3.48Å; K272-N275 PolarHBondContact O-N 2.9Å; L273-N275 VanDerWaalsContact C-N 3.29Å; L273-N275 PolarHBondContact O-N 3.45Å; N275-S278 PolarHBondContact O-N 3.3Å; N275-I279 VanDerWaalsContact O-CG1 3.32Å; N275-I279 WeakPolarHBondContact O-CG1 3.47Å; N275-I279 PolarHBondContact O-N 2.97Å
276	L	92.8	Very high	91	Very high	12 Å²	12	50.3 Å²	50.3	6%	0.063	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-48.1	175.9	-69.3	166	0	0	0	111.5	K272 L273 S278 I279 F280 Y356 E359 I360 L363	K272-L276 HydrophobicContact CG-CD1 4.06Å; K272-L276 WeakPolarHBondContact O-CG 3.35Å; K272-L276 PolarHBondContact O-N 3.36Å; L273-L276 PolarHBondContact O-N 2.93Å; L276-S278 VanDerWaalsContact C-N 3.32Å; L276-S278 PolarHBondContact O-N 3.42Å; L276-I279 PolarHBondContact O-N 3.25Å; L276-F280 VanDerWaalsContact O-CB 3.29Å; L276-F280 WeakPolarHBondContact O-CB 3.49Å; L276-F280 PolarHBondContact O-N 3.41Å; L276-Y356 HydrophobicContact CD2-CD1 3.72Å; L276-Y356 HydrophobicContact CD2-CD2 4.31Å; L276-Y356 HydrophobicContact CD2-CE1 3.87Å; L276-Y356 HydrophobicContact CD2-CE2 4.44Å; L276-Y356 HydrophobicContact CD2-CG 3.96Å; L276-E359 HydrophobicContact CD1-CB 4.32Å; L276-E359 HydrophobicContact CD1-CG 3.81Å; L276-E359 VanDerWaalsContact CD1-OE2 3.23Å; L276-E359 WeakPolarHBondContact CD1-OE2 3.24Å; L276-E359 WeakPolarHBondContact CD2-OE2 3.44Å; L276-I360 HydrophobicContact CB-CD1 4.08Å; L276-I360 HydrophobicContact CB-CG1 3.93Å; L276-I360 HydrophobicContact CD1-CG1 4.31Å; L276-L363 HydrophobicContact CD1-CD1 3.94Å
277	C	92	Very high	91.5	Very high	39 Å²	39	42.6 Å²	42.6	26%	0.264	24%	0.237	S	C	.	.	H	α-helix	trans	-61.1	-40.2	176.6	-65.5	0	0	0	0	112.2	L273 I281	L273-C277 PolarHBondContact O-N 3.04Å; L273-C277 PolarHBondContact O-SG 2.95Å; C277-I281 WeakPolarHBondContact O-CB 3.42Å; C277-I281 WeakPolarHBondContact O-CD1 3.17Å; C277-I281 VanDerWaalsContact O-CG1 3.23Å; C277-I281 WeakPolarHBondContact O-CG1 3.28Å; C277-I281 PolarHBondContact O-N 3.32Å
278	S	92.1	Very high	91.9	Very high	7 Å²	7	38.7 Å²	38.7	5%	0.049	21%	0.213	C	C	.	.	H	α-helix	trans	-64.6	-47.8	-179.9	-58.9	0	0	0	0	111.7	V274 N275 L276 S282	V274-S278 VanDerWaalsContact O-CB 3.26Å; V274-S278 WeakPolarHBondContact O-CB 3.32Å; V274-S278 PolarHBondContact O-N 3.48Å; V274-S278 PolarHBondContact O-OG 3.47Å; N275-S278 PolarHBondContact O-N 3.3Å; L276-S278 VanDerWaalsContact C-N 3.32Å; L276-S278 PolarHBondContact O-N 3.42Å; S278-S282 VanDerWaalsContact O-CB 3.24Å; S278-S282 WeakPolarHBondContact O-CB 3.37Å; S278-S282 PolarHBondContact O-N 3.31Å; S278-S282 PolarHBondContact O-OG 3.21Å; S278-S282 VanDerWaalsContact O-OG 3.09Å
279	I	92.1	Very high	92.3	Very high	36 Å²	36	34.3 Å²	34.3	19%	0.185	18%	0.182	C	C	.	.	H	α-helix	trans	-67	-40.4	179.1	-63.2	164	0	0	0	111.2	I253 N275 L276 S282 T283 Y356	I253-I279 HydrophobicContact CG2-CG1 4.37Å; N275-I279 VanDerWaalsContact O-CG1 3.32Å; N275-I279 WeakPolarHBondContact O-CG1 3.47Å; N275-I279 PolarHBondContact O-N 2.97Å; L276-I279 PolarHBondContact O-N 3.25Å; I279-S282 WeakPolarHBondContact CA-OG 3.49Å; I279-S282 PolarHBondContact O-OG 3.06Å; I279-S282 VanDerWaalsContact O-OG 3.06Å; I279-T283 VanDerWaalsContact O-CB 3.27Å; I279-T283 WeakPolarHBondContact O-CB 3.36Å; I279-T283 PolarHBondContact O-N 3.47Å; I279-T283 VanDerWaalsContact O-N 3.09Å; I279-T283 PolarHBondContact O-OG1 2.64Å; I279-Y356 HydrophobicContact CB-CE2 4.32Å; I279-Y356 HydrophobicContact CG2-CE2 3.9Å
280	F	92.9	Very high	92.7	Very high	28 Å²	28	33.7 Å²	33.7	12%	0.123	18%	0.175	C	C	.	.	H	α-helix	trans	-61.1	-53.3	176.8	-176.1	-96.6	0	0	0	111.3	L276 T283 W284 M323 F353 Y356 V357	L276-F280 VanDerWaalsContact O-CB 3.29Å; L276-F280 WeakPolarHBondContact O-CB 3.49Å; L276-F280 PolarHBondContact O-N 3.41Å; F280-T283 PolarHBondContact O-N 3.04Å; F280-W284 WeakPolarHBondContact O-CB 3.18Å; F280-W284 PolarHBondContact O-N 3.28Å; F280-M323 HydrophobicContact CZ-CE 4.34Å; F280-F353 HydrophobicContact CE2-CD2 4.27Å; F280-F353 HydrophobicContact CZ-CD2 4.28Å; F280-Y356 HydrophobicContact CB-CD2 4.33Å; F280-V357 HydrophobicContact CE2-CG2 4.4Å
281	I	93	Very high	93	Very high	73 Å²	73	32.3 Å²	32.3	37%	0.374	17%	0.165	S	C	.	.	H	α-helix	trans	-65.5	-44.4	-178.4	-66.5	167.4	0	0	0	111	L252 C277 T283 L285	L252-I281 HydrophobicContact CD1-CG2 4.19Å; C277-I281 WeakPolarHBondContact O-CB 3.42Å; C277-I281 WeakPolarHBondContact O-CD1 3.17Å; C277-I281 VanDerWaalsContact O-CG1 3.23Å; C277-I281 WeakPolarHBondContact O-CG1 3.28Å; C277-I281 PolarHBondContact O-N 3.32Å; I281-T283 VanDerWaalsContact C-N 3.31Å; I281-T283 PolarHBondContact O-N 2.79Å; I281-L285 HydrophobicContact CG2-CD1 3.64Å; I281-L285 HydrophobicContact CG2-CG 4.25Å; I281-L285 WeakPolarHBondContact O-CB 3.45Å; I281-L285 VanDerWaalsContact O-CG 3.3Å; I281-L285 WeakPolarHBondContact O-CG 3.29Å; I281-L285 PolarHBondContact O-N 3.42Å
282	S	93	Very high	93.2	Very high	0 Å²	0	30.5 Å²	30.5	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-60.6	-42.2	179.4	67.9	0	0	0	0	112	A249 I253 S278 I279 T286	A249-S282 WeakPolarHBondContact O-CB 3.41Å; I253-S282 WeakPolarHBondContact CG1-OG 3.4Å; S278-S282 VanDerWaalsContact O-CB 3.24Å; S278-S282 WeakPolarHBondContact O-CB 3.37Å; S278-S282 PolarHBondContact O-N 3.31Å; S278-S282 PolarHBondContact O-OG 3.21Å; S278-S282 VanDerWaalsContact O-OG 3.09Å; I279-S282 WeakPolarHBondContact CA-OG 3.49Å; I279-S282 PolarHBondContact O-OG 3.06Å; I279-S282 VanDerWaalsContact O-OG 3.06Å; S282-T286 VanDerWaalsContact O-CB 3.25Å; S282-T286 WeakPolarHBondContact O-CB 3.22Å; S282-T286 PolarHBondContact O-N 3.41Å; S282-T286 PolarHBondContact O-OG1 3.32Å
283	T	92.4	Very high	93.2	Very high	41 Å²	41	27.5 Å²	27.5	25%	0.252	14%	0.144	S	C	.	.	H	α-helix	trans	-74	-41.7	-175.6	-50.5	0	0	0	0	111.1	I279 F280 I281 T286 A287 M352	I279-T283 VanDerWaalsContact O-CB 3.27Å; I279-T283 WeakPolarHBondContact O-CB 3.36Å; I279-T283 PolarHBondContact O-N 3.47Å; I279-T283 VanDerWaalsContact O-N 3.09Å; I279-T283 PolarHBondContact O-OG1 2.64Å; F280-T283 PolarHBondContact O-N 3.04Å; I281-T283 VanDerWaalsContact C-N 3.31Å; I281-T283 PolarHBondContact O-N 2.79Å; T283-T286 PolarHBondContact O-N 3.38Å; T283-A287 VanDerWaalsContact O-CB 3.27Å; T283-A287 WeakPolarHBondContact O-CB 3.39Å; T283-A287 PolarHBondContact O-N 3.37Å; T283-M352 HydrophobicContact CG2-CE 3.82Å; T283-M352 HydrophobicContact CG2-SD 4.07Å
284	W	94.4	Very high	93.2	Very high	56 Å²	56	26.3 Å²	26.3	21%	0.212	14%	0.138	C	C	.	.	H	α-helix	trans	-59.7	-50.8	174.1	174.1	35.6	0	0	0	112.4	F280 T286 A287 A288 V316 M320 M323	F280-W284 WeakPolarHBondContact O-CB 3.18Å; F280-W284 PolarHBondContact O-N 3.28Å; W284-T286 VanDerWaalsContact C-N 3.35Å; W284-T286 PolarHBondContact O-N 2.94Å; W284-A287 PolarHBondContact O-N 2.88Å; W284-A288 WeakPolarHBondContact O-CB 3.27Å; W284-A288 PolarHBondContact O-N 2.77Å; W284-V316 HydrophobicContact CH2-CG1 3.94Å; W284-V316 HydrophobicContact CZ2-CG1 3.29Å; W284-V316 PolarHBondContact NE1-O 3.32Å; W284-M320 HydrophobicContact CZ2-CB 3.83Å; W284-M320 HydrophobicContact CZ2-CG 4.25Å; W284-M320 HydrophobicContact CZ2-SD 4.38Å; W284-M323 HydrophobicContact CB-CE 4.04Å; W284-M323 VanDerWaalsContact CD1-CE 3.45Å; W284-M323 HydrophobicContact CD2-CE 4.39Å; W284-M323 HydrophobicContact CG-CE 3.7Å
285	L	95.1	Very high	93.2	Very high	19 Å²	19	24.9 Å²	24.9	10%	0.099	13%	0.13	C	C	.	.	H	α-helix	trans	-65.7	-35.5	179.8	-68.3	175.4	0	0	0	112.8	F169 A249 L252 I281 G289 Y312 V316	F169-L285 HydrophobicContact CZ-CD1 4.41Å; A249-L285 HydrophobicContact CB-CB 3.9Å; L252-L285 HydrophobicContact CD1-CD1 4.14Å; I281-L285 HydrophobicContact CG2-CD1 3.64Å; I281-L285 HydrophobicContact CG2-CG 4.25Å; I281-L285 WeakPolarHBondContact O-CB 3.45Å; I281-L285 VanDerWaalsContact O-CG 3.3Å; I281-L285 WeakPolarHBondContact O-CG 3.29Å; I281-L285 PolarHBondContact O-N 3.42Å; L285-G289 PolarHBondContact O-N 3.19Å; L285-G289 VanDerWaalsContact O-N 3.09Å; L285-Y312 WeakPolarHBondContact CA-OH 3.08Å; L285-Y312 WeakPolarHBondContact CB-OH 3.45Å; L285-Y312 HydrophobicContact CD2-CE1 4.4Å; L285-Y312 WeakPolarHBondContact CD2-OH 3.3Å; L285-Y312 PolarHBondContact O-OH 3.01Å; L285-V316 HydrophobicContact CD2-CG2 4.22Å
286	T	94.3	Very high	93	Very high	18 Å²	18	23.7 Å²	23.7	11%	0.11	12%	0.123	C	C	.	.	H	α-helix	trans	-69.6	-44	176.4	-56.8	0	0	0	0	111.2	F246 L247 L250 S282 T283 W284 A288 G289 F290	F246-T286 HydrophobicContact CD2-CG2 3.9Å; F246-T286 WeakPolarHBondContact CD2-O 3.14Å; F246-T286 HydrophobicContact CE2-CG2 4.12Å; L247-T286 HydrophobicContact CD2-CG2 3.97Å; L250-T286 HydrophobicContact CD1-CG2 4.18Å; L250-T286 HydrophobicContact CD2-CG2 4.01Å; L250-T286 VanDerWaalsContact CD2-OG1 3.31Å; L250-T286 WeakPolarHBondContact CD2-OG1 3.46Å; L250-T286 HydrophobicContact CG-CG2 3.89Å; L250-T286 WeakPolarHBondContact CG-OG1 3.26Å; S282-T286 VanDerWaalsContact O-CB 3.25Å; S282-T286 WeakPolarHBondContact O-CB 3.22Å; S282-T286 PolarHBondContact O-N 3.41Å; S282-T286 PolarHBondContact O-OG1 3.32Å; T283-T286 PolarHBondContact O-N 3.38Å; W284-T286 VanDerWaalsContact C-N 3.35Å; W284-T286 PolarHBondContact O-N 2.94Å; T286-A288 VanDerWaalsContact C-N 3.33Å; T286-A288 PolarHBondContact O-N 3.17Å; T286-G289 PolarHBondContact O-N 2.92Å; T286-F290 PolarHBondContact O-N 2.81Å
287	A	94.7	Very high	92.7	Very high	9 Å²	9	24.6 Å²	24.6	7%	0.074	13%	0.131	C	C	.	.	H	α-helix	trans	-62.8	-40.3	175.3	0	0	0	0	0	111.6	T283 W284 G289 F290 I291 L319 F341 F345	T283-A287 VanDerWaalsContact O-CB 3.27Å; T283-A287 WeakPolarHBondContact O-CB 3.39Å; T283-A287 PolarHBondContact O-N 3.37Å; W284-A287 PolarHBondContact O-N 2.88Å; A287-G289 VanDerWaalsContact C-N 3.3Å; A287-G289 PolarHBondContact O-N 3.15Å; A287-F290 PolarHBondContact O-N 2.88Å; A287-I291 PolarHBondContact O-N 3.04Å; A287-L319 HydrophobicContact CB-CD1 3.47Å; A287-L319 VanDerWaalsContact CB-CD1 3.47Å; A287-F341 HydrophobicContact CB-CE1 4.41Å; A287-F341 HydrophobicContact CB-CZ 3.89Å; A287-F345 HydrophobicContact CB-CD2 3.8Å; A287-F345 HydrophobicContact CB-CE2 3.43Å; A287-F345 VanDerWaalsContact CB-CE2 3.43Å; A287-F345 HydrophobicContact CB-CZ 4.25Å
288	A	95.1	Very high	92.4	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-62	-39.9	176.4	0	0	0	0	0	111.3	W284 T286 I291 H292 Y312 V316 L319	W284-A288 WeakPolarHBondContact O-CB 3.27Å; W284-A288 PolarHBondContact O-N 2.77Å; T286-A288 VanDerWaalsContact C-N 3.33Å; T286-A288 PolarHBondContact O-N 3.17Å; A288-I291 WeakPolarHBondContact O-CG2 3.43Å; A288-H292 WeakPolarHBondContact O-CB 3.21Å; A288-H292 PolarHBondContact O-N 2.92Å; A288-Y312 HydrophobicContact CB-CE2 4.06Å; A288-V316 HydrophobicContact CB-CB 4.31Å; A288-V316 HydrophobicContact CB-CG2 3.53Å; A288-L319 HydrophobicContact CB-CD1 4.15Å; A288-L319 VanDerWaalsContact N-CD1 3.25Å
289	G	93.8	Very high	92.1	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-69.3	-31.9	175.8	0	0	0	0	0	113.9	F246 L285 T286 A287 L293	F246-G289 WeakPolarHBondContact CD1-O 3.24Å; L285-G289 PolarHBondContact O-N 3.19Å; L285-G289 VanDerWaalsContact O-N 3.09Å; T286-G289 PolarHBondContact O-N 2.92Å; A287-G289 VanDerWaalsContact C-N 3.3Å; A287-G289 PolarHBondContact O-N 3.15Å; G289-L293 WeakPolarHBondContact O-CB 3.36Å; G289-L293 PolarHBondContact O-N 2.85Å
290	F	94.6	Very high	91.7	Very high	77 Å²	77	24 Å²	24	34%	0.338	13%	0.129	S	C	.	.	H	α-helix	trans	-66.9	-51.4	173.3	-175.2	-87.7	0	0	0	111.7	F246 T286 A287 H292 L293 V294 F341	F246-F290 HydrophobicContact CE2-CB 4.02Å; F246-F290 HydrophobicContact CE2-CD2 4.48Å; F246-F290 HydrophobicContact CZ-CB 4.01Å; F246-F290 AromaticContact CZ-CD2 3.96Å; F246-F290 HydrophobicContact CZ-CD2 3.96Å; F246-F290 HydrophobicContact CZ-CG 4.48Å; T286-F290 PolarHBondContact O-N 2.81Å; A287-F290 PolarHBondContact O-N 2.88Å; F290-H292 VanDerWaalsContact C-N 3.3Å; F290-H292 PolarHBondContact O-N 3.46Å; F290-L293 PolarHBondContact O-N 3.16Å; F290-V294 HydrophobicContact CD1-CG2 4.14Å; F290-V294 HydrophobicContact CE1-CG2 3.71Å; F290-V294 HydrophobicContact CZ-CG2 3.99Å; F290-V294 WeakPolarHBondContact O-CG2 3.33Å; F290-V294 PolarHBondContact O-N 3.21Å; F290-F341 HydrophobicContact CB-CE2 4.45Å; F290-F341 HydrophobicContact CB-CZ 4.3Å; F290-F341 HydrophobicContact CD1-CB 4.3Å; F290-F341 AromaticContact CD1-CD1 3.98Å; F290-F341 HydrophobicContact CD1-CD1 3.98Å; F290-F341 AromaticContact CD1-CD2 3.36Å; F290-F341 HydrophobicContact CD1-CD2 3.36Å; F290-F341 HydrophobicContact CD1-CE1 4.11Å; F290-F341 AromaticContact CD1-CE2 3.52Å; F290-F341 HydrophobicContact CD1-CE2 3.52Å; F290-F341 AromaticContact CD1-CG 3.6Å; F290-F341 HydrophobicContact CD1-CG 3.6Å; F290-F341 AromaticContact CD1-CZ 3.9Å; F290-F341 HydrophobicContact CD1-CZ 3.9Å; F290-F341 HydrophobicContact CE1-CB 3.91Å; F290-F341 HydrophobicContact CE1-CD1 4.45Å; F290-F341 AromaticContact CE1-CD2 3.42Å; F290-F341 HydrophobicContact CE1-CD2 3.42Å; F290-F341 VanDerWaalsContact CE1-CD2 3.42Å; F290-F341 HydrophobicContact CE1-CE2 4.02Å; F290-F341 AromaticContact CE1-CG 3.67Å; F290-F341 HydrophobicContact CE1-CG 3.67Å; F290-F341 HydrophobicContact CG-CD2 4.32Å; F290-F341 HydrophobicContact CG-CE2 4.09Å; F290-F341 HydrophobicContact CG-CZ 4.38Å; F290-F341 HydrophobicContact CZ-CD2 4.4Å
291	I	94.2	Very high	91.2	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-66.2	-34.1	178.3	-169.6	63	0	0	0	111.7	A287 A288 V294 E295 C315 L319 A333 F341	A287-I291 PolarHBondContact O-N 3.04Å; A288-I291 WeakPolarHBondContact O-CG2 3.43Å; I291-V294 PolarHBondContact O-N 3.42Å; I291-E295 HydrophobicContact CD1-CG 3.82Å; I291-E295 HydrophobicContact CG1-CG 4Å; I291-E295 PolarHBondContact O-N 2.96Å; I291-C315 HydrophobicContact CG2-CB 3.87Å; I291-L319 HydrophobicContact CG2-CD1 4.22Å; I291-L319 HydrophobicContact CG2-CD2 4.24Å; I291-L319 HydrophobicContact CG2-CG 4.25Å; I291-A333 HydrophobicContact CD1-CB 4.26Å; I291-F341 HydrophobicContact CB-CD1 4.16Å; I291-F341 HydrophobicContact CB-CE1 4.2Å; I291-F341 HydrophobicContact CD1-CD1 4.3Å
292	H	93.9	Very high	90.6	Very high	7 Å²	7	31.8 Å²	31.8	3%	0.032	16%	0.158	C	C	.	.	H	α-helix	trans	-60.7	-42.8	171.5	-178.1	-101.4	0	0	0	112.7	A288 F290 N296 L310 S311 Y312 C315	A288-H292 WeakPolarHBondContact O-CB 3.21Å; A288-H292 PolarHBondContact O-N 2.92Å; F290-H292 VanDerWaalsContact C-N 3.3Å; F290-H292 PolarHBondContact O-N 3.46Å; H292-N296 PolarHBondContact CD2-ND2 3.24Å; H292-N296 PolarHBondContact NE2-ND2 2.83Å; H292-N296 WeakPolarHBondContact O-CB 3.17Å; H292-N296 PolarHBondContact O-N 3.02Å; H292-N296 PolarHBondContact O-ND2 3.43Å; H292-L310 PolarHBondContact CD2-O 2.91Å; H292-L310 PolarHBondContact NE2-O 3.29Å; H292-L310 VanDerWaalsContact NE2-O 3.13Å; H292-S311 VanDerWaalsContact CD2-C 3.4Å; H292-Y312 HydrophobicContact CB-CD2 4.28Å; H292-Y312 WeakPolarHBondContact CD2-CA 3.14Å; H292-Y312 PolarHBondContact CD2-N 3.19Å; H292-Y312 PolarHBondContact NE2-N 3.23Å; H292-Y312 VanDerWaalsContact NE2-N 3.12Å; H292-C315 VanDerWaalsContact CA-SG 3.59Å; H292-C315 HydrophobicContact CB-CB 4.14Å
293	L	91.1	Very high	90	Very high	25 Å²	25	36.7 Å²	36.7	13%	0.131	18%	0.184	C	C	.	.	H	α-helix	trans	-64.6	-43	174.7	179.8	65.7	0	0	0	111	L244 F246 G289 F290 S297	L244-L293 HydrophobicContact CD2-CD2 4.15Å; F246-L293 HydrophobicContact CE1-CB 4.3Å; F246-L293 HydrophobicContact CE1-CD2 4.02Å; G289-L293 WeakPolarHBondContact O-CB 3.36Å; G289-L293 PolarHBondContact O-N 2.85Å; F290-L293 PolarHBondContact O-N 3.16Å; L293-S297 WeakPolarHBondContact O-CB 3.32Å; L293-S297 PolarHBondContact O-N 2.98Å; L293-S297 VanDerWaalsContact O-N 3.08Å; L293-S297 PolarHBondContact O-OG 3.2Å
294	V	91.8	Very high	89.4	Confident	17 Å²	17	38 Å²	38	10%	0.103	19%	0.187	C	C	.	.	H	α-helix	trans	-70.6	-52.2	-174.7	171.5	0	0	0	0	112.4	F290 I291 N296 S297 G298 T335 L337	F290-V294 HydrophobicContact CD1-CG2 4.14Å; F290-V294 HydrophobicContact CE1-CG2 3.71Å; F290-V294 HydrophobicContact CZ-CG2 3.99Å; F290-V294 WeakPolarHBondContact O-CG2 3.33Å; F290-V294 PolarHBondContact O-N 3.21Å; I291-V294 PolarHBondContact O-N 3.42Å; V294-N296 PolarHBondContact O-N 3.44Å; V294-S297 PolarHBondContact O-N 2.94Å; V294-G298 PolarHBondContact O-N 3.04Å; V294-T335 WeakPolarHBondContact CG1-OG1 3.42Å; V294-L337 HydrophobicContact CG1-CB 3.59Å
295	E	91.2	Very high	88.6	Confident	0 Å²	0	43 Å²	43	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-64.3	-42.2	-178	-69.3	-68.2	123.9	0	0	112.1	I291 S297 S307 Q308 L310 A333 K334 T335	I291-E295 HydrophobicContact CD1-CG 3.82Å; I291-E295 HydrophobicContact CG1-CG 4Å; I291-E295 PolarHBondContact O-N 2.96Å; E295-S297 PolarHBondContact O-N 2.77Å; E295-S307 WeakPolarHBondContact O-CA 3.35Å; E295-Q308 CarbonylContact C-O 3.57Å; E295-Q308 PolarHBondContact O-N 2.85Å; E295-L310 HydrophobicContact CB-CD1 4.26Å; E295-L310 HydrophobicContact CG-CD1 4.29Å; E295-A333 WeakPolarHBondContact OE1-CB 3.5Å; E295-A333 WeakPolarHBondContact OE2-CA 3.08Å; E295-K334 PolarHBondContact OE1-N 3.44Å; E295-K334 PolarHBondContact OE2-N 3.39Å; E295-T335 WeakPolarHBondContact OE1-CB 3.23Å; E295-T335 PolarHBondContact OE1-N 2.91Å; E295-T335 VanDerWaalsContact OE1-N 3.08Å; E295-T335 PolarHBondContact OE1-OG1 2.87Å; E295-T335 PolarHBondContact OE2-N 3.29Å
296	N	88.8	Confident	88.2	Confident	33 Å²	33	44.4 Å²	44.4	18%	0.176	22%	0.22	C	C	.	.	H	α-helix	trans	-69.2	-31.6	176.4	-72.5	-63	0	0	0	112.6	I176 H292 V294 S307 Q308 S309 L310	I176-N296 HydrophobicContact CD1-CB 3.85Å; I176-N296 WeakPolarHBondContact CD1-O 3.35Å; I176-N296 HydrophobicContact CG1-CB 4.3Å; H292-N296 PolarHBondContact CD2-ND2 3.24Å; H292-N296 PolarHBondContact NE2-ND2 2.83Å; H292-N296 WeakPolarHBondContact O-CB 3.17Å; H292-N296 PolarHBondContact O-N 3.02Å; H292-N296 PolarHBondContact O-ND2 3.43Å; V294-N296 PolarHBondContact O-N 3.44Å; N296-S307 WeakPolarHBondContact O-CB 3.49Å; N296-Q308 PolarHBondContact OD1-O 2.86Å; N296-S309 VanDerWaalsContact OD1-CA 3.27Å; N296-S309 WeakPolarHBondContact OD1-CA 3.32Å; N296-L310 PolarHBondContact ND2-O 3.01Å; N296-L310 PolarHBondContact OD1-N 3.49Å; N296-L310 PolarHBondContact OD1-O 3.15Å
297	S	86	Confident	87.7	Confident	32 Å²	32	46.5 Å²	46.5	22%	0.224	24%	0.235	C	C	.	.	H	α-helix	trans	-74	-38.3	178.9	-62.6	0	0	0	0	112.8	L293 V294 E295 F304	L293-S297 WeakPolarHBondContact O-CB 3.32Å; L293-S297 PolarHBondContact O-N 2.98Å; L293-S297 VanDerWaalsContact O-N 3.08Å; L293-S297 PolarHBondContact O-OG 3.2Å; V294-S297 PolarHBondContact O-N 2.94Å; E295-S297 PolarHBondContact O-N 2.77Å; S297-F304 WeakPolarHBondContact O-CB 3.36Å; S297-F304 WeakPolarHBondContact O-CD1 3.29Å
298	G	85.6	Confident	87.3	Confident	3 Å²	3	47.3 Å²	47.3	3%	0.031	24%	0.237	C	C	.	.			trans	83.5	166.9	-169.3	0	0	0	0	0	113.7	V294 F304 N306	V294-G298 PolarHBondContact O-N 3.04Å; G298-F304 WeakPolarHBondContact O-CD1 3.36Å; G298-N306 WeakPolarHBondContact CA-OD1 3.13Å
299	D	86.4	Confident	86.9	Confident	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.275	C	S	.	.			trans	-77.5	130.8	177.7	-70.3	-46.1	0	0	0	111	W301 E302 F304 N306 T336 L337	D299-W301 HydrophobicContact CB-CD2 4.3Å; D299-W301 HydrophobicContact CB-CE3 3.72Å; D299-W301 HydrophobicContact CB-CH2 4.1Å; D299-W301 HydrophobicContact CB-CZ3 3.61Å; D299-W301 VanDerWaalsContact CG-CZ3 3.44Å; D299-W301 PolarHBondContact O-N 3.32Å; D299-W301 VanDerWaalsContact O-N 3.11Å; D299-E302 PolarHBondContact O-N 2.93Å; D299-F304 PolarHBondContact O-N 3.38Å; D299-N306 PolarHBondContact N-OD1 3.03Å; D299-N306 PolarHBondContact OD2-ND2 2.69Å; D299-T336 PolarHBondContact OD1-N 3.26Å; D299-T336 VanDerWaalsContact OD2-CB 3.29Å; D299-T336 WeakPolarHBondContact OD2-CB 3.44Å; D299-T336 PolarHBondContact OD2-N 2.96Å; D299-T336 PolarHBondContact OD2-OG1 3.42Å; D299-L337 WeakPolarHBondContact OD1-CB 3.28Å; D299-L337 VanDerWaalsContact OD1-CG 3.31Å; D299-L337 WeakPolarHBondContact OD1-CG 3.23Å; D299-L337 PolarHBondContact OD1-N 2.94Å
300	P	82.4	Confident	86.7	Confident	67 Å²	67	53.2 Å²	53.2	44%	0.435	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-19	-176.9	-24.5	33	0	0	0	116.2	F304	P300-F304 HydrophobicContact CB-CE1 3.97Å; P300-F304 HydrophobicContact CB-CZ 3.89Å; P300-F304 HydrophobicContact CG-CE1 3.84Å; P300-F304 HydrophobicContact CG-CZ 4.17Å
301	W	83.4	Confident	86.7	Confident	152 Å²	152	51.9 Å²	51.9	58%	0.576	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-16.5	-176.6	-10.7	-75.5	0	0	0	112.7	D299 N303 T336 L337	D299-W301 HydrophobicContact CB-CD2 4.3Å; D299-W301 HydrophobicContact CB-CE3 3.72Å; D299-W301 HydrophobicContact CB-CH2 4.1Å; D299-W301 HydrophobicContact CB-CZ3 3.61Å; D299-W301 VanDerWaalsContact CG-CZ3 3.44Å; D299-W301 PolarHBondContact O-N 3.32Å; D299-W301 VanDerWaalsContact O-N 3.11Å; W301-N303 VanDerWaalsContact C-N 3.31Å; W301-T336 HydrophobicContact CH2-CG2 3.98Å; W301-T336 HydrophobicContact CZ3-CG2 3.98Å; W301-L337 HydrophobicContact CH2-CD2 4.31Å; W301-L337 HydrophobicContact CH2-CG 3.92Å; W301-L337 HydrophobicContact CZ2-CD1 4.32Å; W301-L337 HydrophobicContact CZ2-CD2 3.99Å; W301-L337 HydrophobicContact CZ2-CG 3.89Å
302	E	79.8	Confident	86.7	Confident	112 Å²	112	51.9 Å²	51.9	52%	0.523	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	29.5	173	-59.1	-66	172.5	0	0	110.5	D299 F304 E305	D299-E302 PolarHBondContact O-N 2.93Å; E302-F304 PolarHBondContact O-N 3.26Å; E302-E305 WeakPolarHBondContact O-CB 3.47Å; E302-E305 PolarHBondContact O-N 3.36Å
303	N	80.5	Confident	86.7	Confident	102 Å²	102	58.2 Å²	58.2	55%	0.545	30%	0.301	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.8	23.8	-175.3	-62.3	-42.7	0	0	0	115.4	W301 E305	W301-N303 VanDerWaalsContact C-N 3.31Å; N303-E305 HydrophobicContact CB-CG 4.39Å; N303-E305 PolarHBondContact O-N 3.38Å
304	F	80.3	Confident	86.9	Confident	70 Å²	70	60.9 Å²	60.9	31%	0.307	31%	0.313	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	12.6	-172.2	-49.5	-80	0	0	0	115.6	S297 G298 D299 P300 E302 N306 S307	S297-F304 WeakPolarHBondContact O-CB 3.36Å; S297-F304 WeakPolarHBondContact O-CD1 3.29Å; G298-F304 WeakPolarHBondContact O-CD1 3.36Å; D299-F304 PolarHBondContact O-N 3.38Å; P300-F304 HydrophobicContact CB-CE1 3.97Å; P300-F304 HydrophobicContact CB-CZ 3.89Å; P300-F304 HydrophobicContact CG-CE1 3.84Å; P300-F304 HydrophobicContact CG-CZ 4.17Å; E302-F304 PolarHBondContact O-N 3.26Å; F304-N306 VanDerWaalsContact C-N 3.31Å; F304-N306 PolarHBondContact O-N 3.24Å; F304-S307 PolarHBondContact O-OG 3.34Å
305	E	78.6	Confident	87	Confident	159 Å²	159	60 Å²	60	74%	0.743	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-27.3	179.7	-66.2	-175.1	-167.5	0	0	113	E302 N303 S307	E302-E305 WeakPolarHBondContact O-CB 3.47Å; E302-E305 PolarHBondContact O-N 3.36Å; N303-E305 HydrophobicContact CB-CG 4.39Å; N303-E305 PolarHBondContact O-N 3.38Å; E305-S307 PolarHBondContact O-N 2.93Å
306	N	86.1	Confident	87.2	Confident	49 Å²	49	60.7 Å²	60.7	26%	0.262	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	21.2	-178.1	76.9	-12.6	0	0	0	114.7	G298 D299 F304	G298-N306 WeakPolarHBondContact CA-OD1 3.13Å; D299-N306 PolarHBondContact N-OD1 3.03Å; D299-N306 PolarHBondContact OD2-ND2 2.69Å; F304-N306 VanDerWaalsContact C-N 3.31Å; F304-N306 PolarHBondContact O-N 3.24Å
307	S	84.1	Confident	87.6	Confident	62 Å²	62	63.4 Å²	63.4	43%	0.434	32%	0.321	S	S	.	.			trans	-65.6	145	177.1	40.4	0	0	0	0	112.2	E295 N296 F304 E305	E295-S307 WeakPolarHBondContact O-CA 3.35Å; N296-S307 WeakPolarHBondContact O-CB 3.49Å; F304-S307 PolarHBondContact O-OG 3.34Å; E305-S307 PolarHBondContact O-N 2.93Å
308	Q	86	Confident	88	Confident	26 Å²	26	62.3 Å²	62.3	12%	0.121	31%	0.312	C	S	.	.			trans	-122.7	117.3	175.7	-178.5	175	-66.8	0	0	109.7	E295 N296 L310 Y332	E295-Q308 CarbonylContact C-O 3.57Å; E295-Q308 PolarHBondContact O-N 2.85Å; N296-Q308 PolarHBondContact OD1-O 2.86Å; Q308-L310 HydrophobicContact CG-CD2 4.46Å; Q308-L310 HydrophobicContact CG-CG 4.08Å; Q308-L310 PolarHBondContact O-N 3.46Å; Q308-Y332 PolarHBondContact NE2-O 3.43Å
309	S	85.9	Confident	88.4	Confident	112 Å²	112	62.1 Å²	62.1	78%	0.783	31%	0.311	S	S	*	.			trans	-66.9	92.2	173.9	58.2	0	0	0	0	111.1	N296	N296-S309 VanDerWaalsContact OD1-CA 3.27Å; N296-S309 WeakPolarHBondContact OD1-CA 3.32Å
310	L	90.3	Very high	88.7	Confident	12 Å²	12	65.4 Å²	65.4	6%	0.063	33%	0.327	C	S	.	.			trans	-109.9	134.9	170.9	-74.6	-178.8	0	0	0	109.3	H292 E295 N296 Q308 E314 V331	H292-L310 PolarHBondContact CD2-O 2.91Å; H292-L310 PolarHBondContact NE2-O 3.29Å; H292-L310 VanDerWaalsContact NE2-O 3.13Å; E295-L310 HydrophobicContact CB-CD1 4.26Å; E295-L310 HydrophobicContact CG-CD1 4.29Å; N296-L310 PolarHBondContact ND2-O 3.01Å; N296-L310 PolarHBondContact OD1-N 3.49Å; N296-L310 PolarHBondContact OD1-O 3.15Å; Q308-L310 HydrophobicContact CG-CD2 4.46Å; Q308-L310 HydrophobicContact CG-CG 4.08Å; Q308-L310 PolarHBondContact O-N 3.46Å; L310-E314 HydrophobicContact CD2-CB 4.17Å; L310-V331 HydrophobicContact CD1-CG1 4.28Å; L310-V331 HydrophobicContact CD2-CG1 4Å
311	S	93.6	Very high	89.3	Confident	49 Å²	49	62.9 Å²	62.9	34%	0.343	31%	0.31	S	S	.	.			trans	-71	155.8	166.2	69.7	0	0	0	0	111.4	H292 W313 E314 C315	H292-S311 VanDerWaalsContact CD2-C 3.4Å; S311-W313 PolarHBondContact O-N 3.09Å; S311-W313 VanDerWaalsContact O-N 3.16Å; S311-E314 VanDerWaalsContact CB-OE2 3.24Å; S311-E314 WeakPolarHBondContact CB-OE2 3.26Å; S311-E314 PolarHBondContact N-OE2 2.68Å; S311-E314 PolarHBondContact O-N 2.8Å; S311-E314 VanDerWaalsContact O-N 3.13Å; S311-E314 WeakPolarHBondContact OG-CG 3.34Å; S311-E314 PolarHBondContact OG-N 3.02Å; S311-E314 PolarHBondContact OG-OE2 3.36Å; S311-C315 PolarHBondContact O-N 2.84Å; S311-C315 VanDerWaalsContact O-N 3.16Å
312	Y	94.2	Very high	89.8	Confident	1 Å²	1	56.8 Å²	56.8	0%	0.004	29%	0.29	C	S	.	.	H	α-helix	trans	-54.7	-36.5	176.5	179.2	-103.3	0	0	0	112.4	Y168 F169 L285 A288 H292 C315 V316	Y168-Y312 HydrophobicContact CE1-CD2 4.06Å; Y168-Y312 AromaticContact CE1-CE2 3.7Å; Y168-Y312 HydrophobicContact CE1-CE2 3.7Å; Y168-Y312 AromaticContact CZ-CE2 4Å; Y168-Y312 VanDerWaalsContact OH-CD2 3.26Å; Y168-Y312 WeakPolarHBondContact OH-CD2 3.49Å; Y168-Y312 WeakPolarHBondContact OH-CE2 3.41Å; F169-Y312 HydrophobicContact CD1-CD1 4.02Å; F169-Y312 AromaticContact CD1-CE1 3.66Å; F169-Y312 HydrophobicContact CD1-CE1 3.66Å; F169-Y312 HydrophobicContact CE1-CD1 4.2Å; F169-Y312 AromaticContact CE1-CE1 3.38Å; F169-Y312 HydrophobicContact CE1-CE1 3.38Å; F169-Y312 AromaticContact CE1-CZ 3.75Å; F169-Y312 HydrophobicContact CZ-CE1 4.35Å; L285-Y312 WeakPolarHBondContact CA-OH 3.08Å; L285-Y312 WeakPolarHBondContact CB-OH 3.45Å; L285-Y312 HydrophobicContact CD2-CE1 4.4Å; L285-Y312 WeakPolarHBondContact CD2-OH 3.3Å; L285-Y312 PolarHBondContact O-OH 3.01Å; A288-Y312 HydrophobicContact CB-CE2 4.06Å; H292-Y312 HydrophobicContact CB-CD2 4.28Å; H292-Y312 WeakPolarHBondContact CD2-CA 3.14Å; H292-Y312 PolarHBondContact CD2-N 3.19Å; H292-Y312 PolarHBondContact NE2-N 3.23Å; H292-Y312 VanDerWaalsContact NE2-N 3.12Å; Y312-C315 WeakPolarHBondContact O-CB 3.25Å; Y312-C315 PolarHBondContact O-N 3.16Å; Y312-V316 HydrophobicContact CD1-CG2 3.94Å; Y312-V316 HydrophobicContact CE1-CG2 3.47Å; Y312-V316 VanDerWaalsContact CE1-CG2 3.47Å; Y312-V316 HydrophobicContact CE2-CG2 4.32Å; Y312-V316 WeakPolarHBondContact O-CG2 3.29Å; Y312-V316 PolarHBondContact O-N 3.32Å
313	W	94.8	Very high	90.3	Very high	139 Å²	139	51.7 Å²	51.7	53%	0.527	27%	0.266	S	S	.	.	H	α-helix	trans	-72.9	-32.1	-178.6	-56.6	113.1	0	0	0	113.3	F169 S311 V316 Y317	F169-W313 HydrophobicContact CB-CZ2 4.15Å; F169-W313 HydrophobicContact CD1-CH2 4.18Å; F169-W313 HydrophobicContact CD1-CZ2 4.29Å; F169-W313 HydrophobicContact CD2-CH2 4.11Å; F169-W313 HydrophobicContact CD2-CZ2 4.32Å; F169-W313 HydrophobicContact CE1-CH2 4.29Å; F169-W313 HydrophobicContact CE2-CH2 4.2Å; F169-W313 HydrophobicContact CG-CH2 4.11Å; F169-W313 HydrophobicContact CG-CZ2 4.02Å; F169-W313 HydrophobicContact CZ-CH2 4.29Å; S311-W313 PolarHBondContact O-N 3.09Å; S311-W313 VanDerWaalsContact O-N 3.16Å; W313-V316 HydrophobicContact CE3-CB 4.4Å; W313-V316 HydrophobicContact CE3-CG1 4.49Å; W313-V316 HydrophobicContact CE3-CG2 4.21Å; W313-V316 HydrophobicContact CZ3-CG2 4.47Å; W313-V316 PolarHBondContact O-N 2.98Å; W313-Y317 WeakPolarHBondContact O-CB 3.39Å; W313-Y317 PolarHBondContact O-N 3.11Å
314	E	94.7	Very high	90.8	Very high	81 Å²	81	48.3 Å²	48.3	38%	0.379	25%	0.25	S	S	.	.	H	α-helix	trans	-67.3	-36.6	169.5	-71.1	160.9	116.8	0	0	111.4	L310 S311 Y317 L318	L310-E314 HydrophobicContact CD2-CB 4.17Å; S311-E314 VanDerWaalsContact CB-OE2 3.24Å; S311-E314 WeakPolarHBondContact CB-OE2 3.26Å; S311-E314 PolarHBondContact N-OE2 2.68Å; S311-E314 PolarHBondContact O-N 2.8Å; S311-E314 VanDerWaalsContact O-N 3.13Å; S311-E314 WeakPolarHBondContact OG-CG 3.34Å; S311-E314 PolarHBondContact OG-N 3.02Å; S311-E314 PolarHBondContact OG-OE2 3.36Å; E314-Y317 PolarHBondContact O-N 3.18Å; E314-L318 VanDerWaalsContact O-CB 3.3Å; E314-L318 WeakPolarHBondContact O-CB 3.13Å; E314-L318 PolarHBondContact O-N 2.73Å
315	C	94.7	Very high	91.4	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-66.1	-41.1	171.7	-66.3	0	0	0	0	112.4	I291 H292 S311 Y312 L318 L319	I291-C315 HydrophobicContact CG2-CB 3.87Å; H292-C315 VanDerWaalsContact CA-SG 3.59Å; H292-C315 HydrophobicContact CB-CB 4.14Å; S311-C315 PolarHBondContact O-N 2.84Å; S311-C315 VanDerWaalsContact O-N 3.16Å; Y312-C315 WeakPolarHBondContact O-CB 3.25Å; Y312-C315 PolarHBondContact O-N 3.16Å; C315-L318 PolarHBondContact O-N 2.76Å; C315-L319 WeakPolarHBondContact O-CG 3.42Å; C315-L319 PolarHBondContact O-N 3.21Å; C315-L319 VanDerWaalsContact O-N 3.09Å
316	V	95.7	Very high	92.2	Very high	13 Å²	13	45.9 Å²	45.9	8%	0.079	25%	0.252	C	S	.	.	H	α-helix	trans	-60.3	-44.5	174	167.7	0	0	0	0	111	W284 L285 A288 Y312 W313 M320	W284-V316 HydrophobicContact CH2-CG1 3.94Å; W284-V316 HydrophobicContact CZ2-CG1 3.29Å; W284-V316 PolarHBondContact NE1-O 3.32Å; L285-V316 HydrophobicContact CD2-CG2 4.22Å; A288-V316 HydrophobicContact CB-CB 4.31Å; A288-V316 HydrophobicContact CB-CG2 3.53Å; Y312-V316 HydrophobicContact CD1-CG2 3.94Å; Y312-V316 HydrophobicContact CE1-CG2 3.47Å; Y312-V316 VanDerWaalsContact CE1-CG2 3.47Å; Y312-V316 HydrophobicContact CE2-CG2 4.32Å; Y312-V316 WeakPolarHBondContact O-CG2 3.29Å; Y312-V316 PolarHBondContact O-N 3.32Å; W313-V316 HydrophobicContact CE3-CB 4.4Å; W313-V316 HydrophobicContact CE3-CG1 4.49Å; W313-V316 HydrophobicContact CE3-CG2 4.21Å; W313-V316 HydrophobicContact CZ3-CG2 4.47Å; W313-V316 PolarHBondContact O-N 2.98Å; V316-M320 PolarHBondContact O-N 2.93Å; V316-M320 VanDerWaalsContact O-N 3.14Å
317	Y	95.8	Very high	92.4	Very high	90 Å²	90	46 Å²	46	35%	0.353	27%	0.265	S	S	.	.	H	α-helix	trans	-61.1	-53	174.4	167.8	-105.1	0	0	0	112.3	W313 E314 L319 M320 V321 Y328 D330 V331	W313-Y317 WeakPolarHBondContact O-CB 3.39Å; W313-Y317 PolarHBondContact O-N 3.11Å; E314-Y317 PolarHBondContact O-N 3.18Å; Y317-L319 VanDerWaalsContact C-N 3.29Å; Y317-L319 PolarHBondContact O-N 2.83Å; Y317-M320 PolarHBondContact O-N 3.41Å; Y317-V321 HydrophobicContact CD2-CG2 3.9Å; Y317-V321 HydrophobicContact CE1-CG2 4.27Å; Y317-V321 HydrophobicContact CE2-CG2 3.53Å; Y317-V321 HydrophobicContact CG-CG2 4.42Å; Y317-V321 WeakPolarHBondContact O-CG2 3.47Å; Y317-V321 PolarHBondContact O-N 2.54Å; Y317-Y328 WeakPolarHBondContact OH-CD2 3.45Å; Y317-D330 VanDerWaalsContact CE1-OD2 3.29Å; Y317-D330 WeakPolarHBondContact CE1-OD2 3.4Å; Y317-D330 PolarHBondContact OH-OD2 3.39Å; Y317-V331 HydrophobicContact CD1-CG2 4.24Å; Y317-V331 HydrophobicContact CE1-CG2 4.18Å
318	L	94.9	Very high	92.8	Very high	9 Å²	9	50.8 Å²	50.8	5%	0.047	28%	0.275	C	S	.	.	H	α-helix	trans	-49.4	-48.7	177.1	169	62.2	0	0	0	111.7	E314 C315 T322 V331 M342	E314-L318 VanDerWaalsContact O-CB 3.3Å; E314-L318 WeakPolarHBondContact O-CB 3.13Å; E314-L318 PolarHBondContact O-N 2.73Å; C315-L318 PolarHBondContact O-N 2.76Å; L318-T322 VanDerWaalsContact O-CB 3.29Å; L318-T322 WeakPolarHBondContact O-CB 3.34Å; L318-T322 PolarHBondContact O-N 2.72Å; L318-T322 PolarHBondContact O-OG1 3.3Å; L318-V331 HydrophobicContact CB-CG1 4.14Å; L318-V331 WeakPolarHBondContact CD1-O 3.28Å; L318-V331 HydrophobicContact CD2-CG1 4.34Å; L318-M342 HydrophobicContact CD1-CE 4.01Å; L318-M342 HydrophobicContact CD2-CE 4.34Å; L318-M342 HydrophobicContact CG-CE 4.05Å
319	L	94.7	Very high	93	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-70.8	-32.5	-179.1	-64	-160.8	0	0	0	113	A287 A288 I291 C315 Y317 T322 M323 M342 F345	A287-L319 HydrophobicContact CB-CD1 3.47Å; A287-L319 VanDerWaalsContact CB-CD1 3.47Å; A288-L319 HydrophobicContact CB-CD1 4.15Å; A288-L319 VanDerWaalsContact N-CD1 3.25Å; I291-L319 HydrophobicContact CG2-CD1 4.22Å; I291-L319 HydrophobicContact CG2-CD2 4.24Å; I291-L319 HydrophobicContact CG2-CG 4.25Å; C315-L319 WeakPolarHBondContact O-CG 3.42Å; C315-L319 PolarHBondContact O-N 3.21Å; C315-L319 VanDerWaalsContact O-N 3.09Å; Y317-L319 VanDerWaalsContact C-N 3.29Å; Y317-L319 PolarHBondContact O-N 2.83Å; L319-T322 PolarHBondContact O-N 2.92Å; L319-M323 WeakPolarHBondContact O-CB 3.36Å; L319-M323 WeakPolarHBondContact O-CG 3.47Å; L319-M323 PolarHBondContact O-N 3.39Å; L319-M342 HydrophobicContact CD2-CE 3.94Å; L319-M342 HydrophobicContact CD2-SD 3.44Å; L319-M342 WeakPolarHBondContact CD2-SD 3.4Å; L319-F345 HydrophobicContact CB-CE1 3.77Å; L319-F345 HydrophobicContact CB-CZ 3.88Å; L319-F345 HydrophobicContact CD1-CE1 4.01Å; L319-F345 HydrophobicContact CD1-CE2 4.07Å; L319-F345 HydrophobicContact CD1-CZ 3.77Å; L319-F345 HydrophobicContact CD2-CD1 3.83Å; L319-F345 HydrophobicContact CD2-CE1 3.69Å; L319-F345 HydrophobicContact CD2-CZ 4.31Å; L319-F345 HydrophobicContact CG-CE1 4.02Å; L319-F345 HydrophobicContact CG-CZ 4.2Å
320	M	93.1	Very high	93.3	Very high	68 Å²	68	51 Å²	51	34%	0.335	28%	0.279	S	S	.	.	H	α-helix	trans	-67	-49.3	174.6	-174	61.7	-172.7	0	0	111.1	W284 V316 Y317 T322 M323 S324 F353	W284-M320 HydrophobicContact CZ2-CB 3.83Å; W284-M320 HydrophobicContact CZ2-CG 4.25Å; W284-M320 HydrophobicContact CZ2-SD 4.38Å; V316-M320 PolarHBondContact O-N 2.93Å; V316-M320 VanDerWaalsContact O-N 3.14Å; Y317-M320 PolarHBondContact O-N 3.41Å; M320-T322 PolarHBondContact O-N 2.85Å; M320-M323 PolarHBondContact O-N 2.94Å; M320-M323 HydrophobicContact SD-CE 4.31Å; M320-S324 PolarHBondContact O-N 2.92Å; M320-S324 PolarHBondContact O-OG 3.44Å; M320-F353 HydrophobicContact CE-CE2 4.17Å
321	V	94.2	Very high	93.4	Very high	14 Å²	14	51.6 Å²	51.6	9%	0.085	28%	0.283	C	S	.	.	H	α-helix	trans	-58.6	-32.1	175.5	170	0	0	0	0	112	Y317 S324 V326 G327 Y328	Y317-V321 HydrophobicContact CD2-CG2 3.9Å; Y317-V321 HydrophobicContact CE1-CG2 4.27Å; Y317-V321 HydrophobicContact CE2-CG2 3.53Å; Y317-V321 HydrophobicContact CG-CG2 4.42Å; Y317-V321 WeakPolarHBondContact O-CG2 3.47Å; Y317-V321 PolarHBondContact O-N 2.54Å; V321-S324 PolarHBondContact O-OG 3.38Å; V321-V326 HydrophobicContact CG1-CB 4.26Å; V321-V326 PolarHBondContact O-N 2.86Å; V321-G327 PolarHBondContact O-N 3.04Å; V321-Y328 HydrophobicContact CG1-CD2 3.78Å; V321-Y328 HydrophobicContact CG1-CE2 4.45Å; V321-Y328 HydrophobicContact CG1-CG 4.4Å; V321-Y328 HydrophobicContact CG2-CD2 4.04Å; V321-Y328 HydrophobicContact CG2-CE2 4.23Å
322	T	93.3	Very high	93.4	Very high	25 Å²	25	54.8 Å²	54.8	15%	0.153	29%	0.289	C	S	.	.	H	α-helix	trans	-76.4	-48	176	-58.2	0	0	0	0	112.4	L318 L319 M320 S324 T325 M342 F345 I346	L318-T322 VanDerWaalsContact O-CB 3.29Å; L318-T322 WeakPolarHBondContact O-CB 3.34Å; L318-T322 PolarHBondContact O-N 2.72Å; L318-T322 PolarHBondContact O-OG1 3.3Å; L319-T322 PolarHBondContact O-N 2.92Å; M320-T322 PolarHBondContact O-N 2.85Å; T322-S324 VanDerWaalsContact C-N 3.32Å; T322-S324 PolarHBondContact O-N 2.92Å; T322-T325 PolarHBondContact O-N 3.13Å; T322-M342 HydrophobicContact CG2-CE 3.81Å; T322-M342 WeakPolarHBondContact OG1-CE 3.45Å; T322-F345 HydrophobicContact CG2-CD1 4.49Å; T322-I346 HydrophobicContact CG2-CD1 4.13Å; T322-I346 HydrophobicContact CG2-CG1 3.47Å; T322-I346 VanDerWaalsContact CG2-CG1 3.47Å
323	M	91.3	Very high	93.3	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.025	29%	0.292	C	S	.	.	H	α-helix	trans	-63	-36.6	179	-75.9	-172.6	-64	0	0	112.7	F280 W284 L319 M320 T325 F345 F353	F280-M323 HydrophobicContact CZ-CE 4.34Å; W284-M323 HydrophobicContact CB-CE 4.04Å; W284-M323 VanDerWaalsContact CD1-CE 3.45Å; W284-M323 HydrophobicContact CD2-CE 4.39Å; W284-M323 HydrophobicContact CG-CE 3.7Å; L319-M323 WeakPolarHBondContact O-CB 3.36Å; L319-M323 WeakPolarHBondContact O-CG 3.47Å; L319-M323 PolarHBondContact O-N 3.39Å; M320-M323 PolarHBondContact O-N 2.94Å; M320-M323 HydrophobicContact SD-CE 4.31Å; M323-T325 PolarHBondContact O-N 3.26Å; M323-F345 HydrophobicContact CE-CZ 4.28Å; M323-F345 HydrophobicContact CG-CE1 3.59Å; M323-F345 HydrophobicContact CG-CZ 3.54Å; M323-F345 HydrophobicContact SD-CE1 4.28Å; M323-F345 HydrophobicContact SD-CE2 4.42Å; M323-F345 HydrophobicContact SD-CZ 3.6Å; M323-F345 VanDerWaalsContact SD-CZ 3.6Å; M323-F353 HydrophobicContact CB-CB 4.45Å; M323-F353 HydrophobicContact CB-CD2 4.14Å
324	S	91	Very high	93.1	Very high	30 Å²	30	53.3 Å²	53.3	21%	0.21	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	5.6	175.3	66.3	0	0	0	0	113.6	M320 V321 T322 V326	M320-S324 PolarHBondContact O-N 2.92Å; M320-S324 PolarHBondContact O-OG 3.44Å; V321-S324 PolarHBondContact O-OG 3.38Å; T322-S324 VanDerWaalsContact C-N 3.32Å; T322-S324 PolarHBondContact O-N 2.92Å; S324-V326 PolarHBondContact O-N 3.17Å; S324-V326 VanDerWaalsContact O-N 3.17Å; S324-V326 WeakPolarHBondContact OG-CG2 3.33Å
325	T	92.5	Very high	93	Very high	105 Å²	105	49.5 Å²	49.5	64%	0.644	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.9	23.4	-179.7	61.2	0	0	0	0	115.9	T322 M323 L350	T322-T325 PolarHBondContact O-N 3.13Å; M323-T325 PolarHBondContact O-N 3.26Å; T325-L350 HydrophobicContact CG2-CD1 3.72Å
326	V	94.4	Very high	92.8	Very high	73 Å²	73	53.1 Å²	53.1	44%	0.442	29%	0.292	S	S	.	.			trans	-81.2	-42.2	-178.1	174.9	0	0	0	0	111.5	V321 S324 Y328	V321-V326 HydrophobicContact CG1-CB 4.26Å; V321-V326 PolarHBondContact O-N 2.86Å; S324-V326 PolarHBondContact O-N 3.17Å; S324-V326 VanDerWaalsContact O-N 3.17Å; S324-V326 WeakPolarHBondContact OG-CG2 3.33Å; V326-Y328 HydrophobicContact CG1-CD1 3.97Å; V326-Y328 HydrophobicContact CG1-CD2 4.01Å; V326-Y328 HydrophobicContact CG1-CE1 3.57Å; V326-Y328 HydrophobicContact CG1-CE2 3.62Å; V326-Y328 HydrophobicContact CG1-CG 4.17Å; V326-Y328 PolarHBondContact O-N 3.48Å
327	G	91.1	Very high	92.6	Very high	53 Å²	53	55.5 Å²	55.5	55%	0.546	30%	0.304	S	S	.	.			trans	57.1	44.4	164.7	0	0	0	0	0	117.3	V321 G329	V321-G327 PolarHBondContact O-N 3.04Å; G327-G329 PolarHBondContact O-N 2.89Å; G327-G329 VanDerWaalsContact O-N 3.1Å
328	Y	92.7	Very high	92.4	Very high	162 Å²	162	51.2 Å²	51.2	64%	0.635	29%	0.287	S	S	*	.			trans	-52.8	-32.4	-176.3	-66.1	-59.3	0	0	0	115.6	Y317 V321 V326 D330	Y317-Y328 WeakPolarHBondContact OH-CD2 3.45Å; V321-Y328 HydrophobicContact CG1-CD2 3.78Å; V321-Y328 HydrophobicContact CG1-CE2 4.45Å; V321-Y328 HydrophobicContact CG1-CG 4.4Å; V321-Y328 HydrophobicContact CG2-CD2 4.04Å; V321-Y328 HydrophobicContact CG2-CE2 4.23Å; V326-Y328 HydrophobicContact CG1-CD1 3.97Å; V326-Y328 HydrophobicContact CG1-CD2 4.01Å; V326-Y328 HydrophobicContact CG1-CE1 3.57Å; V326-Y328 HydrophobicContact CG1-CE2 3.62Å; V326-Y328 HydrophobicContact CG1-CG 4.17Å; V326-Y328 PolarHBondContact O-N 3.48Å; Y328-D330 VanDerWaalsContact C-N 3.28Å; Y328-D330 WeakPolarHBondContact CB-OD1 3.18Å; Y328-D330 PolarHBondContact O-N 3.25Å
329	G	90.4	Very high	92.4	Very high	48 Å²	48	57.3 Å²	57.3	50%	0.495	31%	0.31	S	S	.	.	S	Bend	trans	77.9	8.5	179.4	0	0	0	0	0	115	G327 Y332	G327-G329 PolarHBondContact O-N 2.89Å; G327-G329 VanDerWaalsContact O-N 3.1Å; G329-Y332 WeakPolarHBondContact O-CD1 3.41Å
330	D	92.3	Very high	92.4	Very high	93 Å²	93	62 Å²	62	50%	0.497	33%	0.334	S	S	.	.	S	Bend	trans	-67.2	-45.6	170.6	55.1	-15.6	0	0	0	112	Y317 Y328	Y317-D330 VanDerWaalsContact CE1-OD2 3.29Å; Y317-D330 WeakPolarHBondContact CE1-OD2 3.4Å; Y317-D330 PolarHBondContact OH-OD2 3.39Å; Y328-D330 VanDerWaalsContact C-N 3.28Å; Y328-D330 WeakPolarHBondContact CB-OD1 3.18Å; Y328-D330 PolarHBondContact O-N 3.25Å
331	V	92.6	Very high	92.5	Very high	25 Å²	25	60.8 Å²	60.8	15%	0.152	33%	0.327	C	S	.	.	S	Bend	trans	-114.2	135.8	169.5	-175.9	0	0	0	0	108.2	L310 Y317 L318	L310-V331 HydrophobicContact CD1-CG1 4.28Å; L310-V331 HydrophobicContact CD2-CG1 4Å; Y317-V331 HydrophobicContact CD1-CG2 4.24Å; Y317-V331 HydrophobicContact CE1-CG2 4.18Å; L318-V331 HydrophobicContact CB-CG1 4.14Å; L318-V331 WeakPolarHBondContact CD1-O 3.28Å; L318-V331 HydrophobicContact CD2-CG1 4.34Å
332	Y	92.7	Very high	92.4	Very high	117 Å²	117	61 Å²	61	46%	0.459	33%	0.328	S	S	.	.			trans	-156.8	159.2	176.7	61	-87	0	0	0	111.7	Q308 G329 K334	Q308-Y332 PolarHBondContact NE2-O 3.43Å; G329-Y332 WeakPolarHBondContact O-CD1 3.41Å; Y332-K334 HydrophobicContact CD2-CG 4.22Å; Y332-K334 HydrophobicContact CE2-CD 4.5Å; Y332-K334 HydrophobicContact CE2-CG 3.74Å
333	A	93.1	Very high	92.5	Very high	9 Å²	9	64 Å²	64	7%	0.074	35%	0.345	C	S	.	.			trans	-74.1	122.7	176.5	0	0	0	0	0	111.6	I291 E295 R339 M342	I291-A333 HydrophobicContact CD1-CB 4.26Å; E295-A333 WeakPolarHBondContact OE1-CB 3.5Å; E295-A333 WeakPolarHBondContact OE2-CA 3.08Å; A333-R339 HydrophobicContact CB-CG 4.21Å; A333-R339 WeakPolarHBondContact O-CG 3.01Å; A333-R339 PolarHBondContact O-NE 3.02Å; A333-M342 HydrophobicContact CB-CG 4.05Å
334	K	90.1	Very high	92.6	Very high	100 Å²	100	70.2 Å²	70.2	44%	0.435	37%	0.373	S	S	.	.			trans	-93.4	-35.1	174	-73.7	-173.6	-164.8	132.6	0	112.2	E295 Y332 R339	E295-K334 PolarHBondContact OE1-N 3.44Å; E295-K334 PolarHBondContact OE2-N 3.39Å; Y332-K334 HydrophobicContact CD2-CG 4.22Å; Y332-K334 HydrophobicContact CE2-CD 4.5Å; Y332-K334 HydrophobicContact CE2-CG 3.74Å; K334-R339 PolarHBondContact O-NE 3.47Å
335	T	92.5	Very high	92.7	Very high	0 Å²	0	69.6 Å²	69.6	0%	0	37%	0.366	C	S	.	.	S	Bend	trans	-67.2	152.9	-180	72.8	0	0	0	0	111.4	V294 E295 G338 R339	V294-T335 WeakPolarHBondContact CG1-OG1 3.42Å; E295-T335 WeakPolarHBondContact OE1-CB 3.23Å; E295-T335 PolarHBondContact OE1-N 2.91Å; E295-T335 VanDerWaalsContact OE1-N 3.08Å; E295-T335 PolarHBondContact OE1-OG1 2.87Å; E295-T335 PolarHBondContact OE2-N 3.29Å; T335-G338 PolarHBondContact O-N 3.04Å; T335-G338 WeakPolarHBondContact OG1-CA 3.32Å; T335-G338 PolarHBondContact OG1-N 3.1Å; T335-R339 WeakPolarHBondContact O-CB 3.5Å; T335-R339 VanDerWaalsContact O-CG 3.26Å; T335-R339 WeakPolarHBondContact O-CG 3.42Å; T335-R339 PolarHBondContact O-N 3.29Å
336	T	91	Very high	92.8	Very high	76 Å²	76	68.6 Å²	68.6	47%	0.466	36%	0.356	S	S	.	.	H	α-helix	trans	-73.1	-40.2	-179.8	-48.2	0	0	0	0	110.5	D299 W301 G338 R339 L340	D299-T336 PolarHBondContact OD1-N 3.26Å; D299-T336 VanDerWaalsContact OD2-CB 3.29Å; D299-T336 WeakPolarHBondContact OD2-CB 3.44Å; D299-T336 PolarHBondContact OD2-N 2.96Å; D299-T336 PolarHBondContact OD2-OG1 3.42Å; W301-T336 HydrophobicContact CH2-CG2 3.98Å; W301-T336 HydrophobicContact CZ3-CG2 3.98Å; T336-G338 VanDerWaalsContact C-N 3.34Å; T336-R339 PolarHBondContact O-N 3.04Å; T336-L340 WeakPolarHBondContact O-CB 3.27Å; T336-L340 PolarHBondContact O-N 3.29Å
337	L	90.5	Very high	92.6	Very high	64 Å²	64	71 Å²	71	34%	0.335	37%	0.366	S	S	.	.	H	α-helix	trans	-61.4	-41.7	170.9	-72.6	173.1	0	0	0	111.8	V294 D299 W301 L340 F341	V294-L337 HydrophobicContact CG1-CB 3.59Å; D299-L337 WeakPolarHBondContact OD1-CB 3.28Å; D299-L337 VanDerWaalsContact OD1-CG 3.31Å; D299-L337 WeakPolarHBondContact OD1-CG 3.23Å; D299-L337 PolarHBondContact OD1-N 2.94Å; W301-L337 HydrophobicContact CH2-CD2 4.31Å; W301-L337 HydrophobicContact CH2-CG 3.92Å; W301-L337 HydrophobicContact CZ2-CD1 4.32Å; W301-L337 HydrophobicContact CZ2-CD2 3.99Å; W301-L337 HydrophobicContact CZ2-CG 3.89Å; L337-L340 PolarHBondContact O-N 2.93Å; L337-F341 PolarHBondContact O-N 3.19Å
338	G	92.9	Very high	92.6	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-64.8	-45.4	177.7	0	0	0	0	0	112.1	T335 T336 L340 F341 M342	T335-G338 PolarHBondContact O-N 3.04Å; T335-G338 WeakPolarHBondContact OG1-CA 3.32Å; T335-G338 PolarHBondContact OG1-N 3.1Å; T336-G338 VanDerWaalsContact C-N 3.34Å; G338-L340 PolarHBondContact O-N 3.48Å; G338-F341 WeakPolarHBondContact O-CB 3.47Å; G338-F341 PolarHBondContact O-N 3.48Å; G338-M342 VanDerWaalsContact O-CG 3.28Å; G338-M342 WeakPolarHBondContact O-CG 3.33Å; G338-M342 PolarHBondContact O-N 3.5Å
339	R	93.4	Very high	92.4	Very high	136 Å²	136	62.6 Å²	62.6	51%	0.513	33%	0.328	S	S	.	.	H	α-helix	trans	-60.7	-42.3	173.5	-73.1	168.7	179.8	-177.7	1.3	112.8	A333 K334 T335 T336 F341 M342 V343	A333-R339 HydrophobicContact CB-CG 4.21Å; A333-R339 WeakPolarHBondContact O-CG 3.01Å; A333-R339 PolarHBondContact O-NE 3.02Å; K334-R339 PolarHBondContact O-NE 3.47Å; T335-R339 WeakPolarHBondContact O-CB 3.5Å; T335-R339 VanDerWaalsContact O-CG 3.26Å; T335-R339 WeakPolarHBondContact O-CG 3.42Å; T335-R339 PolarHBondContact O-N 3.29Å; T336-R339 PolarHBondContact O-N 3.04Å; R339-F341 VanDerWaalsContact C-N 3.34Å; R339-F341 PolarHBondContact O-N 3.28Å; R339-M342 PolarHBondContact O-N 3.48Å; R339-V343 PolarHBondContact O-N 3Å; R339-V343 VanDerWaalsContact O-N 3.09Å
340	L	94.4	Very high	92.4	Very high	99 Å²	99	64.1 Å²	64.1	52%	0.518	33%	0.325	S	S	.	.	H	α-helix	trans	-61.5	-43.4	175.6	-178.9	62.3	0	0	0	111.3	T336 L337 G338 V343 F344	T336-L340 WeakPolarHBondContact O-CB 3.27Å; T336-L340 PolarHBondContact O-N 3.29Å; L337-L340 PolarHBondContact O-N 2.93Å; G338-L340 PolarHBondContact O-N 3.48Å; L340-V343 PolarHBondContact O-N 3.03Å; L340-F344 HydrophobicContact CD1-CD2 4.41Å; L340-F344 HydrophobicContact CD1-CE2 3.77Å; L340-F344 HydrophobicContact CG-CD2 4.44Å; L340-F344 HydrophobicContact CG-CE2 4.04Å; L340-F344 VanDerWaalsContact O-CD2 3.25Å; L340-F344 WeakPolarHBondContact O-CD2 3.43Å; L340-F344 PolarHBondContact O-N 3.06Å
341	F	95.1	Very high	92.3	Very high	42 Å²	42	62.7 Å²	62.7	18%	0.184	33%	0.326	C	S	.	.	H	α-helix	trans	-61	-45.4	173.2	176.6	-102.1	0	0	0	112.1	A287 F290 I291 L337 G338 R339 V343 F344 F345	A287-F341 HydrophobicContact CB-CE1 4.41Å; A287-F341 HydrophobicContact CB-CZ 3.89Å; F290-F341 HydrophobicContact CB-CE2 4.45Å; F290-F341 HydrophobicContact CB-CZ 4.3Å; F290-F341 HydrophobicContact CD1-CB 4.3Å; F290-F341 AromaticContact CD1-CD1 3.98Å; F290-F341 HydrophobicContact CD1-CD1 3.98Å; F290-F341 AromaticContact CD1-CD2 3.36Å; F290-F341 HydrophobicContact CD1-CD2 3.36Å; F290-F341 HydrophobicContact CD1-CE1 4.11Å; F290-F341 AromaticContact CD1-CE2 3.52Å; F290-F341 HydrophobicContact CD1-CE2 3.52Å; F290-F341 AromaticContact CD1-CG 3.6Å; F290-F341 HydrophobicContact CD1-CG 3.6Å; F290-F341 AromaticContact CD1-CZ 3.9Å; F290-F341 HydrophobicContact CD1-CZ 3.9Å; F290-F341 HydrophobicContact CE1-CB 3.91Å; F290-F341 HydrophobicContact CE1-CD1 4.45Å; F290-F341 AromaticContact CE1-CD2 3.42Å; F290-F341 HydrophobicContact CE1-CD2 3.42Å; F290-F341 VanDerWaalsContact CE1-CD2 3.42Å; F290-F341 HydrophobicContact CE1-CE2 4.02Å; F290-F341 AromaticContact CE1-CG 3.67Å; F290-F341 HydrophobicContact CE1-CG 3.67Å; F290-F341 HydrophobicContact CG-CD2 4.32Å; F290-F341 HydrophobicContact CG-CE2 4.09Å; F290-F341 HydrophobicContact CG-CZ 4.38Å; F290-F341 HydrophobicContact CZ-CD2 4.4Å; I291-F341 HydrophobicContact CB-CD1 4.16Å; I291-F341 HydrophobicContact CB-CE1 4.2Å; I291-F341 HydrophobicContact CD1-CD1 4.3Å; L337-F341 PolarHBondContact O-N 3.19Å; G338-F341 WeakPolarHBondContact O-CB 3.47Å; G338-F341 PolarHBondContact O-N 3.48Å; R339-F341 VanDerWaalsContact C-N 3.34Å; R339-F341 PolarHBondContact O-N 3.28Å; F341-V343 VanDerWaalsContact C-N 3.28Å; F341-V343 PolarHBondContact O-N 2.92Å; F341-F344 PolarHBondContact O-N 3.36Å; F341-F344 VanDerWaalsContact O-N 3.16Å; F341-F345 HydrophobicContact CD1-CB 4.4Å; F341-F345 HydrophobicContact CE1-CB 4.08Å; F341-F345 HydrophobicContact CE1-CD2 4.38Å; F341-F345 HydrophobicContact CE1-CG 4.27Å; F341-F345 HydrophobicContact CZ-CB 4.28Å; F341-F345 HydrophobicContact CZ-CD2 4.18Å; F341-F345 HydrophobicContact CZ-CG 4.46Å; F341-F345 WeakPolarHBondContact O-CB 3.4Å; F341-F345 PolarHBondContact O-N 2.86Å
342	M	93.7	Very high	92.1	Very high	20 Å²	20	63.5 Å²	63.5	10%	0.099	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-36	178.9	-69.8	-63.3	-77.1	0	0	112.5	L318 L319 T322 A333 G338 R339 F345 I346	L318-M342 HydrophobicContact CD1-CE 4.01Å; L318-M342 HydrophobicContact CD2-CE 4.34Å; L318-M342 HydrophobicContact CG-CE 4.05Å; L319-M342 HydrophobicContact CD2-CE 3.94Å; L319-M342 HydrophobicContact CD2-SD 3.44Å; L319-M342 WeakPolarHBondContact CD2-SD 3.4Å; T322-M342 HydrophobicContact CG2-CE 3.81Å; T322-M342 WeakPolarHBondContact OG1-CE 3.45Å; A333-M342 HydrophobicContact CB-CG 4.05Å; G338-M342 VanDerWaalsContact O-CG 3.28Å; G338-M342 WeakPolarHBondContact O-CG 3.33Å; G338-M342 PolarHBondContact O-N 3.5Å; R339-M342 PolarHBondContact O-N 3.48Å; M342-F345 PolarHBondContact O-N 3.44Å; M342-I346 WeakPolarHBondContact O-CB 3.45Å; M342-I346 WeakPolarHBondContact O-CD1 3.43Å; M342-I346 WeakPolarHBondContact O-CG1 3.47Å; M342-I346 PolarHBondContact O-N 2.72Å
343	V	94.3	Very high	92	Very high	86 Å²	86	60.4 Å²	60.4	52%	0.521	32%	0.317	S	S	.	.	H	α-helix	trans	-62	-47.5	174.4	172.2	0	0	0	0	111.8	R339 L340 F341 L347	R339-V343 PolarHBondContact O-N 3Å; R339-V343 VanDerWaalsContact O-N 3.09Å; L340-V343 PolarHBondContact O-N 3.03Å; F341-V343 VanDerWaalsContact C-N 3.28Å; F341-V343 PolarHBondContact O-N 2.92Å; V343-L347 PolarHBondContact O-N 2.88Å
344	F	93.3	Very high	91.8	Very high	137 Å²	137	63.1 Å²	63.1	60%	0.601	34%	0.34	S	S	*	.	H	α-helix	trans	-67.1	-38	175.9	-69.9	-66.7	0	0	0	112.3	L340 F341 L347 G348	L340-F344 HydrophobicContact CD1-CD2 4.41Å; L340-F344 HydrophobicContact CD1-CE2 3.77Å; L340-F344 HydrophobicContact CG-CD2 4.44Å; L340-F344 HydrophobicContact CG-CE2 4.04Å; L340-F344 VanDerWaalsContact O-CD2 3.25Å; L340-F344 WeakPolarHBondContact O-CD2 3.43Å; L340-F344 PolarHBondContact O-N 3.06Å; F341-F344 PolarHBondContact O-N 3.36Å; F341-F344 VanDerWaalsContact O-N 3.16Å; F344-L347 PolarHBondContact O-N 2.76Å; F344-G348 PolarHBondContact O-N 3.48Å; F344-G348 VanDerWaalsContact O-N 3.09Å
345	F	94.1	Very high	91.8	Very high	16 Å²	16	61.1 Å²	61.1	7%	0.07	34%	0.338	C	S	.	.	H	α-helix	trans	-69.2	-34.8	179.6	-177.6	-99.1	0	0	0	112.7	A287 L319 T322 M323 F341 M342 G349	A287-F345 HydrophobicContact CB-CD2 3.8Å; A287-F345 HydrophobicContact CB-CE2 3.43Å; A287-F345 VanDerWaalsContact CB-CE2 3.43Å; A287-F345 HydrophobicContact CB-CZ 4.25Å; L319-F345 HydrophobicContact CB-CE1 3.77Å; L319-F345 HydrophobicContact CB-CZ 3.88Å; L319-F345 HydrophobicContact CD1-CE1 4.01Å; L319-F345 HydrophobicContact CD1-CE2 4.07Å; L319-F345 HydrophobicContact CD1-CZ 3.77Å; L319-F345 HydrophobicContact CD2-CD1 3.83Å; L319-F345 HydrophobicContact CD2-CE1 3.69Å; L319-F345 HydrophobicContact CD2-CZ 4.31Å; L319-F345 HydrophobicContact CG-CE1 4.02Å; L319-F345 HydrophobicContact CG-CZ 4.2Å; T322-F345 HydrophobicContact CG2-CD1 4.49Å; M323-F345 HydrophobicContact CE-CZ 4.28Å; M323-F345 HydrophobicContact CG-CE1 3.59Å; M323-F345 HydrophobicContact CG-CZ 3.54Å; M323-F345 HydrophobicContact SD-CE1 4.28Å; M323-F345 HydrophobicContact SD-CE2 4.42Å; M323-F345 HydrophobicContact SD-CZ 3.6Å; M323-F345 VanDerWaalsContact SD-CZ 3.6Å; F341-F345 HydrophobicContact CD1-CB 4.4Å; F341-F345 HydrophobicContact CE1-CB 4.08Å; F341-F345 HydrophobicContact CE1-CD2 4.38Å; F341-F345 HydrophobicContact CE1-CG 4.27Å; F341-F345 HydrophobicContact CZ-CB 4.28Å; F341-F345 HydrophobicContact CZ-CD2 4.18Å; F341-F345 HydrophobicContact CZ-CG 4.46Å; F341-F345 WeakPolarHBondContact O-CB 3.4Å; F341-F345 PolarHBondContact O-N 2.86Å; M342-F345 PolarHBondContact O-N 3.44Å; F345-G349 VanDerWaalsContact O-CA 3.24Å; F345-G349 WeakPolarHBondContact O-CA 3.49Å; F345-G349 PolarHBondContact O-N 2.62Å
346	I	93.6	Very high	91.7	Very high	84 Å²	84	63.9 Å²	63.9	43%	0.431	35%	0.349	S	S	.	.	H	α-helix	trans	-61.8	-46.9	172.3	-74.1	161.3	0	0	0	110.2	T322 M342 L350	T322-I346 HydrophobicContact CG2-CD1 4.13Å; T322-I346 HydrophobicContact CG2-CG1 3.47Å; T322-I346 VanDerWaalsContact CG2-CG1 3.47Å; M342-I346 WeakPolarHBondContact O-CB 3.45Å; M342-I346 WeakPolarHBondContact O-CD1 3.43Å; M342-I346 WeakPolarHBondContact O-CG1 3.47Å; M342-I346 PolarHBondContact O-N 2.72Å; I346-L350 WeakPolarHBondContact O-CB 3.31Å; I346-L350 PolarHBondContact O-N 3.05Å
347	L	91.1	Very high	91.6	Very high	125 Å²	125	62.2 Å²	62.2	65%	0.654	34%	0.339	S	S	*	.	H	α-helix	trans	-62.5	-45.7	-179.6	-68.3	171.4	0	0	0	112.7	V343 F344	V343-L347 PolarHBondContact O-N 2.88Å; F344-L347 PolarHBondContact O-N 2.76Å
348	G	90.6	Very high	91.6	Very high	36 Å²	36	62.6 Å²	62.6	37%	0.371	35%	0.345	S	S	.	.	H	α-helix	trans	-77.2	-42.2	178.5	0	0	0	0	0	113.8	F344 A351 M352	F344-G348 PolarHBondContact O-N 3.48Å; F344-G348 VanDerWaalsContact O-N 3.09Å; G348-A351 PolarHBondContact O-N 3.23Å; G348-M352 WeakPolarHBondContact O-CG 3.3Å; G348-M352 PolarHBondContact O-N 3.19Å
349	G	88.9	Confident	91.5	Very high	1 Å²	1	65.4 Å²	65.4	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-66.1	-41.5	-177.4	0	0	0	0	0	112.9	F345 A351 M352 F353	F345-G349 VanDerWaalsContact O-CA 3.24Å; F345-G349 WeakPolarHBondContact O-CA 3.49Å; F345-G349 PolarHBondContact O-N 2.62Å; G349-A351 VanDerWaalsContact C-N 3.35Å; G349-A351 PolarHBondContact O-N 2.94Å; G349-M352 PolarHBondContact O-N 2.77Å; G349-F353 VanDerWaalsContact O-CB 3.3Å; G349-F353 WeakPolarHBondContact O-CB 3.48Å; G349-F353 PolarHBondContact O-N 3.01Å
350	L	89.8	Confident	91.3	Very high	81 Å²	81	60.3 Å²	60.3	42%	0.424	34%	0.341	S	S	.	.	H	α-helix	trans	-61.4	-43.4	174.1	179.8	58.3	0	0	0	111.5	T325 I346 F353 A354	T325-L350 HydrophobicContact CG2-CD1 3.72Å; I346-L350 WeakPolarHBondContact O-CB 3.31Å; I346-L350 PolarHBondContact O-N 3.05Å; L350-F353 PolarHBondContact O-N 3.23Å; L350-A354 VanDerWaalsContact O-CB 3.23Å; L350-A354 WeakPolarHBondContact O-CB 3.41Å; L350-A354 PolarHBondContact O-N 2.73Å
351	A	89.7	Confident	91	Very high	63 Å²	63	60.7 Å²	60.7	52%	0.521	34%	0.342	S	S	.	.	H	α-helix	trans	-65.3	-38.8	178.2	0	0	0	0	0	112.6	G348 G349 S355	G348-A351 PolarHBondContact O-N 3.23Å; G349-A351 VanDerWaalsContact C-N 3.35Å; G349-A351 PolarHBondContact O-N 2.94Å; A351-S355 WeakPolarHBondContact O-CB 3.45Å; A351-S355 PolarHBondContact O-N 3.15Å; A351-S355 PolarHBondContact O-OG 3.27Å
352	M	89.5	Confident	90.5	Very high	42 Å²	42	64.7 Å²	64.7	21%	0.207	36%	0.362	C	S	.	.	H	α-helix	trans	-68.5	-45.4	173.3	-70.5	-173.4	-60.6	0	0	112.2	T283 G348 G349 S355 Y356	T283-M352 HydrophobicContact CG2-CE 3.82Å; T283-M352 HydrophobicContact CG2-SD 4.07Å; G348-M352 WeakPolarHBondContact O-CG 3.3Å; G348-M352 PolarHBondContact O-N 3.19Å; G349-M352 PolarHBondContact O-N 2.77Å; M352-S355 PolarHBondContact O-N 3.04Å; M352-S355 PolarHBondContact O-OG 3.06Å; M352-Y356 WeakPolarHBondContact O-CB 3.21Å; M352-Y356 PolarHBondContact O-N 3.15Å
353	F	89.9	Confident	90.1	Very high	51 Å²	51	65.1 Å²	65.1	22%	0.224	36%	0.364	C	S	.	.	H	α-helix	trans	-63.5	-47.9	-178.5	-170.2	-88.9	0	0	0	111.4	F280 M320 M323 G349 L350 S355 V357	F280-F353 HydrophobicContact CE2-CD2 4.27Å; F280-F353 HydrophobicContact CZ-CD2 4.28Å; M320-F353 HydrophobicContact CE-CE2 4.17Å; M323-F353 HydrophobicContact CB-CB 4.45Å; M323-F353 HydrophobicContact CB-CD2 4.14Å; G349-F353 VanDerWaalsContact O-CB 3.3Å; G349-F353 WeakPolarHBondContact O-CB 3.48Å; G349-F353 PolarHBondContact O-N 3.01Å; L350-F353 PolarHBondContact O-N 3.23Å; F353-S355 PolarHBondContact O-N 3.38Å; F353-V357 HydrophobicContact CD1-CG2 4.44Å; F353-V357 HydrophobicContact CD2-CG2 3.83Å; F353-V357 HydrophobicContact CE1-CG2 4.49Å; F353-V357 HydrophobicContact CE2-CG2 3.89Å; F353-V357 HydrophobicContact CG-CG2 4.11Å; F353-V357 HydrophobicContact CZ-CG2 4.23Å; F353-V357 WeakPolarHBondContact O-CB 3.47Å; F353-V357 WeakPolarHBondContact O-CG2 3.35Å; F353-V357 PolarHBondContact O-N 3.01Å
354	A	88.4	Confident	89.6	Confident	66 Å²	66	65.2 Å²	65.2	55%	0.545	36%	0.361	S	S	.	.	H	α-helix	trans	-67.5	-18.6	-179.6	0	0	0	0	0	114.3	L350	L350-A354 VanDerWaalsContact O-CB 3.23Å; L350-A354 WeakPolarHBondContact O-CB 3.41Å; L350-A354 PolarHBondContact O-N 2.73Å
355	S	90.3	Very high	88.7	Confident	59 Å²	59	61.4 Å²	61.4	41%	0.413	36%	0.36	S	S	.	.	H	α-helix	trans	-100.5	-48.8	177.5	55.4	0	0	0	0	113.1	A351 M352 F353	A351-S355 WeakPolarHBondContact O-CB 3.45Å; A351-S355 PolarHBondContact O-N 3.15Å; A351-S355 PolarHBondContact O-OG 3.27Å; M352-S355 PolarHBondContact O-N 3.04Å; M352-S355 PolarHBondContact O-OG 3.06Å; F353-S355 PolarHBondContact O-N 3.38Å
356	Y	91.1	Very high	87.7	Confident	58 Å²	58	65.5 Å²	65.5	23%	0.227	38%	0.383	C	S	.	.	H	α-helix	trans	-78.1	-35	-172.8	-68.6	2.4	0	0	0	113	L276 I279 F280 M352 E359 I360	L276-Y356 HydrophobicContact CD2-CD1 3.72Å; L276-Y356 HydrophobicContact CD2-CD2 4.31Å; L276-Y356 HydrophobicContact CD2-CE1 3.87Å; L276-Y356 HydrophobicContact CD2-CE2 4.44Å; L276-Y356 HydrophobicContact CD2-CG 3.96Å; I279-Y356 HydrophobicContact CB-CE2 4.32Å; I279-Y356 HydrophobicContact CG2-CE2 3.9Å; F280-Y356 HydrophobicContact CB-CD2 4.33Å; M352-Y356 WeakPolarHBondContact O-CB 3.21Å; M352-Y356 PolarHBondContact O-N 3.15Å; Y356-E359 PolarHBondContact O-N 3.26Å; Y356-I360 WeakPolarHBondContact O-CB 3.33Å; Y356-I360 WeakPolarHBondContact O-CD1 3.27Å; Y356-I360 WeakPolarHBondContact O-CG1 3.34Å; Y356-I360 PolarHBondContact O-N 2.87Å
357	V	89.1	Confident	86.5	Confident	41 Å²	41	71.4 Å²	71.4	25%	0.248	40%	0.399	C	S	.	.	H	α-helix	trans	-66.9	-47	-176.6	178.8	0	0	0	0	112	F280 F353 E359 I360 I361	F280-V357 HydrophobicContact CE2-CG2 4.4Å; F353-V357 HydrophobicContact CD1-CG2 4.44Å; F353-V357 HydrophobicContact CD2-CG2 3.83Å; F353-V357 HydrophobicContact CE1-CG2 4.49Å; F353-V357 HydrophobicContact CE2-CG2 3.89Å; F353-V357 HydrophobicContact CG-CG2 4.11Å; F353-V357 HydrophobicContact CZ-CG2 4.23Å; F353-V357 WeakPolarHBondContact O-CB 3.47Å; F353-V357 WeakPolarHBondContact O-CG2 3.35Å; F353-V357 PolarHBondContact O-N 3.01Å; V357-E359 VanDerWaalsContact C-N 3.35Å; V357-E359 PolarHBondContact O-N 3.35Å; V357-I360 PolarHBondContact O-N 3.42Å; V357-I361 HydrophobicContact CG1-CD1 3.89Å; V357-I361 VanDerWaalsContact O-CG1 3.3Å; V357-I361 WeakPolarHBondContact O-CG1 3.28Å; V357-I361 PolarHBondContact O-N 3.07Å
358	P	91.3	Very high	85.6	Confident	72 Å²	72	72.4 Å²	72.4	47%	0.468	40%	0.398	S	S	.	.	H	α-helix	trans	-60.7	-41.3	174.1	-24.4	35.8	0	0	0	112.9	I361 E362	P358-I361 PolarHBondContact O-N 2.93Å; P358-E362 PolarHBondContact O-N 2.96Å
359	E	89.8	Confident	85.2	Confident	59 Å²	59	77.2 Å²	77.2	28%	0.276	41%	0.409	S	S	.	.	H	α-helix	trans	-67.8	-36.6	-178.9	-170.1	168.1	-121.3	0	0	112.5	K272 L276 Y356 V357 L363	K272-E359 WeakPolarHBondContact CE-OE1 3.46Å; K272-E359 WeakPolarHBondContact CE-OE2 3.49Å; K272-E359 VanDerWaalsContact NZ-CD 3.28Å; K272-E359 IonicContact NZ-OE1 3.22Å; K272-E359 PolarHBondContact NZ-OE1 3.08Å; K272-E359 IonicContact NZ-OE2 2.76Å; L276-E359 HydrophobicContact CD1-CB 4.32Å; L276-E359 HydrophobicContact CD1-CG 3.81Å; L276-E359 VanDerWaalsContact CD1-OE2 3.23Å; L276-E359 WeakPolarHBondContact CD1-OE2 3.24Å; L276-E359 WeakPolarHBondContact CD2-OE2 3.44Å; Y356-E359 PolarHBondContact O-N 3.26Å; V357-E359 VanDerWaalsContact C-N 3.35Å; V357-E359 PolarHBondContact O-N 3.35Å; E359-L363 HydrophobicContact CG-CD1 4.37Å; E359-L363 WeakPolarHBondContact O-CB 3.44Å; E359-L363 WeakPolarHBondContact O-CD1 3.17Å; E359-L363 VanDerWaalsContact O-CG 3.24Å; E359-L363 WeakPolarHBondContact O-CG 3.48Å; E359-L363 PolarHBondContact O-N 2.85Å; E359-L363 VanDerWaalsContact O-N 3.07Å
360	I	89.8	Confident	85.1	Confident	28 Å²	28	79.2 Å²	79.2	14%	0.144	42%	0.417	C	S	.	.	H	α-helix	trans	-64	-43.9	170.8	-73.3	165.7	0	0	0	110.7	L273 L276 Y356 V357 L363 I364	L273-I360 HydrophobicContact CD1-CB 4.38Å; L273-I360 HydrophobicContact CD1-CG1 4.28Å; L273-I360 HydrophobicContact CD1-CG2 3.98Å; L276-I360 HydrophobicContact CB-CD1 4.08Å; L276-I360 HydrophobicContact CB-CG1 3.93Å; L276-I360 HydrophobicContact CD1-CG1 4.31Å; Y356-I360 WeakPolarHBondContact O-CB 3.33Å; Y356-I360 WeakPolarHBondContact O-CD1 3.27Å; Y356-I360 WeakPolarHBondContact O-CG1 3.34Å; Y356-I360 PolarHBondContact O-N 2.87Å; V357-I360 PolarHBondContact O-N 3.42Å; I360-L363 PolarHBondContact O-N 2.97Å; I360-I364 HydrophobicContact CG2-CD1 3.77Å; I360-I364 VanDerWaalsContact O-CG1 3.3Å; I360-I364 WeakPolarHBondContact O-CG1 3.48Å; I360-I364 PolarHBondContact O-N 3.39Å
361	I	86.9	Confident	84.7	Confident	108 Å²	108	76.7 Å²	76.7	55%	0.554	41%	0.41	S	S	*	.	H	α-helix	trans	-63.2	-43.8	178.2	-69.9	166.6	0	0	0	110.9	V357 P358 I364 G365	V357-I361 HydrophobicContact CG1-CD1 3.89Å; V357-I361 VanDerWaalsContact O-CG1 3.3Å; V357-I361 WeakPolarHBondContact O-CG1 3.28Å; V357-I361 PolarHBondContact O-N 3.07Å; P358-I361 PolarHBondContact O-N 2.93Å; I361-I364 PolarHBondContact O-N 2.71Å; I361-G365 PolarHBondContact O-N 3.31Å
362	E	85.6	Confident	84.7	Confident	125 Å²	125	76.4 Å²	76.4	58%	0.584	41%	0.414	S	S	*	.	H	α-helix	trans	-62.7	-43.5	177.8	-160.9	-156	137.2	0	0	111.9	P358 I364 G365 N366	P358-E362 PolarHBondContact O-N 2.96Å; E362-I364 VanDerWaalsContact C-N 3.31Å; E362-I364 PolarHBondContact O-N 2.61Å; E362-G365 PolarHBondContact O-N 3.25Å; E362-N366 WeakPolarHBondContact O-CB 3.23Å; E362-N366 PolarHBondContact O-N 3.14Å; E362-N366 VanDerWaalsContact O-N 3.08Å; E362-N366 PolarHBondContact O-ND2 3.38Å
363	L	85.9	Confident	84.8	Confident	30 Å²	30	77.8 Å²	77.8	16%	0.157	43%	0.427	C	S	.	.	H	α-helix	trans	-66	-31.4	178	-72.8	169.4	0	0	0	113	N269 K272 L273 L276 E359 I360	N269-L363 HydrophobicContact CB-CD2 3.98Å; K272-L363 HydrophobicContact CB-CD1 4.32Å; K272-L363 HydrophobicContact CD-CD1 4.11Å; K272-L363 HydrophobicContact CG-CD1 4.06Å; L273-L363 HydrophobicContact CB-CB 4.46Å; L273-L363 HydrophobicContact CB-CD1 4.17Å; L273-L363 HydrophobicContact CD1-CB 4.23Å; L276-L363 HydrophobicContact CD1-CD1 3.94Å; E359-L363 HydrophobicContact CG-CD1 4.37Å; E359-L363 WeakPolarHBondContact O-CB 3.44Å; E359-L363 WeakPolarHBondContact O-CD1 3.17Å; E359-L363 VanDerWaalsContact O-CG 3.24Å; E359-L363 WeakPolarHBondContact O-CG 3.48Å; E359-L363 PolarHBondContact O-N 2.85Å; E359-L363 VanDerWaalsContact O-N 3.07Å; I360-L363 PolarHBondContact O-N 2.97Å
364	I	84	Confident	85	Confident	88 Å²	88	75.6 Å²	75.6	45%	0.451	42%	0.418	S	S	.	.	H	α-helix	trans	-80.3	-36.6	174.6	-67.5	169.1	0	0	0	111.5	L273 I360 I361 E362	L273-I364 HydrophobicContact CD1-CD1 4.28Å; L273-I364 HydrophobicContact CD1-CG1 4.07Å; L273-I364 HydrophobicContact CD2-CG1 4.1Å; I360-I364 HydrophobicContact CG2-CD1 3.77Å; I360-I364 VanDerWaalsContact O-CG1 3.3Å; I360-I364 WeakPolarHBondContact O-CG1 3.48Å; I360-I364 PolarHBondContact O-N 3.39Å; I361-I364 PolarHBondContact O-N 2.71Å; E362-I364 VanDerWaalsContact C-N 3.31Å; E362-I364 PolarHBondContact O-N 2.61Å
365	G	74.4	Confident	85	Confident	56 Å²	56	76.4 Å²	76.4	58%	0.577	42%	0.419	S	S	*	.	H	α-helix	trans	-73.7	-22.6	-177.1	0	0	0	0	0	114.7	I361 E362 R367	I361-G365 PolarHBondContact O-N 3.31Å; E362-G365 PolarHBondContact O-N 3.25Å; G365-R367 PolarHBondContact O-N 3.34Å
366	N	71.6	Confident	84.6	Confident	103 Å²	103	76 Å²	76	55%	0.551	42%	0.42	S	S	*	.			trans	-67.8	33.6	178.3	-95.4	-67	0	0	0	115.3	E362	E362-N366 WeakPolarHBondContact O-CB 3.23Å; E362-N366 PolarHBondContact O-N 3.14Å; E362-N366 VanDerWaalsContact O-N 3.08Å; E362-N366 PolarHBondContact O-ND2 3.38Å
367	R	70.1	Confident	84.3	Confident	207 Å²	207	76.4 Å²	76.4	78%	0.781	43%	0.428	S	S	*	.			trans	-78.3	122.6	169.3	-64.7	-177.8	-177.2	-159.9	-0.6	109.3	G365 K369	G365-R367 PolarHBondContact O-N 3.34Å; R367-K369 PolarHBondContact O-N 3.13Å
368	K	71.9	Confident	83.8	Confident	146 Å²	146	82.6 Å²	82.6	64%	0.635	46%	0.46	S	S	*	.			trans	-62.2	104	173	-71.3	-167.2	171.1	-156.8	0	110.6	Y370 G371	K368-Y370 PolarHBondContact O-N 3.09Å; K368-G371 PolarHBondContact O-N 2.94Å
369	K	80.9	Confident	83.3	Confident	138 Å²	138	83.2 Å²	83.2	60%	0.6	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-42.2	177.3	-179.3	176.4	174.1	-175.6	0	112.9	R367 G371 E426	R367-K369 PolarHBondContact O-N 3.13Å; K369-G371 VanDerWaalsContact C-N 3.35Å; K369-G371 PolarHBondContact O-N 3.48Å; K369-E426 IonicContact NZ-OE1 3.2Å; K369-E426 PolarHBondContact NZ-OE1 3.1Å; K369-E426 IonicContact NZ-OE2 2.63Å; K369-E426 PolarHBondContact NZ-OE2 3.06Å
370	Y	86.7	Confident	83	Confident	42 Å²	42	85.7 Å²	85.7	17%	0.165	49%	0.486	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	36	179.9	-60	-70.8	0	0	0	112.9	K368 P421 E426 F438 Q440	K368-Y370 PolarHBondContact O-N 3.09Å; Y370-P421 HydrophobicContact CD2-CG 4.22Å; Y370-P421 HydrophobicContact CE2-CG 3.62Å; Y370-E426 VanDerWaalsContact OH-CG 3.3Å; Y370-E426 WeakPolarHBondContact OH-CG 3.43Å; Y370-E426 PolarHBondContact OH-OE1 3.36Å; Y370-E426 PolarHBondContact OH-OE2 3.2Å; Y370-F438 HydrophobicContact CD1-CB 4.41Å; Y370-F438 AromaticContact CD1-CD1 3.67Å; Y370-F438 HydrophobicContact CD1-CD1 3.67Å; Y370-F438 HydrophobicContact CD1-CG 4.5Å; Y370-F438 WeakPolarHBondContact CD1-O 3.28Å; Y370-F438 HydrophobicContact CD2-CD1 4.22Å; Y370-F438 HydrophobicContact CD2-CE1 4.35Å; Y370-F438 HydrophobicContact CE1-CD1 4.29Å; Y370-F438 AromaticContact CG-CD1 3.63Å; Y370-F438 HydrophobicContact CG-CD1 3.63Å; Y370-F438 HydrophobicContact CG-CE1 4.04Å; Y370-Q440 PolarHBondContact O-N 3.3Å
371	G	83.1	Confident	83.1	Confident	28 Å²	28	89.5 Å²	89.5	29%	0.289	50%	0.502	S	S	.	.			trans	-76.9	-149.9	166.6	0	0	0	0	0	111.8	K368 K369 Y439	K368-G371 PolarHBondContact O-N 2.94Å; K369-G371 VanDerWaalsContact C-N 3.35Å; K369-G371 PolarHBondContact O-N 3.48Å; G371-Y439 VanDerWaalsContact O-CD1 3.28Å; G371-Y439 WeakPolarHBondContact O-CD1 3.43Å; G371-Y439 WeakPolarHBondContact O-CE1 3.49Å
372	G	89.4	Confident	83.5	Confident	58 Å²	58	84.5 Å²	84.5	60%	0.598	48%	0.476	S	S	*	.	S	Bend	trans	70.3	-172.7	-179.3	0	0	0	0	0	113.7	R451	G372-R451 WeakPolarHBondContact O-CD 3.49Å; G372-R451 WeakPolarHBondContact O-CG 3.18Å; G372-R451 PolarHBondContact O-NH1 3.29Å
373	S	91.3	Very high	84	Confident	70 Å²	70	78.6 Å²	78.6	49%	0.49	45%	0.448	S	S	.	.			trans	-140.2	140.6	-178.4	58.6	0	0	0	0	110.4	S375 R451	S373-S375 PolarHBondContact O-N 2.8Å; S373-R451 CarbonylContact C-O 3.33Å; S373-R451 WeakPolarHBondContact CA-O 3.5Å; S373-R451 WeakPolarHBondContact CB-O 3.04Å
374	Y	93.9	Very high	84.6	Confident	5 Å²	5	77.2 Å²	77.2	2%	0.02	44%	0.441	C	S	.	.			trans	-59.9	132.5	177.4	171.2	-110.7	0	0	0	111.6	A376 H382 E412 V414 E437 Y439 R451 K453	Y374-A376 HydrophobicContact CD1-CB 4.41Å; Y374-A376 HydrophobicContact CE1-CB 3.81Å; Y374-H382 AromaticContact CD1-CD2 3.87Å; Y374-H382 AromaticContact CD1-NE2 3.71Å; Y374-H382 HydrophobicContact CE1-CB 4.09Å; Y374-H382 AromaticContact CE1-CD2 3.51Å; Y374-H382 AromaticContact CE1-CE1 3.5Å; Y374-H382 AromaticContact CE1-CG 3.42Å; Y374-H382 VanDerWaalsContact CE1-CG 3.42Å; Y374-H382 AromaticContact CE1-ND1 3.42Å; Y374-H382 WeakPolarHBondContact CE1-ND1 3.32Å; Y374-H382 AromaticContact CE1-NE2 3.54Å; Y374-H382 AromaticContact CZ-CG 3.77Å; Y374-E412 PolarHBondContact OH-OE2 3.5Å; Y374-V414 HydrophobicContact CD1-CG2 4.4Å; Y374-V414 HydrophobicContact CD2-CG2 3.85Å; Y374-V414 HydrophobicContact CE2-CG2 4.03Å; Y374-V414 HydrophobicContact CG-CG2 4.05Å; Y374-E437 WeakPolarHBondContact CD2-OE2 3.38Å; Y374-Y439 WeakPolarHBondContact CA-OH 3.48Å; Y374-Y439 PolarHBondContact N-OH 2.84Å; Y374-R451 PolarHBondContact N-O 2.95Å; Y374-K453 HydrophobicContact CD1-CB 3.98Å; Y374-K453 HydrophobicContact CD1-CG 4Å; Y374-K453 WeakPolarHBondContact O-CG 3.25Å
375	S	88.3	Confident	85.2	Confident	83 Å²	83	73 Å²	73	58%	0.58	42%	0.42	S	S	*	.			trans	-101.2	88	180	54.4	0	0	0	0	110.6	S373 V377	S373-S375 PolarHBondContact O-N 2.8Å; S375-V377 PolarHBondContact O-N 3.45Å
376	A	82.1	Confident	86.3	Confident	52 Å²	52	70.3 Å²	70.3	43%	0.43	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-51.9	120.5	-178.4	0	0	0	0	0	112.9	Y374	Y374-A376 HydrophobicContact CD1-CB 4.41Å; Y374-A376 HydrophobicContact CE1-CB 3.81Å
377	V	84.9	Confident	87.4	Confident	66 Å²	66	65.8 Å²	65.8	40%	0.4	37%	0.37	S	S	.	.	P	Polyproline II helix	trans	-87.9	119.1	-178.4	-178.4	0	0	0	0	110.2	S375 G379 R380	S375-V377 PolarHBondContact O-N 3.45Å; V377-G379 PolarHBondContact O-N 2.88Å; V377-G379 VanDerWaalsContact O-N 3.12Å; V377-R380 HydrophobicContact CB-CB 4.34Å; V377-R380 HydrophobicContact CB-CG 4.49Å; V377-R380 HydrophobicContact CG1-CG 4.34Å; V377-R380 PolarHBondContact O-N 2.95Å
378	N	78.3	Confident	88.6	Confident	170 Å²	170	58.5 Å²	58.5	91%	0.909	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.3	118.7	178.8	-81.9	-17.2	0	0	0	111.9
379	G	80.4	Confident	89.7	Confident	85 Å²	85	52 Å²	52	88%	0.876	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.9	-7.4	178.5	0	0	0	0	0	115	V377	V377-G379 PolarHBondContact O-N 2.88Å; V377-G379 VanDerWaalsContact O-N 3.12Å
380	R	84.8	Confident	90.2	Very high	111 Å²	111	47.6 Å²	47.6	42%	0.419	30%	0.301	S	S	.	.			trans	-98.6	150.7	164.4	-66.5	-172.5	168.2	179.5	-7.9	110.2	V377 N410 E412	V377-R380 HydrophobicContact CB-CB 4.34Å; V377-R380 HydrophobicContact CB-CG 4.49Å; V377-R380 HydrophobicContact CG1-CG 4.34Å; V377-R380 PolarHBondContact O-N 2.95Å; R380-N410 HydrophobicContact CG-CB 4.45Å; R380-E412 WeakPolarHBondContact CD-OE1 3.44Å; R380-E412 IonicContact CZ-OE1 3.84Å; R380-E412 IonicContact NE-OE1 3.21Å; R380-E412 IonicContact NH1-OE1 2.98Å; R380-E412 PolarHBondContact NH1-OE1 3.2Å
381	K	91.4	Very high	90.3	Very high	108 Å²	108	48.8 Å²	48.8	47%	0.47	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	158.1	167.3	-78.8	175.9	159.3	-155.7	0	108.7	N410 V411 E412 D458	K381-N410 PolarHBondContact N-O 3.21Å; K381-V411 HydrophobicContact CB-CG2 4Å; K381-V411 WeakPolarHBondContact O-CA 3.15Å; K381-E412 PolarHBondContact O-N 3.24Å; K381-D458 HydrophobicContact CB-CB 4.34Å; K381-D458 HydrophobicContact CD-CB 4.2Å; K381-D458 WeakPolarHBondContact CD-OD2 3.41Å; K381-D458 VanDerWaalsContact CE-CG 3.5Å; K381-D458 WeakPolarHBondContact CE-OD1 3.37Å; K381-D458 HydrophobicContact CG-CB 4.4Å; K381-D458 IonicContact NZ-OD1 2.73Å; K381-D458 PolarHBondContact NZ-OD1 2.87Å; K381-D458 IonicContact NZ-OD2 3.65Å; K381-D458 PolarHBondContact NZ-OD2 3.41Å
382	H	94.8	Very high	90.4	Very high	4 Å²	4	51.3 Å²	51.3	2%	0.019	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	152.2	165.6	72.2	-69	0	0	0	111.7	Y374 E412 V414 V452 K453 A457 D458	Y374-H382 AromaticContact CD1-CD2 3.87Å; Y374-H382 AromaticContact CD1-NE2 3.71Å; Y374-H382 HydrophobicContact CE1-CB 4.09Å; Y374-H382 AromaticContact CE1-CD2 3.51Å; Y374-H382 AromaticContact CE1-CE1 3.5Å; Y374-H382 AromaticContact CE1-CG 3.42Å; Y374-H382 VanDerWaalsContact CE1-CG 3.42Å; Y374-H382 AromaticContact CE1-ND1 3.42Å; Y374-H382 WeakPolarHBondContact CE1-ND1 3.32Å; Y374-H382 AromaticContact CE1-NE2 3.54Å; Y374-H382 AromaticContact CZ-CG 3.77Å; H382-E412 CarbonylContact C-O 3.57Å; H382-E412 WeakPolarHBondContact CA-O 3.41Å; H382-E412 HydrophobicContact CB-CB 4.18Å; H382-E412 WeakPolarHBondContact CB-O 3.24Å; H382-V414 HydrophobicContact CB-CG2 4.24Å; H382-V452 PolarHBondContact NE2-O 3.46Å; H382-K453 PolarHBondContact CE1-O 2.71Å; H382-K453 PolarHBondContact NE2-O 3.46Å; H382-A457 WeakPolarHBondContact O-CA 3.27Å; H382-D458 PolarHBondContact O-N 3.01Å
383	I	96.2	Very high	90.4	Very high	0 Å²	0	49 Å²	49	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	149	169.2	57.1	162.8	0	0	0	109.9	V385 F397 F401 V411 E412 I413 V414 A459 L461 Y967	I383-V385 HydrophobicContact CD1-CG2 3.92Å; I383-V385 HydrophobicContact CG1-CG2 4.4Å; I383-F397 HydrophobicContact CD1-CE1 4.39Å; I383-F397 HydrophobicContact CD1-CZ 3.88Å; I383-F401 HydrophobicContact CD1-CD2 4.29Å; I383-F401 HydrophobicContact CD1-CE1 4.15Å; I383-F401 HydrophobicContact CD1-CE2 3.55Å; I383-F401 HydrophobicContact CD1-CZ 3.47Å; I383-F401 VanDerWaalsContact CD1-CZ 3.47Å; I383-F401 HydrophobicContact CG1-CZ 4.27Å; I383-V411 HydrophobicContact CG1-CG1 4.07Å; I383-V411 HydrophobicContact CG2-CG1 4.03Å; I383-E412 PolarHBondContact N-O 3.35Å; I383-I413 HydrophobicContact CD1-CG1 4.29Å; I383-I413 HydrophobicContact CD1-CG2 4.21Å; I383-I413 HydrophobicContact CG1-CB 4.43Å; I383-I413 HydrophobicContact CG1-CG1 4.28Å; I383-I413 HydrophobicContact CG1-CG2 4.26Å; I383-V414 PolarHBondContact O-N 3.39Å; I383-A459 WeakPolarHBondContact CA-O 3.49Å; I383-A459 HydrophobicContact CG2-CB 4.29Å; I383-L461 HydrophobicContact CB-CD1 4.13Å; I383-L461 HydrophobicContact CD1-CD1 4.04Å; I383-L461 HydrophobicContact CD1-CD2 4.48Å; I383-L461 HydrophobicContact CG2-CD1 4.28Å; I383-Y967 HydrophobicContact CG2-CD2 4.28Å; I383-Y967 HydrophobicContact CG2-CE1 4.36Å; I383-Y967 HydrophobicContact CG2-CE2 3.66Å
384	V	97.6	Very high	90.4	Very high	1 Å²	1	45.6 Å²	45.6	1%	0.006	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	117.5	173.2	177.1	0	0	0	0	109	V414 L416 V452 I454 A457 A459 C460 L461	V384-V414 CarbonylContact C-O 3.54Å; V384-V414 WeakPolarHBondContact CA-O 3.49Å; V384-V414 HydrophobicContact CG2-CB 4.49Å; V384-L416 HydrophobicContact CG1-CB 4.32Å; V384-V452 HydrophobicContact CG1-CG2 3.96Å; V384-V452 HydrophobicContact CG2-CB 4.21Å; V384-V452 HydrophobicContact CG2-CG2 3.92Å; V384-I454 HydrophobicContact CB-CD1 3.68Å; V384-I454 HydrophobicContact CG1-CD1 4.06Å; V384-I454 HydrophobicContact CG2-CD1 3.65Å; V384-A457 HydrophobicContact CG2-CB 3.97Å; V384-A459 PolarHBondContact N-O 2.82Å; V384-A459 VanDerWaalsContact N-O 3.09Å; V384-C460 CarbonylContact O-C 3.47Å; V384-C460 VanDerWaalsContact O-CA 3.3Å; V384-C460 WeakPolarHBondContact O-CA 3.18Å; V384-C460 PolarHBondContact O-SG 3.18Å; V384-C460 VanDerWaalsContact O-SG 3.34Å; V384-L461 PolarHBondContact O-N 3.21Å
385	V	97.8	Very high	90.2	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	131.3	178.4	-173.5	0	0	0	0	109.1	I383 F397 I413 V414 F415 L416 L461 L463	I383-V385 HydrophobicContact CD1-CG2 3.92Å; I383-V385 HydrophobicContact CG1-CG2 4.4Å; V385-F397 HydrophobicContact CG2-CE1 3.88Å; V385-F397 HydrophobicContact CG2-CZ 4.08Å; V385-I413 HydrophobicContact CG2-CG2 3.66Å; V385-V414 PolarHBondContact N-O 3.29Å; V385-F415 HydrophobicContact CB-CD1 3.71Å; V385-F415 HydrophobicContact CB-CE1 3.72Å; V385-F415 HydrophobicContact CB-CG 4.4Å; V385-F415 HydrophobicContact CB-CZ 4.4Å; V385-F415 HydrophobicContact CG1-CD1 3.83Å; V385-F415 HydrophobicContact CG1-CE1 3.54Å; V385-F415 HydrophobicContact CG1-CZ 4.45Å; V385-F415 HydrophobicContact CG2-CE1 4.29Å; V385-F415 WeakPolarHBondContact O-CA 3.25Å; V385-L416 PolarHBondContact O-N 2.6Å; V385-L461 WeakPolarHBondContact CA-O 3.28Å; V385-L461 HydrophobicContact CG2-CB 4.39Å; V385-L463 HydrophobicContact CG1-CD1 3.88Å; V385-L463 HydrophobicContact CG1-CG 4.19Å
386	C	96.7	Very high	90.1	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.6	-177.7	-174	70.3	0	0	0	0	112.1	V443 L461 I462 L463	C386-V443 HydrophobicContact CB-CG2 3.46Å; C386-V443 VanDerWaalsContact CB-CG2 3.46Å; C386-L461 PolarHBondContact N-O 2.98Å; C386-L461 PolarHBondContact SG-O 3.21Å; C386-L461 VanDerWaalsContact SG-O 3.41Å; C386-I462 WeakPolarHBondContact O-CA 3.48Å; C386-L463 PolarHBondContact O-N 3.31Å
387	G	94.8	Very high	90.5	Very high	8 Å²	8	42.6 Å²	42.6	8%	0.082	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	90.2	-134.7	-173.5	0	0	0	0	0	112.1	I389 H417 L463	G387-I389 PolarHBondContact O-N 2.69Å; G387-H417 PolarHBondContact O-CE1 3.37Å; G387-H417 VanDerWaalsContact O-CE1 3.28Å; G387-H417 PolarHBondContact O-ND1 3.27Å; G387-L463 WeakPolarHBondContact CA-O 3.46Å
388	H	94.6	Very high	90.7	Very high	53 Å²	53	39.8 Å²	39.8	25%	0.245	22%	0.221	C	C	.	.	S	Bend	trans	-82.2	97.4	-177.6	-171	75.2	0	0	0	112.1	T390 S393 L463 N465	H388-T390 VanDerWaalsContact NE2-CG2 3.29Å; H388-T390 WeakPolarHBondContact NE2-CG2 3.21Å; H388-S393 PolarHBondContact O-OG 3.29Å; H388-L463 PolarHBondContact N-O 3.16Å; H388-N465 HydrophobicContact CB-CB 4.15Å
389	I	94.9	Very high	91	Very high	11 Å²	11	36.8 Å²	36.8	6%	0.056	20%	0.2	C	C	.	.			trans	-107.6	105.5	-175.3	-73.7	162.5	0	0	0	109	G387 V394 F415 H417 L425 F438	G387-I389 PolarHBondContact O-N 2.69Å; I389-V394 HydrophobicContact CG2-CG2 3.81Å; I389-F415 HydrophobicContact CD1-CB 4.42Å; I389-F415 HydrophobicContact CD1-CD1 3.83Å; I389-F415 HydrophobicContact CG1-CD1 4.08Å; I389-F415 HydrophobicContact CG2-CD1 4.31Å; I389-H417 HydrophobicContact CB-CB 4.19Å; I389-H417 HydrophobicContact CD1-CB 3.83Å; I389-H417 HydrophobicContact CG2-CB 4.43Å; I389-L425 HydrophobicContact CG2-CD2 4.14Å; I389-F438 HydrophobicContact CG2-CE2 4.41Å
390	T	91.8	Very high	91.2	Very high	44 Å²	44	33.3 Å²	33.3	27%	0.27	16%	0.162	S	C	.	.			trans	-131.9	173.9	178.7	57.3	0	0	0	0	110.3	H388 E392 S393 V394	H388-T390 VanDerWaalsContact NE2-CG2 3.29Å; H388-T390 WeakPolarHBondContact NE2-CG2 3.21Å; T390-E392 VanDerWaalsContact C-N 3.34Å; T390-E392 PolarHBondContact O-N 3.15Å; T390-S393 PolarHBondContact N-OG 3.28Å; T390-S393 VanDerWaalsContact N-OG 3.12Å; T390-S393 PolarHBondContact OG1-N 3.24Å; T390-S393 PolarHBondContact OG1-OG 3.46Å; T390-V394 VanDerWaalsContact O-CB 3.3Å; T390-V394 WeakPolarHBondContact O-CB 3.33Å; T390-V394 VanDerWaalsContact O-CG2 3.24Å; T390-V394 WeakPolarHBondContact O-CG2 3.41Å; T390-V394 PolarHBondContact O-N 3.34Å
391	L	89.5	Confident	91.4	Very high	67 Å²	67	28.5 Å²	28.5	35%	0.351	14%	0.144	S	C	.	.	H	α-helix	trans	-59	-45.3	178.5	-176.9	66.3	0	0	0	111.8	S395 E424 L428	L391-S395 WeakPolarHBondContact O-CB 3.46Å; L391-S395 PolarHBondContact O-N 2.92Å; L391-E424 HydrophobicContact CD1-CB 4.05Å; L391-E424 HydrophobicContact CD2-CB 3.81Å; L391-E424 HydrophobicContact CD2-CG 4.43Å; L391-L428 HydrophobicContact CD1-CD2 4.12Å
392	E	84.9	Confident	91.2	Very high	82 Å²	82	25.4 Å²	25.4	38%	0.383	13%	0.132	S	C	.	.	H	α-helix	trans	-61.9	-56.1	178.4	-174.8	-163.9	146.4	0	0	111.8	T390 V394 S395 N396 Y467	T390-E392 VanDerWaalsContact C-N 3.34Å; T390-E392 PolarHBondContact O-N 3.15Å; E392-V394 VanDerWaalsContact C-N 3.29Å; E392-V394 PolarHBondContact O-N 2.9Å; E392-S395 PolarHBondContact O-N 2.64Å; E392-N396 PolarHBondContact O-N 3.45Å; E392-Y467 VanDerWaalsContact OE1-CE2 3.31Å; E392-Y467 WeakPolarHBondContact OE1-CE2 3.24Å; E392-Y467 PolarHBondContact OE1-OH 2.96Å
393	S	89.4	Confident	90.6	Very high	8 Å²	8	27.1 Å²	27.1	6%	0.056	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-34.1	-175.2	71.8	0	0	0	0	112.6	H388 T390 F397	H388-S393 PolarHBondContact O-OG 3.29Å; T390-S393 PolarHBondContact N-OG 3.28Å; T390-S393 VanDerWaalsContact N-OG 3.12Å; T390-S393 PolarHBondContact OG1-N 3.24Å; T390-S393 PolarHBondContact OG1-OG 3.46Å; S393-F397 WeakPolarHBondContact O-CB 3.28Å; S393-F397 PolarHBondContact O-N 2.7Å
394	V	91.7	Very high	89.6	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-76.6	-38.8	174.6	177.5	0	0	0	0	111.9	I389 T390 E392 F397 L398 F415 L425 L428 F429	I389-V394 HydrophobicContact CG2-CG2 3.81Å; T390-V394 VanDerWaalsContact O-CB 3.3Å; T390-V394 WeakPolarHBondContact O-CB 3.33Å; T390-V394 VanDerWaalsContact O-CG2 3.24Å; T390-V394 WeakPolarHBondContact O-CG2 3.41Å; T390-V394 PolarHBondContact O-N 3.34Å; E392-V394 VanDerWaalsContact C-N 3.29Å; E392-V394 PolarHBondContact O-N 2.9Å; V394-F397 PolarHBondContact O-N 3.24Å; V394-L398 HydrophobicContact CG1-CD1 3.6Å; V394-L398 HydrophobicContact CG1-CG 3.9Å; V394-L398 VanDerWaalsContact O-CB 3.31Å; V394-L398 WeakPolarHBondContact O-CB 3.44Å; V394-L398 VanDerWaalsContact O-CG 3.26Å; V394-L398 WeakPolarHBondContact O-CG 3.42Å; V394-L398 PolarHBondContact O-N 3.21Å; V394-F415 HydrophobicContact CG1-CE1 4.21Å; V394-F415 HydrophobicContact CG1-CE2 4.39Å; V394-F415 HydrophobicContact CG1-CZ 3.8Å; V394-F415 HydrophobicContact CG2-CD1 4.32Å; V394-F415 HydrophobicContact CG2-CE1 3.74Å; V394-F415 HydrophobicContact CG2-CZ 4.2Å; V394-L425 HydrophobicContact CB-CD1 3.87Å; V394-L425 HydrophobicContact CG1-CD1 3.83Å; V394-L425 HydrophobicContact CG2-CD1 4.03Å; V394-L428 HydrophobicContact CB-CD2 4.38Å; V394-L428 HydrophobicContact CG1-CD2 3.84Å; V394-F429 HydrophobicContact CG1-CE1 3.92Å
395	S	88.8	Confident	88.4	Confident	38 Å²	38	39.7 Å²	39.7	27%	0.266	20%	0.198	S	C	.	.	H	α-helix	trans	-59.9	-52.2	178.3	177.7	0	0	0	0	111.2	L391 E392 F397 L398 K399	L391-S395 WeakPolarHBondContact O-CB 3.46Å; L391-S395 PolarHBondContact O-N 2.92Å; E392-S395 PolarHBondContact O-N 2.64Å; S395-F397 PolarHBondContact O-N 3.03Å; S395-L398 PolarHBondContact O-N 2.66Å; S395-K399 WeakPolarHBondContact O-CG 3.46Å; S395-K399 PolarHBondContact O-N 2.69Å
396	N	86.2	Confident	87.3	Confident	35 Å²	35	41.7 Å²	41.7	19%	0.187	21%	0.205	C	C	.	.	H	α-helix	trans	-62	-47.4	179.3	-65.4	-3.5	0	0	0	110.8	E392 L398 K399 D400 D960	E392-N396 PolarHBondContact O-N 3.45Å; N396-L398 PolarHBondContact O-N 3.11Å; N396-K399 PolarHBondContact O-N 3.18Å; N396-D400 PolarHBondContact O-N 3.46Å; N396-D960 HydrophobicContact CB-CB 4.35Å; N396-D960 PolarHBondContact ND2-OD2 2.98Å
397	F	90.1	Very high	85.9	Confident	4 Å²	4	45.4 Å²	45.4	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-59.8	-43.9	177.5	178.6	-102.3	0	0	0	113	I383 V385 S393 V394 S395 F401 I413 F415 L461	I383-F397 HydrophobicContact CD1-CE1 4.39Å; I383-F397 HydrophobicContact CD1-CZ 3.88Å; V385-F397 HydrophobicContact CG2-CE1 3.88Å; V385-F397 HydrophobicContact CG2-CZ 4.08Å; S393-F397 WeakPolarHBondContact O-CB 3.28Å; S393-F397 PolarHBondContact O-N 2.7Å; V394-F397 PolarHBondContact O-N 3.24Å; S395-F397 PolarHBondContact O-N 3.03Å; F397-F401 HydrophobicContact CE1-CB 4.16Å; F397-F401 HydrophobicContact CE1-CD2 4.19Å; F397-F401 HydrophobicContact CE1-CG 4.18Å; F397-F401 HydrophobicContact CE2-CB 4.33Å; F397-F401 AromaticContact CE2-CD2 3.74Å; F397-F401 HydrophobicContact CE2-CD2 3.74Å; F397-F401 HydrophobicContact CE2-CG 4.36Å; F397-F401 HydrophobicContact CZ-CB 4.05Å; F397-F401 AromaticContact CZ-CD2 3.38Å; F397-F401 HydrophobicContact CZ-CD2 3.38Å; F397-F401 AromaticContact CZ-CE2 3.98Å; F397-F401 HydrophobicContact CZ-CE2 3.98Å; F397-F401 AromaticContact CZ-CG 3.82Å; F397-F401 HydrophobicContact CZ-CG 3.82Å; F397-F401 WeakPolarHBondContact O-CB 3.21Å; F397-F401 PolarHBondContact O-N 3.48Å; F397-I413 HydrophobicContact CE1-CD1 4.27Å; F397-I413 HydrophobicContact CE1-CG2 4.13Å; F397-F415 HydrophobicContact CD1-CZ 4.22Å; F397-F415 HydrophobicContact CE1-CZ 4.49Å; F397-L461 HydrophobicContact CE2-CD2 3.51Å; F397-L461 HydrophobicContact CZ-CD2 3.76Å
398	L	90.2	Very high	84.3	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.031	26%	0.263	C	S	.	.	H	α-helix	trans	-72	-34.7	-179.7	-69.4	-177.9	0	0	0	112.9	V394 S395 N396 L402 I413 F415 L428 V436	V394-L398 HydrophobicContact CG1-CD1 3.6Å; V394-L398 HydrophobicContact CG1-CG 3.9Å; V394-L398 VanDerWaalsContact O-CB 3.31Å; V394-L398 WeakPolarHBondContact O-CB 3.44Å; V394-L398 VanDerWaalsContact O-CG 3.26Å; V394-L398 WeakPolarHBondContact O-CG 3.42Å; V394-L398 PolarHBondContact O-N 3.21Å; S395-L398 PolarHBondContact O-N 2.66Å; N396-L398 PolarHBondContact O-N 3.11Å; L398-L402 HydrophobicContact CD2-CD1 3.95Å; L398-L402 HydrophobicContact CD2-CG 4.49Å; L398-L402 WeakPolarHBondContact O-CB 3.26Å; L398-L402 PolarHBondContact O-N 2.9Å; L398-I413 HydrophobicContact CD2-CD1 3.54Å; L398-F415 HydrophobicContact CD2-CE2 4.34Å; L398-F415 HydrophobicContact CD2-CZ 4.26Å; L398-L428 HydrophobicContact CD1-CD1 4.47Å; L398-L428 HydrophobicContact CD1-CD2 4.25Å; L398-L428 HydrophobicContact CD1-CG 4.11Å; L398-V436 HydrophobicContact CD1-CG2 4.32Å; L398-V436 HydrophobicContact CD2-CG2 3.93Å
399	K	85.2	Confident	82.9	Confident	107 Å²	107	54 Å²	54	47%	0.465	27%	0.274	S	S	.	.	H	α-helix	trans	-54.6	-53.3	173	-82.3	-176	177.4	-175.3	0	111.1	S395 N396 H403 E941	S395-K399 WeakPolarHBondContact O-CG 3.46Å; S395-K399 PolarHBondContact O-N 2.69Å; N396-K399 PolarHBondContact O-N 3.18Å; K399-H403 WeakPolarHBondContact O-CB 3.38Å; K399-H403 PolarHBondContact O-N 3.05Å; K399-E941 IonicContact NZ-OE1 3.65Å; K399-E941 PolarHBondContact NZ-OE1 2.95Å
400	D	83.9	Confident	82.1	Confident	13 Å²	13	58 Å²	58	7%	0.07	30%	0.295	C	S	.	.	H	α-helix	trans	-72.5	-44.8	179.8	-82.1	-65	0	0	0	112.5	N396 R406 M551 S961	N396-D400 PolarHBondContact O-N 3.46Å; D400-R406 PolarHBondContact O-NH1 2.93Å; D400-M551 PolarHBondContact OD1-N 3.28Å; D400-S961 VanDerWaalsContact CG-OG 3.3Å; D400-S961 PolarHBondContact OD1-OG 3.38Å; D400-S961 VanDerWaalsContact OD2-CA 3.23Å; D400-S961 WeakPolarHBondContact OD2-CA 3.31Å; D400-S961 WeakPolarHBondContact OD2-CB 3.28Å; D400-S961 PolarHBondContact OD2-OG 3.24Å
401	F	88.2	Confident	82	Confident	10 Å²	10	56.4 Å²	56.4	4%	0.044	29%	0.286	C	S	.	.	H	α-helix	trans	-68.6	-39.9	-172.5	-162.9	-80.6	0	0	0	112.7	I383 F397 V411 I413 Y967 F968	I383-F401 HydrophobicContact CD1-CD2 4.29Å; I383-F401 HydrophobicContact CD1-CE1 4.15Å; I383-F401 HydrophobicContact CD1-CE2 3.55Å; I383-F401 HydrophobicContact CD1-CZ 3.47Å; I383-F401 VanDerWaalsContact CD1-CZ 3.47Å; I383-F401 HydrophobicContact CG1-CZ 4.27Å; F397-F401 HydrophobicContact CE1-CB 4.16Å; F397-F401 HydrophobicContact CE1-CD2 4.19Å; F397-F401 HydrophobicContact CE1-CG 4.18Å; F397-F401 HydrophobicContact CE2-CB 4.33Å; F397-F401 AromaticContact CE2-CD2 3.74Å; F397-F401 HydrophobicContact CE2-CD2 3.74Å; F397-F401 HydrophobicContact CE2-CG 4.36Å; F397-F401 HydrophobicContact CZ-CB 4.05Å; F397-F401 AromaticContact CZ-CD2 3.38Å; F397-F401 HydrophobicContact CZ-CD2 3.38Å; F397-F401 AromaticContact CZ-CE2 3.98Å; F397-F401 HydrophobicContact CZ-CE2 3.98Å; F397-F401 AromaticContact CZ-CG 3.82Å; F397-F401 HydrophobicContact CZ-CG 3.82Å; F397-F401 WeakPolarHBondContact O-CB 3.21Å; F397-F401 PolarHBondContact O-N 3.48Å; F401-V411 HydrophobicContact CE1-CB 4.42Å; F401-V411 HydrophobicContact CE1-CG1 4.04Å; F401-V411 HydrophobicContact CZ-CG1 3.96Å; F401-I413 HydrophobicContact CD1-CD1 3.57Å; F401-I413 HydrophobicContact CD1-CG1 4.23Å; F401-I413 HydrophobicContact CE1-CD1 3.98Å; F401-I413 HydrophobicContact CE1-CG1 4.12Å; F401-I413 HydrophobicContact CG-CD1 4.22Å; F401-Y967 AromaticContact CE2-CD1 3.42Å; F401-Y967 HydrophobicContact CE2-CD1 3.42Å; F401-Y967 VanDerWaalsContact CE2-CD1 3.42Å; F401-Y967 AromaticContact CE2-CE1 3.89Å; F401-Y967 HydrophobicContact CE2-CE1 3.89Å; F401-Y967 HydrophobicContact CE2-CG 4.14Å; F401-Y967 AromaticContact CZ-CD1 3.7Å; F401-Y967 HydrophobicContact CZ-CD1 3.7Å; F401-Y967 AromaticContact CZ-CE1 3.64Å; F401-Y967 HydrophobicContact CZ-CE1 3.64Å; F401-F968 HydrophobicContact CD2-CE2 4.03Å; F401-F968 HydrophobicContact CE1-CE2 4.47Å; F401-F968 HydrophobicContact CE1-CZ 4.1Å; F401-F968 AromaticContact CE2-CE2 3.86Å; F401-F968 HydrophobicContact CE2-CE2 3.86Å; F401-F968 HydrophobicContact CE2-CZ 4.1Å; F401-F968 HydrophobicContact CG-CE2 4.42Å; F401-F968 HydrophobicContact CZ-CE2 4.09Å; F401-F968 AromaticContact CZ-CZ 3.84Å; F401-F968 HydrophobicContact CZ-CZ 3.84Å
402	L	87.4	Confident	82.1	Confident	42 Å²	42	54.2 Å²	54.2	22%	0.22	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101	24.6	-178.7	-59.7	175.1	0	0	0	112.6	L398 I413 H432 Q435 V436	L398-L402 HydrophobicContact CD2-CD1 3.95Å; L398-L402 HydrophobicContact CD2-CG 4.49Å; L398-L402 WeakPolarHBondContact O-CB 3.26Å; L398-L402 PolarHBondContact O-N 2.9Å; L402-I413 HydrophobicContact CD1-CD1 4.15Å; L402-I413 HydrophobicContact CD2-CD1 4Å; L402-I413 HydrophobicContact CG-CD1 4.04Å; L402-H432 HydrophobicContact CD1-CB 4.5Å; L402-Q435 HydrophobicContact CD1-CB 4.29Å; L402-Q435 HydrophobicContact CD2-CB 4.5Å; L402-V436 HydrophobicContact CD1-CG2 4.34Å
403	H	83.1	Confident	82.6	Confident	40 Å²	40	50.3 Å²	50.3	19%	0.185	26%	0.255	C	S	.	.			trans	-66.2	141.5	-179.4	-156.5	-105.6	0	0	0	112.6	K399 D405 R406 M551 S553	K399-H403 WeakPolarHBondContact O-CB 3.38Å; K399-H403 PolarHBondContact O-N 3.05Å; H403-D405 IonicContact CE1-OD2 2.77Å; H403-D405 PolarHBondContact CE1-OD2 2.7Å; H403-D405 IonicContact ND1-OD2 3.76Å; H403-D405 PolarHBondContact ND1-OD2 2.82Å; H403-D405 PolarHBondContact O-N 2.87Å; H403-R406 PolarHBondContact O-N 2.68Å; H403-M551 HydrophobicContact CB-CB 3.57Å; H403-M551 HydrophobicContact CB-CG 3.98Å; H403-S553 PolarHBondContact CE1-N 2.87Å
404	K	75.9	Confident	82.9	Confident	194 Å²	194	50 Å²	50	84%	0.843	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-25.6	-173.4	-62.3	172.6	-172.1	161.1	0	114.2	R406	K404-R406 VanDerWaalsContact C-N 3.32Å
405	D	71.7	Confident	83.2	Confident	72 Å²	72	50 Å²	50	39%	0.385	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-6.6	-173.3	-56.3	-35	0	0	0	112.5	H403 M551	H403-D405 IonicContact CE1-OD2 2.77Å; H403-D405 PolarHBondContact CE1-OD2 2.7Å; H403-D405 IonicContact ND1-OD2 3.76Å; H403-D405 PolarHBondContact ND1-OD2 2.82Å; H403-D405 PolarHBondContact O-N 2.87Å; D405-M551 HydrophobicContact CB-CE 4.09Å
406	R	74.3	Confident	83.6	Confident	41 Å²	41	48.3 Å²	48.3	16%	0.155	24%	0.241	C	C	.	.	S	Bend	trans	-74.6	133.9	163.5	-61.4	-162.6	160.5	144.1	-1.7	109.2	D400 H403 K404 M551 S964 F968	D400-R406 PolarHBondContact O-NH1 2.93Å; H403-R406 PolarHBondContact O-N 2.68Å; K404-R406 VanDerWaalsContact C-N 3.32Å; R406-M551 HydrophobicContact CG-CE 3.53Å; R406-M551 HydrophobicContact CG-CG 4.34Å; R406-M551 HydrophobicContact CG-SD 3.82Å; R406-M551 PolarHBondContact NE-SD 3.13Å; R406-M551 VanDerWaalsContact NH2-CG 3.25Å; R406-M551 PolarHBondContact NH2-SD 3.41Å; R406-S964 VanDerWaalsContact NH1-CB 3.33Å; R406-S964 PolarHBondContact NH1-OG 3.1Å; R406-S964 PolarHBondContact NH2-OG 3.04Å; R406-F968 VanDerWaalsContact NH1-CE2 3.35Å
407	D	67.9	Low	84.1	Confident	79 Å²	79	48 Å²	48	42%	0.422	24%	0.238	S	C	.	.			trans	-53	147	169.3	-71.6	-26.9	0	0	0	110.2	V409 K641	D407-V409 VanDerWaalsContact C-N 3.32Å; D407-V409 WeakPolarHBondContact O-CG2 3.22Å; D407-V409 PolarHBondContact O-N 2.6Å; D407-K641 WeakPolarHBondContact OD1-CE 3.35Å; D407-K641 IonicContact OD1-NZ 3.9Å; D407-K641 PolarHBondContact OD1-NZ 3.32Å
408	D	59.6	Low	84.2	Confident	161 Å²	161	52.3 Å²	52.3	86%	0.861	26%	0.262	S	S	*	.			trans	-57.4	74.1	-170.1	-73.5	-62.9	0	0	0	115.9	N410	D408-N410 PolarHBondContact O-N 2.93Å; D408-N410 PolarHBondContact O-ND2 3.23Å
409	V	66.3	Low	84.3	Confident	80 Å²	80	57.2 Å²	57.2	49%	0.485	29%	0.287	S	S	.	.			trans	-79.8	110.9	177.4	-155.7	0	0	0	0	109.8	D407 V411 F968	D407-V409 VanDerWaalsContact C-N 3.32Å; D407-V409 WeakPolarHBondContact O-CG2 3.22Å; D407-V409 PolarHBondContact O-N 2.6Å; V409-V411 HydrophobicContact CG1-CG2 3.78Å; V409-V411 PolarHBondContact O-N 2.86Å; V409-F968 HydrophobicContact CB-CE1 4.1Å; V409-F968 HydrophobicContact CG1-CE1 4.22Å; V409-F968 HydrophobicContact CG2-CD1 4.42Å; V409-F968 HydrophobicContact CG2-CE1 3.75Å
410	N	78.4	Confident	84.6	Confident	95 Å²	95	55.4 Å²	55.4	51%	0.508	29%	0.288	S	S	.	.			trans	-76	70.3	178.4	-79	-102.8	0	0	0	111.4	R380 K381 D408	R380-N410 HydrophobicContact CG-CB 4.45Å; K381-N410 PolarHBondContact N-O 3.21Å; D408-N410 PolarHBondContact O-N 2.93Å; D408-N410 PolarHBondContact O-ND2 3.23Å
411	V	88.6	Confident	85	Confident	10 Å²	10	55.5 Å²	55.5	6%	0.061	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	126.7	175	172	0	0	0	0	109.9	K381 I383 F401 V409	K381-V411 HydrophobicContact CB-CG2 4Å; K381-V411 WeakPolarHBondContact O-CA 3.15Å; I383-V411 HydrophobicContact CG1-CG1 4.07Å; I383-V411 HydrophobicContact CG2-CG1 4.03Å; F401-V411 HydrophobicContact CE1-CB 4.42Å; F401-V411 HydrophobicContact CE1-CG1 4.04Å; F401-V411 HydrophobicContact CZ-CG1 3.96Å; V409-V411 HydrophobicContact CG1-CG2 3.78Å; V409-V411 PolarHBondContact O-N 2.86Å
412	E	92.5	Very high	85.2	Confident	21 Å²	21	58.6 Å²	58.6	10%	0.098	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	147.4	172.3	-68.1	174.1	-170.1	0	0	111	Y374 R380 K381 H382 I383	Y374-E412 PolarHBondContact OH-OE2 3.5Å; R380-E412 WeakPolarHBondContact CD-OE1 3.44Å; R380-E412 IonicContact CZ-OE1 3.84Å; R380-E412 IonicContact NE-OE1 3.21Å; R380-E412 IonicContact NH1-OE1 2.98Å; R380-E412 PolarHBondContact NH1-OE1 3.2Å; K381-E412 PolarHBondContact O-N 3.24Å; H382-E412 CarbonylContact C-O 3.57Å; H382-E412 WeakPolarHBondContact CA-O 3.41Å; H382-E412 HydrophobicContact CB-CB 4.18Å; H382-E412 WeakPolarHBondContact CB-O 3.24Å; I383-E412 PolarHBondContact N-O 3.35Å
413	I	95.2	Very high	85.5	Confident	1 Å²	1	63.6 Å²	63.6	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	113.4	-173.1	-49.3	177.6	0	0	0	109.3	I383 V385 F397 L398 F401 L402 F415 Q435 V436 E437	I383-I413 HydrophobicContact CD1-CG1 4.29Å; I383-I413 HydrophobicContact CD1-CG2 4.21Å; I383-I413 HydrophobicContact CG1-CB 4.43Å; I383-I413 HydrophobicContact CG1-CG1 4.28Å; I383-I413 HydrophobicContact CG1-CG2 4.26Å; V385-I413 HydrophobicContact CG2-CG2 3.66Å; F397-I413 HydrophobicContact CE1-CD1 4.27Å; F397-I413 HydrophobicContact CE1-CG2 4.13Å; L398-I413 HydrophobicContact CD2-CD1 3.54Å; F401-I413 HydrophobicContact CD1-CD1 3.57Å; F401-I413 HydrophobicContact CD1-CG1 4.23Å; F401-I413 HydrophobicContact CE1-CD1 3.98Å; F401-I413 HydrophobicContact CE1-CG1 4.12Å; F401-I413 HydrophobicContact CG-CD1 4.22Å; L402-I413 HydrophobicContact CD1-CD1 4.15Å; L402-I413 HydrophobicContact CD2-CD1 4Å; L402-I413 HydrophobicContact CG-CD1 4.04Å; I413-F415 HydrophobicContact CB-CE2 4.36Å; I413-F415 HydrophobicContact CG2-CD2 4.04Å; I413-F415 HydrophobicContact CG2-CE2 3.47Å; I413-F415 VanDerWaalsContact CG2-CE2 3.47Å; I413-F415 HydrophobicContact CG2-CZ 3.84Å; I413-Q435 PolarHBondContact N-O 3.08Å; I413-V436 HydrophobicContact CB-CG2 4.29Å; I413-V436 HydrophobicContact CD1-CG2 4.36Å; I413-V436 WeakPolarHBondContact O-CA 3.27Å; I413-E437 PolarHBondContact O-N 3.37Å
414	V	96.6	Very high	85.9	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.006	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	103.7	-176.6	-175.6	0	0	0	0	109.7	Y374 H382 I383 V384 V385 Y439 V452	Y374-V414 HydrophobicContact CD1-CG2 4.4Å; Y374-V414 HydrophobicContact CD2-CG2 3.85Å; Y374-V414 HydrophobicContact CE2-CG2 4.03Å; Y374-V414 HydrophobicContact CG-CG2 4.05Å; H382-V414 HydrophobicContact CB-CG2 4.24Å; I383-V414 PolarHBondContact O-N 3.39Å; V384-V414 CarbonylContact C-O 3.54Å; V384-V414 WeakPolarHBondContact CA-O 3.49Å; V384-V414 HydrophobicContact CG2-CB 4.49Å; V385-V414 PolarHBondContact N-O 3.29Å; V414-Y439 HydrophobicContact CG1-CD2 3.64Å; V414-Y439 HydrophobicContact CG1-CE2 3.92Å; V414-V452 HydrophobicContact CG1-CB 3.95Å; V414-V452 HydrophobicContact CG1-CG1 3.93Å
415	F	97.4	Very high	86.7	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	131.3	177.1	-71.8	-87.4	0	0	0	111.5	V385 I389 V394 F397 L398 I413 F429 V436 E437 F438 Y439	V385-F415 HydrophobicContact CB-CD1 3.71Å; V385-F415 HydrophobicContact CB-CE1 3.72Å; V385-F415 HydrophobicContact CB-CG 4.4Å; V385-F415 HydrophobicContact CB-CZ 4.4Å; V385-F415 HydrophobicContact CG1-CD1 3.83Å; V385-F415 HydrophobicContact CG1-CE1 3.54Å; V385-F415 HydrophobicContact CG1-CZ 4.45Å; V385-F415 HydrophobicContact CG2-CE1 4.29Å; V385-F415 WeakPolarHBondContact O-CA 3.25Å; I389-F415 HydrophobicContact CD1-CB 4.42Å; I389-F415 HydrophobicContact CD1-CD1 3.83Å; I389-F415 HydrophobicContact CG1-CD1 4.08Å; I389-F415 HydrophobicContact CG2-CD1 4.31Å; V394-F415 HydrophobicContact CG1-CE1 4.21Å; V394-F415 HydrophobicContact CG1-CE2 4.39Å; V394-F415 HydrophobicContact CG1-CZ 3.8Å; V394-F415 HydrophobicContact CG2-CD1 4.32Å; V394-F415 HydrophobicContact CG2-CE1 3.74Å; V394-F415 HydrophobicContact CG2-CZ 4.2Å; F397-F415 HydrophobicContact CD1-CZ 4.22Å; F397-F415 HydrophobicContact CE1-CZ 4.49Å; L398-F415 HydrophobicContact CD2-CE2 4.34Å; L398-F415 HydrophobicContact CD2-CZ 4.26Å; I413-F415 HydrophobicContact CB-CE2 4.36Å; I413-F415 HydrophobicContact CG2-CD2 4.04Å; I413-F415 HydrophobicContact CG2-CE2 3.47Å; I413-F415 VanDerWaalsContact CG2-CE2 3.47Å; I413-F415 HydrophobicContact CG2-CZ 3.84Å; F415-F429 HydrophobicContact CB-CZ 4.44Å; F415-F429 AromaticContact CD2-CE1 3.71Å; F415-F429 HydrophobicContact CD2-CE1 3.71Å; F415-F429 HydrophobicContact CD2-CZ 4.11Å; F415-F429 AromaticContact CE2-CE1 3.85Å; F415-F429 HydrophobicContact CE2-CE1 3.85Å; F415-F429 HydrophobicContact CG-CE1 4.22Å; F415-F429 HydrophobicContact CG-CZ 4.19Å; F415-F429 HydrophobicContact CZ-CE1 4.47Å; F415-V436 HydrophobicContact CD2-CG1 3.61Å; F415-V436 HydrophobicContact CE2-CG1 3.54Å; F415-E437 PolarHBondContact N-O 3.35Å; F415-F438 HydrophobicContact CB-CB 4.45Å; F415-F438 HydrophobicContact CB-CD2 3.66Å; F415-F438 HydrophobicContact CB-CE2 4.38Å; F415-F438 HydrophobicContact CB-CG 4.44Å; F415-Y439 PolarHBondContact O-N 2.85Å
416	L	97.3	Very high	87.7	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123	107.3	175.6	-179	58.3	0	0	0	110.8	V384 V385 V443 D448 V452	V384-L416 HydrophobicContact CG1-CB 4.32Å; V385-L416 PolarHBondContact O-N 2.6Å; L416-V443 HydrophobicContact CD2-CG2 4.19Å; L416-D448 HydrophobicContact CD1-CB 4.34Å; L416-D448 HydrophobicContact CD2-CB 4.4Å; L416-V452 HydrophobicContact CB-CG1 4.25Å; L416-V452 HydrophobicContact CD1-CG1 4.08Å; L416-V452 HydrophobicContact CD2-CG1 4.17Å; L416-V452 HydrophobicContact CD2-CG2 4.01Å; L416-V452 HydrophobicContact CG-CG1 4.39Å
417	H	96.3	Very high	88.5	Confident	28 Å²	28	55.7 Å²	55.7	13%	0.13	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	151.2	179.9	-163.7	67.4	0	0	0	112.1	G387 I389 I419 F438 Y439 Q440 G441	G387-H417 PolarHBondContact O-CE1 3.37Å; G387-H417 VanDerWaalsContact O-CE1 3.28Å; G387-H417 PolarHBondContact O-ND1 3.27Å; I389-H417 HydrophobicContact CB-CB 4.19Å; I389-H417 HydrophobicContact CD1-CB 3.83Å; I389-H417 HydrophobicContact CG2-CB 4.43Å; H417-I419 PolarHBondContact CD2-N 3.49Å; H417-I419 PolarHBondContact CD2-O 3.49Å; H417-F438 HydrophobicContact CB-CE2 3.82Å; H417-F438 HydrophobicContact CB-CZ 3.91Å; H417-Y439 PolarHBondContact N-O 3.42Å; H417-Q440 CarbonylContact O-C 3.45Å; H417-Q440 VanDerWaalsContact O-CA 3.22Å; H417-Q440 WeakPolarHBondContact O-CA 3.4Å; H417-G441 CarbonylContact C-O 3.46Å; H417-G441 PolarHBondContact O-N 3.23Å; H417-G441 VanDerWaalsContact O-O 3.1Å
418	N	93.1	Very high	89.7	Confident	96 Å²	96	52.8 Å²	52.8	51%	0.513	29%	0.29	S	S	.	.	S	Bend	trans	-83.6	-34.8	-173.4	60.2	-28.5	0	0	0	112.9	Q440 G441	N418-Q440 VanDerWaalsContact O-CG 3.28Å; N418-Q440 WeakPolarHBondContact O-CG 3.25Å; N418-Q440 PolarHBondContact O-NE2 3.32Å; N418-G441 VanDerWaalsContact CA-O 3.29Å; N418-G441 WeakPolarHBondContact CA-O 3.26Å; N418-G441 PolarHBondContact N-O 3.03Å; N418-G441 VanDerWaalsContact N-O 3.07Å
419	I	92.3	Very high	91.3	Very high	109 Å²	109	45.9 Å²	45.9	56%	0.559	25%	0.252	S	S	*	.	S	Bend	trans	-78	145.9	172.7	-55.2	169.7	0	0	0	108.7	H417	H417-I419 PolarHBondContact CD2-N 3.49Å; H417-I419 PolarHBondContact CD2-O 3.49Å
420	S	90.6	Very high	92.5	Very high	69 Å²	69	48 Å²	48	48%	0.483	25%	0.254	S	S	.	.	P	Polyproline II helix	trans	-75.8	144.7	173	48	0	0	0	0	111.3
421	P	93.3	Very high	93	Very high	15 Å²	15	53 Å²	53	10%	0.097	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-61.2	149.5	178.9	27.5	-35.7	0	0	0	111.5	Y370 L425 E426 F429 F438	Y370-P421 HydrophobicContact CD2-CG 4.22Å; Y370-P421 HydrophobicContact CE2-CG 3.62Å; P421-L425 HydrophobicContact CB-CB 4.05Å; P421-L425 HydrophobicContact CB-CD2 3.87Å; P421-L425 HydrophobicContact CB-CG 3.93Å; P421-E426 HydrophobicContact CB-CG 4.28Å; P421-E426 HydrophobicContact CG-CG 3.91Å; P421-F429 HydrophobicContact CB-CE2 4.12Å; P421-F429 HydrophobicContact CG-CE2 4.47Å; P421-F438 HydrophobicContact CG-CD1 4.35Å; P421-F438 HydrophobicContact CG-CE1 4.34Å
422	N	92.5	Very high	93	Very high	75 Å²	75	54.8 Å²	54.8	40%	0.401	27%	0.274	S	S	.	.	P	Polyproline II helix	trans	-75.6	172.4	168.2	78.4	-13.9	0	0	0	110.6	E424 L425 E426	N422-E424 PolarHBondContact ND2-OE2 2.97Å; N422-E424 PolarHBondContact O-N 3.32Å; N422-E424 PolarHBondContact OD1-N 3.13Å; N422-L425 PolarHBondContact O-N 2.8Å; N422-L425 WeakPolarHBondContact OD1-CB 3.46Å; N422-L425 PolarHBondContact OD1-N 2.91Å; N422-E426 PolarHBondContact O-N 2.9Å
423	L	92.6	Very high	92.5	Very high	146 Å²	146	61.7 Å²	61.7	76%	0.764	30%	0.304	S	S	*	.	H	α-helix	trans	-63.3	-28.9	-175.1	-65	175.7	0	0	0	113.4	E426 A427	L423-E426 WeakPolarHBondContact O-CB 3.03Å; L423-A427 PolarHBondContact O-N 3.33Å
424	E	92	Very high	92	Very high	114 Å²	114	66.9 Å²	66.9	53%	0.533	34%	0.336	S	S	.	.	H	α-helix	trans	-73.8	-46.3	178.2	-60.8	153.1	169	0	0	111.1	L391 N422 E426 A427 L428	L391-E424 HydrophobicContact CD1-CB 4.05Å; L391-E424 HydrophobicContact CD2-CB 3.81Å; L391-E424 HydrophobicContact CD2-CG 4.43Å; N422-E424 PolarHBondContact ND2-OE2 2.97Å; N422-E424 PolarHBondContact O-N 3.32Å; N422-E424 PolarHBondContact OD1-N 3.13Å; E424-E426 VanDerWaalsContact C-N 3.31Å; E424-E426 PolarHBondContact O-N 3.45Å; E424-A427 CarbonylContact O-C 3.5Å; E424-A427 WeakPolarHBondContact O-CA 3.15Å; E424-A427 WeakPolarHBondContact O-CB 3.3Å; E424-A427 PolarHBondContact O-N 3.47Å; E424-L428 PolarHBondContact O-N 3.48Å
425	L	92.3	Very high	91.5	Very high	6 Å²	6	70.4 Å²	70.4	3%	0.031	35%	0.352	C	S	.	.	H	α-helix	trans	-66.8	-34.2	175	-175.4	58.1	0	0	0	111.1	I389 V394 P421 N422 A427 L428 F429	I389-L425 HydrophobicContact CG2-CD2 4.14Å; V394-L425 HydrophobicContact CB-CD1 3.87Å; V394-L425 HydrophobicContact CG1-CD1 3.83Å; V394-L425 HydrophobicContact CG2-CD1 4.03Å; P421-L425 HydrophobicContact CB-CB 4.05Å; P421-L425 HydrophobicContact CB-CD2 3.87Å; P421-L425 HydrophobicContact CB-CG 3.93Å; N422-L425 PolarHBondContact O-N 2.8Å; N422-L425 WeakPolarHBondContact OD1-CB 3.46Å; N422-L425 PolarHBondContact OD1-N 2.91Å; L425-A427 VanDerWaalsContact C-N 3.32Å; L425-A427 PolarHBondContact O-N 3.13Å; L425-L428 HydrophobicContact CD1-CD2 4.22Å; L425-L428 PolarHBondContact O-N 3.39Å; L425-F429 HydrophobicContact CD1-CD1 4.34Å; L425-F429 HydrophobicContact CD1-CE1 3.79Å; L425-F429 HydrophobicContact CD1-CE2 4.03Å; L425-F429 HydrophobicContact CD1-CZ 3.61Å; L425-F429 HydrophobicContact CD2-CE2 4.13Å; L425-F429 HydrophobicContact CD2-CZ 4.07Å; L425-F429 HydrophobicContact CG-CD2 4.23Å; L425-F429 HydrophobicContact CG-CE1 4.33Å; L425-F429 HydrophobicContact CG-CE2 3.63Å; L425-F429 HydrophobicContact CG-CZ 3.7Å; L425-F429 WeakPolarHBondContact O-CD2 3.13Å; L425-F429 VanDerWaalsContact O-CG 3.27Å; L425-F429 WeakPolarHBondContact O-CG 3.28Å; L425-F429 PolarHBondContact O-N 3.43Å
426	E	92.1	Very high	91.3	Very high	20 Å²	20	70.8 Å²	70.8	9%	0.093	35%	0.354	C	S	.	.	H	α-helix	trans	-60.1	-38.9	166.1	-82.5	-152.5	-154.7	0	0	113	K369 Y370 P421 N422 L423 E424 K430	K369-E426 IonicContact NZ-OE1 3.2Å; K369-E426 PolarHBondContact NZ-OE1 3.1Å; K369-E426 IonicContact NZ-OE2 2.63Å; K369-E426 PolarHBondContact NZ-OE2 3.06Å; Y370-E426 VanDerWaalsContact OH-CG 3.3Å; Y370-E426 WeakPolarHBondContact OH-CG 3.43Å; Y370-E426 PolarHBondContact OH-OE1 3.36Å; Y370-E426 PolarHBondContact OH-OE2 3.2Å; P421-E426 HydrophobicContact CB-CG 4.28Å; P421-E426 HydrophobicContact CG-CG 3.91Å; N422-E426 PolarHBondContact O-N 2.9Å; L423-E426 WeakPolarHBondContact O-CB 3.03Å; E424-E426 VanDerWaalsContact C-N 3.31Å; E424-E426 PolarHBondContact O-N 3.45Å; E426-K430 WeakPolarHBondContact O-CB 3.23Å; E426-K430 VanDerWaalsContact O-CD 3.28Å; E426-K430 WeakPolarHBondContact O-CD 3.44Å; E426-K430 WeakPolarHBondContact O-CG 2.95Å; E426-K430 PolarHBondContact O-N 2.87Å; E426-K430 IonicContact OE2-NZ 3.8Å; E426-K430 PolarHBondContact OE2-NZ 2.96Å
427	A	92.4	Very high	91.2	Very high	42 Å²	42	74 Å²	74	35%	0.347	37%	0.37	S	S	.	.	H	α-helix	trans	-70.1	-38.9	176.9	0	0	0	0	0	111.3	L423 E424 L425 K430 R431	L423-A427 PolarHBondContact O-N 3.33Å; E424-A427 CarbonylContact O-C 3.5Å; E424-A427 WeakPolarHBondContact O-CA 3.15Å; E424-A427 WeakPolarHBondContact O-CB 3.3Å; E424-A427 PolarHBondContact O-N 3.47Å; L425-A427 VanDerWaalsContact C-N 3.32Å; L425-A427 PolarHBondContact O-N 3.13Å; A427-K430 PolarHBondContact O-N 3.28Å; A427-R431 WeakPolarHBondContact O-CG 3.03Å; A427-R431 PolarHBondContact O-N 3.03Å
428	L	92.6	Very high	91.1	Very high	18 Å²	18	73.4 Å²	73.4	9%	0.094	37%	0.366	C	S	.	.	H	α-helix	trans	-62.1	-47.6	174.1	-175.8	58.3	0	0	0	111.6	L391 V394 L398 E424 L425 K430 R431 H432	L391-L428 HydrophobicContact CD1-CD2 4.12Å; V394-L428 HydrophobicContact CB-CD2 4.38Å; V394-L428 HydrophobicContact CG1-CD2 3.84Å; L398-L428 HydrophobicContact CD1-CD1 4.47Å; L398-L428 HydrophobicContact CD1-CD2 4.25Å; L398-L428 HydrophobicContact CD1-CG 4.11Å; E424-L428 PolarHBondContact O-N 3.48Å; L425-L428 HydrophobicContact CD1-CD2 4.22Å; L425-L428 PolarHBondContact O-N 3.39Å; L428-K430 VanDerWaalsContact C-N 3.32Å; L428-K430 PolarHBondContact O-N 3.02Å; L428-R431 WeakPolarHBondContact O-CB 3.43Å; L428-R431 PolarHBondContact O-N 3.31Å; L428-R431 VanDerWaalsContact O-N 3.13Å; L428-H432 PolarHBondContact O-N 2.87Å
429	F	93.3	Very high	91.3	Very high	16 Å²	16	70 Å²	70	7%	0.07	35%	0.347	C	S	.	.	H	α-helix	trans	-61.7	-36.9	174.4	-64.1	-30.3	0	0	0	112.7	V394 F415 P421 L425 R431 H432 F433 V436 F438	V394-F429 HydrophobicContact CG1-CE1 3.92Å; F415-F429 HydrophobicContact CB-CZ 4.44Å; F415-F429 AromaticContact CD2-CE1 3.71Å; F415-F429 HydrophobicContact CD2-CE1 3.71Å; F415-F429 HydrophobicContact CD2-CZ 4.11Å; F415-F429 AromaticContact CE2-CE1 3.85Å; F415-F429 HydrophobicContact CE2-CE1 3.85Å; F415-F429 HydrophobicContact CG-CE1 4.22Å; F415-F429 HydrophobicContact CG-CZ 4.19Å; F415-F429 HydrophobicContact CZ-CE1 4.47Å; P421-F429 HydrophobicContact CB-CE2 4.12Å; P421-F429 HydrophobicContact CG-CE2 4.47Å; L425-F429 HydrophobicContact CD1-CD1 4.34Å; L425-F429 HydrophobicContact CD1-CE1 3.79Å; L425-F429 HydrophobicContact CD1-CE2 4.03Å; L425-F429 HydrophobicContact CD1-CZ 3.61Å; L425-F429 HydrophobicContact CD2-CE2 4.13Å; L425-F429 HydrophobicContact CD2-CZ 4.07Å; L425-F429 HydrophobicContact CG-CD2 4.23Å; L425-F429 HydrophobicContact CG-CE1 4.33Å; L425-F429 HydrophobicContact CG-CE2 3.63Å; L425-F429 HydrophobicContact CG-CZ 3.7Å; L425-F429 WeakPolarHBondContact O-CD2 3.13Å; L425-F429 VanDerWaalsContact O-CG 3.27Å; L425-F429 WeakPolarHBondContact O-CG 3.28Å; L425-F429 PolarHBondContact O-N 3.43Å; F429-R431 VanDerWaalsContact C-N 3.32Å; F429-R431 PolarHBondContact O-N 3.48Å; F429-H432 CarbonylContact O-C 3.4Å; F429-H432 PolarHBondContact O-N 2.72Å; F429-F433 PolarHBondContact O-N 2.86Å; F429-V436 HydrophobicContact CD1-CG1 3.46Å; F429-V436 VanDerWaalsContact CD1-CG1 3.46Å; F429-V436 HydrophobicContact CE1-CG1 3.85Å; F429-V436 HydrophobicContact CG-CG1 4.29Å; F429-F438 HydrophobicContact CD2-CB 3.94Å; F429-F438 HydrophobicContact CD2-CD2 4.47Å; F429-F438 HydrophobicContact CD2-CG 4.36Å; F429-F438 HydrophobicContact CE2-CB 3.66Å; F429-F438 AromaticContact CE2-CD2 3.41Å; F429-F438 HydrophobicContact CE2-CD2 3.41Å; F429-F438 VanDerWaalsContact CE2-CD2 3.41Å; F429-F438 HydrophobicContact CE2-CE2 4.3Å; F429-F438 AromaticContact CE2-CG 3.68Å; F429-F438 HydrophobicContact CE2-CG 3.68Å; F429-F438 HydrophobicContact CZ-CB 4.22Å; F429-F438 AromaticContact CZ-CD2 3.66Å; F429-F438 HydrophobicContact CZ-CD2 3.66Å; F429-F438 HydrophobicContact CZ-CG 4.29Å
430	K	90.6	Very high	91.4	Very high	123 Å²	123	66.9 Å²	66.9	54%	0.535	33%	0.329	S	S	.	.	H	α-helix	trans	-67.3	-27.6	174.7	-72.8	161.9	-162.8	157.8	0	113.4	E426 A427 L428 H432	E426-K430 WeakPolarHBondContact O-CB 3.23Å; E426-K430 VanDerWaalsContact O-CD 3.28Å; E426-K430 WeakPolarHBondContact O-CD 3.44Å; E426-K430 WeakPolarHBondContact O-CG 2.95Å; E426-K430 PolarHBondContact O-N 2.87Å; E426-K430 IonicContact OE2-NZ 3.8Å; E426-K430 PolarHBondContact OE2-NZ 2.96Å; A427-K430 PolarHBondContact O-N 3.28Å; L428-K430 VanDerWaalsContact C-N 3.32Å; L428-K430 PolarHBondContact O-N 3.02Å; K430-H432 VanDerWaalsContact C-N 3.34Å
431	R	90.5	Very high	91.6	Very high	200 Å²	200	64 Å²	64	76%	0.755	31%	0.311	S	S	*	.	H	α-helix	trans	-67.3	-34.5	172.5	-69.9	170.1	-177.9	-179.2	0.1	111.8	A427 L428 F429	A427-R431 WeakPolarHBondContact O-CG 3.03Å; A427-R431 PolarHBondContact O-N 3.03Å; L428-R431 WeakPolarHBondContact O-CB 3.43Å; L428-R431 PolarHBondContact O-N 3.31Å; L428-R431 VanDerWaalsContact O-N 3.13Å; F429-R431 VanDerWaalsContact C-N 3.32Å; F429-R431 PolarHBondContact O-N 3.48Å
432	H	87.2	Confident	91.7	Very high	49 Å²	49	65.4 Å²	65.4	23%	0.227	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.5	33.5	-178.1	-64.2	-83.6	0	0	0	113.5	L402 L428 F429 K430 T434 Q435 V436	L402-H432 HydrophobicContact CD1-CB 4.5Å; L428-H432 PolarHBondContact O-N 2.87Å; F429-H432 CarbonylContact O-C 3.4Å; F429-H432 PolarHBondContact O-N 2.72Å; K430-H432 VanDerWaalsContact C-N 3.34Å; H432-T434 PolarHBondContact O-N 2.72Å; H432-Q435 PolarHBondContact ND1-OE1 2.95Å; H432-Q435 PolarHBondContact O-N 3.46Å; H432-V436 HydrophobicContact CB-CB 4.1Å; H432-V436 HydrophobicContact CB-CG2 3.62Å; H432-V436 PolarHBondContact O-N 2.74Å
433	F	82.4	Confident	91.9	Very high	166 Å²	166	62.3 Å²	62.3	73%	0.728	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	-25.5	-169.4	-177.4	-98.3	0	0	0	116	F429	F429-F433 PolarHBondContact O-N 2.86Å
434	T	85.3	Confident	92	Very high	109 Å²	109	59.9 Å²	59.9	67%	0.669	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-2.1	179.1	51.2	0	0	0	0	114.4	H432	H432-T434 PolarHBondContact O-N 2.72Å
435	Q	86.6	Confident	92.3	Very high	76 Å²	76	57 Å²	57	36%	0.355	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.1	-23.6	-173	-65.3	167.7	-47.9	0	0	112.5	L402 I413 H432	L402-Q435 HydrophobicContact CD1-CB 4.29Å; L402-Q435 HydrophobicContact CD2-CB 4.5Å; I413-Q435 PolarHBondContact N-O 3.08Å; H432-Q435 PolarHBondContact ND1-OE1 2.95Å; H432-Q435 PolarHBondContact O-N 3.46Å
436	V	92.8	Very high	92.4	Very high	8 Å²	8	60 Å²	60	5%	0.048	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	122.5	-169.8	-179.8	0	0	0	0	111.5	L398 L402 I413 F415 F429 H432	L398-V436 HydrophobicContact CD1-CG2 4.32Å; L398-V436 HydrophobicContact CD2-CG2 3.93Å; L402-V436 HydrophobicContact CD1-CG2 4.34Å; I413-V436 HydrophobicContact CB-CG2 4.29Å; I413-V436 HydrophobicContact CD1-CG2 4.36Å; I413-V436 WeakPolarHBondContact O-CA 3.27Å; F415-V436 HydrophobicContact CD2-CG1 3.61Å; F415-V436 HydrophobicContact CE2-CG1 3.54Å; F429-V436 HydrophobicContact CD1-CG1 3.46Å; F429-V436 VanDerWaalsContact CD1-CG1 3.46Å; F429-V436 HydrophobicContact CE1-CG1 3.85Å; F429-V436 HydrophobicContact CG-CG1 4.29Å; H432-V436 HydrophobicContact CB-CB 4.1Å; H432-V436 HydrophobicContact CB-CG2 3.62Å; H432-V436 PolarHBondContact O-N 2.74Å
437	E	93.6	Very high	92.6	Very high	70 Å²	70	66.1 Å²	66.1	33%	0.327	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	151.9	169.4	-66.3	-164.5	171.7	0	0	111.4	Y374 I413 F415 Y439	Y374-E437 WeakPolarHBondContact CD2-OE2 3.38Å; I413-E437 PolarHBondContact O-N 3.37Å; F415-E437 PolarHBondContact N-O 3.35Å; E437-Y439 HydrophobicContact CB-CE2 3.86Å; E437-Y439 WeakPolarHBondContact OE2-CE2 3.1Å; E437-Y439 VanDerWaalsContact OE2-CZ 3.24Å; E437-Y439 PolarHBondContact OE2-OH 3.49Å
438	F	95.6	Very high	92.8	Very high	15 Å²	15	65 Å²	65	7%	0.066	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	130.9	177.7	178.7	-81	0	0	0	111.6	Y370 I389 F415 H417 P421 F429 Q440	Y370-F438 HydrophobicContact CD1-CB 4.41Å; Y370-F438 AromaticContact CD1-CD1 3.67Å; Y370-F438 HydrophobicContact CD1-CD1 3.67Å; Y370-F438 HydrophobicContact CD1-CG 4.5Å; Y370-F438 WeakPolarHBondContact CD1-O 3.28Å; Y370-F438 HydrophobicContact CD2-CD1 4.22Å; Y370-F438 HydrophobicContact CD2-CE1 4.35Å; Y370-F438 HydrophobicContact CE1-CD1 4.29Å; Y370-F438 AromaticContact CG-CD1 3.63Å; Y370-F438 HydrophobicContact CG-CD1 3.63Å; Y370-F438 HydrophobicContact CG-CE1 4.04Å; I389-F438 HydrophobicContact CG2-CE2 4.41Å; F415-F438 HydrophobicContact CB-CB 4.45Å; F415-F438 HydrophobicContact CB-CD2 3.66Å; F415-F438 HydrophobicContact CB-CE2 4.38Å; F415-F438 HydrophobicContact CB-CG 4.44Å; H417-F438 HydrophobicContact CB-CE2 3.82Å; H417-F438 HydrophobicContact CB-CZ 3.91Å; P421-F438 HydrophobicContact CG-CD1 4.35Å; P421-F438 HydrophobicContact CG-CE1 4.34Å; F429-F438 HydrophobicContact CD2-CB 3.94Å; F429-F438 HydrophobicContact CD2-CD2 4.47Å; F429-F438 HydrophobicContact CD2-CG 4.36Å; F429-F438 HydrophobicContact CE2-CB 3.66Å; F429-F438 AromaticContact CE2-CD2 3.41Å; F429-F438 HydrophobicContact CE2-CD2 3.41Å; F429-F438 VanDerWaalsContact CE2-CD2 3.41Å; F429-F438 HydrophobicContact CE2-CE2 4.3Å; F429-F438 AromaticContact CE2-CG 3.68Å; F429-F438 HydrophobicContact CE2-CG 3.68Å; F429-F438 HydrophobicContact CZ-CB 4.22Å; F429-F438 AromaticContact CZ-CD2 3.66Å; F429-F438 HydrophobicContact CZ-CD2 3.66Å; F429-F438 HydrophobicContact CZ-CG 4.29Å; F438-Q440 HydrophobicContact CE1-CB 4.22Å
439	Y	95.9	Very high	93	Very high	25 Å²	25	64.3 Å²	64.3	10%	0.098	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	127.4	178	-69.3	-82	0	0	0	111.4	G371 Y374 V414 F415 H417 E437 G441 V452	G371-Y439 VanDerWaalsContact O-CD1 3.28Å; G371-Y439 WeakPolarHBondContact O-CD1 3.43Å; G371-Y439 WeakPolarHBondContact O-CE1 3.49Å; Y374-Y439 WeakPolarHBondContact CA-OH 3.48Å; Y374-Y439 PolarHBondContact N-OH 2.84Å; V414-Y439 HydrophobicContact CG1-CD2 3.64Å; V414-Y439 HydrophobicContact CG1-CE2 3.92Å; F415-Y439 PolarHBondContact O-N 2.85Å; H417-Y439 PolarHBondContact N-O 3.42Å; E437-Y439 HydrophobicContact CB-CE2 3.86Å; E437-Y439 WeakPolarHBondContact OE2-CE2 3.1Å; E437-Y439 VanDerWaalsContact OE2-CZ 3.24Å; E437-Y439 PolarHBondContact OE2-OH 3.49Å; Y439-G441 PolarHBondContact O-N 3.5Å; Y439-V452 HydrophobicContact CD2-CG1 4.22Å; Y439-V452 HydrophobicContact CG-CG1 4.31Å
440	Q	94.8	Very high	93.2	Very high	42 Å²	42	65 Å²	65	20%	0.196	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	106.1	177.9	-171	-166	26.8	0	0	110.7	Y370 H417 N418 F438 R451	Y370-Q440 PolarHBondContact O-N 3.3Å; H417-Q440 CarbonylContact O-C 3.45Å; H417-Q440 VanDerWaalsContact O-CA 3.22Å; H417-Q440 WeakPolarHBondContact O-CA 3.4Å; N418-Q440 VanDerWaalsContact O-CG 3.28Å; N418-Q440 WeakPolarHBondContact O-CG 3.25Å; N418-Q440 PolarHBondContact O-NE2 3.32Å; F438-Q440 HydrophobicContact CE1-CB 4.22Å; Q440-R451 VanDerWaalsContact C-NH2 3.3Å; Q440-R451 PolarHBondContact O-NH2 2.79Å
441	G	94.4	Very high	93.4	Very high	10 Å²	10	61 Å²	61	10%	0.103	30%	0.303	C	S	.	.			trans	-170	-177.4	-177	0	0	0	0	0	112.8	H417 N418 Y439 D448	H417-G441 CarbonylContact C-O 3.46Å; H417-G441 PolarHBondContact O-N 3.23Å; H417-G441 VanDerWaalsContact O-O 3.1Å; N418-G441 VanDerWaalsContact CA-O 3.29Å; N418-G441 WeakPolarHBondContact CA-O 3.26Å; N418-G441 PolarHBondContact N-O 3.03Å; N418-G441 VanDerWaalsContact N-O 3.07Å; Y439-G441 PolarHBondContact O-N 3.5Å; G441-D448 WeakPolarHBondContact CA-OD2 3.43Å
442	S	95.6	Very high	93.7	Very high	43 Å²	43	51.5 Å²	51.5	30%	0.301	27%	0.267	S	S	.	.			trans	-122.3	133.4	177.8	-177.4	0	0	0	0	112.1	L444 N445 D448	S442-L444 PolarHBondContact O-N 3.2Å; S442-L444 VanDerWaalsContact O-N 3.13Å; S442-L444 PolarHBondContact OG-N 3.25Å; S442-N445 WeakPolarHBondContact O-CB 3.31Å; S442-N445 PolarHBondContact O-N 2.71Å; S442-D448 PolarHBondContact N-OD2 3.31Å; S442-D448 WeakPolarHBondContact O-CB 3.22Å
443	V	96.4	Very high	94.1	Very high	10 Å²	10	52 Å²	52	6%	0.061	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-52.8	-32.4	171.9	-178	0	0	0	0	111.9	C386 L416 N445 L449 R481 S484 I485	C386-V443 HydrophobicContact CB-CG2 3.46Å; C386-V443 VanDerWaalsContact CB-CG2 3.46Å; L416-V443 HydrophobicContact CD2-CG2 4.19Å; V443-N445 PolarHBondContact O-N 2.91Å; V443-L449 HydrophobicContact CG1-CD2 4.2Å; V443-R481 HydrophobicContact CG1-CB 4.15Å; V443-S484 PolarHBondContact O-OG 3.19Å; V443-I485 HydrophobicContact CG1-CD1 3.66Å; V443-I485 HydrophobicContact CG1-CG1 3.48Å; V443-I485 VanDerWaalsContact CG1-CG1 3.48Å
444	L	96.5	Very high	94.8	Very high	96 Å²	96	44.1 Å²	44.1	50%	0.503	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.7	-7.4	179.8	-55.1	179.6	0	0	0	113.8	S442 M480 S484	S442-L444 PolarHBondContact O-N 3.2Å; S442-L444 VanDerWaalsContact O-N 3.13Å; S442-L444 PolarHBondContact OG-N 3.25Å; L444-M480 HydrophobicContact CD2-CB 4.42Å; L444-M480 WeakPolarHBondContact CD2-O 3.5Å; L444-S484 WeakPolarHBondContact CA-OG 3.37Å
445	N	96.8	Very high	95.2	Very high	54 Å²	54	42.3 Å²	42.3	29%	0.289	22%	0.218	S	C	.	.			trans	-105.8	114.7	180	173.7	21	0	0	0	110.4	S442 V443 H447 D448 L449	S442-N445 WeakPolarHBondContact O-CB 3.31Å; S442-N445 PolarHBondContact O-N 2.71Å; V443-N445 PolarHBondContact O-N 2.91Å; N445-H447 PolarHBondContact O-N 2.86Å; N445-H447 VanDerWaalsContact O-N 3.09Å; N445-H447 WeakPolarHBondContact OD1-CB 3.28Å; N445-H447 PolarHBondContact OD1-N 3Å; N445-H447 VanDerWaalsContact OD1-N 3.13Å; N445-D448 HydrophobicContact CB-CB 4.28Å; N445-D448 PolarHBondContact ND2-OD2 3.02Å; N445-D448 PolarHBondContact O-N 2.83Å; N445-L449 PolarHBondContact O-N 3.25Å
446	P	95.8	Very high	95.5	Very high	68 Å²	68	41.9 Å²	41.9	44%	0.442	22%	0.224	S	C	.	.	H	α-helix	trans	-64	-19.4	-178.6	27.2	-35.5	0	0	0	113.5	A450 Y488	P446-A450 WeakPolarHBondContact O-CB 3.23Å; P446-A450 PolarHBondContact O-N 2.97Å; P446-A450 VanDerWaalsContact O-N 3.13Å; P446-Y488 HydrophobicContact CB-CD2 3.84Å; P446-Y488 HydrophobicContact CB-CE2 4.11Å; P446-Y488 WeakPolarHBondContact O-CE2 3.3Å
447	H	95.7	Very high	95.6	Very high	148 Å²	148	42.2 Å²	42.2	69%	0.685	23%	0.227	S	C	*	.	H	α-helix	trans	-73	-29.9	172	-65.1	-66.6	0	0	0	113	N445 R451	N445-H447 PolarHBondContact O-N 2.86Å; N445-H447 VanDerWaalsContact O-N 3.09Å; N445-H447 WeakPolarHBondContact OD1-CB 3.28Å; N445-H447 PolarHBondContact OD1-N 3Å; N445-H447 VanDerWaalsContact OD1-N 3.13Å; H447-R451 VanDerWaalsContact O-CB 3.28Å; H447-R451 WeakPolarHBondContact O-CB 3.5Å; H447-R451 PolarHBondContact O-N 3.46Å
448	D	96.5	Very high	95.7	Very high	20 Å²	20	41.5 Å²	41.5	11%	0.107	23%	0.225	C	C	.	.	H	α-helix	trans	-78.1	-37.2	174.8	-76.4	-47.2	0	0	0	111.3	L416 G441 S442 N445 A450 R451 V452	L416-D448 HydrophobicContact CD1-CB 4.34Å; L416-D448 HydrophobicContact CD2-CB 4.4Å; G441-D448 WeakPolarHBondContact CA-OD2 3.43Å; S442-D448 PolarHBondContact N-OD2 3.31Å; S442-D448 WeakPolarHBondContact O-CB 3.22Å; N445-D448 HydrophobicContact CB-CB 4.28Å; N445-D448 PolarHBondContact ND2-OD2 3.02Å; N445-D448 PolarHBondContact O-N 2.83Å; D448-A450 PolarHBondContact O-N 3.33Å; D448-R451 WeakPolarHBondContact O-CA 3.34Å; D448-R451 VanDerWaalsContact O-CB 3.27Å; D448-R451 WeakPolarHBondContact O-CB 3.41Å; D448-R451 PolarHBondContact O-N 2.94Å; D448-R451 IonicContact OD1-CZ 2.76Å; D448-R451 VanDerWaalsContact OD1-CZ 3.24Å; D448-R451 IonicContact OD1-NE 2.72Å; D448-R451 PolarHBondContact OD1-NE 3.43Å; D448-R451 IonicContact OD1-NH2 2.76Å; D448-R451 PolarHBondContact OD1-NH2 3.39Å; D448-V452 PolarHBondContact O-N 3.36Å
449	L	96.9	Very high	95.7	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	22%	0.222	C	C	.	.	H	α-helix	trans	-56.7	-47.4	170.6	-68.2	-176.1	0	0	0	112.1	V443 N445 R451 V452 K453 I454 I485 Y488	V443-L449 HydrophobicContact CG1-CD2 4.2Å; N445-L449 PolarHBondContact O-N 3.25Å; L449-R451 PolarHBondContact O-N 2.61Å; L449-V452 PolarHBondContact O-N 2.88Å; L449-K453 PolarHBondContact O-N 3.32Å; L449-I454 HydrophobicContact CB-CG2 3.84Å; L449-I454 PolarHBondContact O-N 3.07Å; L449-I485 HydrophobicContact CD2-CG1 4.32Å; L449-Y488 HydrophobicContact CB-CD1 4.28Å; L449-Y488 HydrophobicContact CB-CD2 4.16Å; L449-Y488 HydrophobicContact CB-CE1 4.44Å; L449-Y488 HydrophobicContact CB-CE2 4.32Å; L449-Y488 HydrophobicContact CB-CG 4.15Å; L449-Y488 HydrophobicContact CD1-CD1 4.48Å; L449-Y488 HydrophobicContact CD1-CD2 4.11Å; L449-Y488 HydrophobicContact CD1-CG 3.81Å
450	A	96.4	Very high	95.8	Very high	30 Å²	30	39.6 Å²	39.6	25%	0.248	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.4	173.3	0	0	0	0	0	113.8	P446 D448 K453 Y488	P446-A450 WeakPolarHBondContact O-CB 3.23Å; P446-A450 PolarHBondContact O-N 2.97Å; P446-A450 VanDerWaalsContact O-N 3.13Å; D448-A450 PolarHBondContact O-N 3.33Å; A450-K453 PolarHBondContact O-NZ 3.25Å; A450-Y488 HydrophobicContact CB-CE2 4.48Å; A450-Y488 VanDerWaalsContact CB-OH 3.28Å; A450-Y488 WeakPolarHBondContact CB-OH 3.34Å
451	R	95.6	Very high	95.9	Very high	41 Å²	41	37.6 Å²	37.6	16%	0.155	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-28.1	-175.1	-169.1	169	70.5	88.4	-3.6	112.6	G372 S373 Y374 Q440 H447 D448 L449	G372-R451 WeakPolarHBondContact O-CD 3.49Å; G372-R451 WeakPolarHBondContact O-CG 3.18Å; G372-R451 PolarHBondContact O-NH1 3.29Å; S373-R451 CarbonylContact C-O 3.33Å; S373-R451 WeakPolarHBondContact CA-O 3.5Å; S373-R451 WeakPolarHBondContact CB-O 3.04Å; Y374-R451 PolarHBondContact N-O 2.95Å; Q440-R451 VanDerWaalsContact C-NH2 3.3Å; Q440-R451 PolarHBondContact O-NH2 2.79Å; H447-R451 VanDerWaalsContact O-CB 3.28Å; H447-R451 WeakPolarHBondContact O-CB 3.5Å; H447-R451 PolarHBondContact O-N 3.46Å; D448-R451 WeakPolarHBondContact O-CA 3.34Å; D448-R451 VanDerWaalsContact O-CB 3.27Å; D448-R451 WeakPolarHBondContact O-CB 3.41Å; D448-R451 PolarHBondContact O-N 2.94Å; D448-R451 IonicContact OD1-CZ 2.76Å; D448-R451 VanDerWaalsContact OD1-CZ 3.24Å; D448-R451 IonicContact OD1-NE 2.72Å; D448-R451 PolarHBondContact OD1-NE 3.43Å; D448-R451 IonicContact OD1-NH2 2.76Å; D448-R451 PolarHBondContact OD1-NH2 3.39Å; L449-R451 PolarHBondContact O-N 2.61Å
452	V	96.4	Very high	96.1	Very high	0 Å²	0	37.1 Å²	37.1	0%	0	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.8	7.1	169.1	-58	0	0	0	0	113.4	H382 V384 V414 L416 Y439 D448 L449 I454	H382-V452 PolarHBondContact NE2-O 3.46Å; V384-V452 HydrophobicContact CG1-CG2 3.96Å; V384-V452 HydrophobicContact CG2-CB 4.21Å; V384-V452 HydrophobicContact CG2-CG2 3.92Å; V414-V452 HydrophobicContact CG1-CB 3.95Å; V414-V452 HydrophobicContact CG1-CG1 3.93Å; L416-V452 HydrophobicContact CB-CG1 4.25Å; L416-V452 HydrophobicContact CD1-CG1 4.08Å; L416-V452 HydrophobicContact CD2-CG1 4.17Å; L416-V452 HydrophobicContact CD2-CG2 4.01Å; L416-V452 HydrophobicContact CG-CG1 4.39Å; Y439-V452 HydrophobicContact CD2-CG1 4.22Å; Y439-V452 HydrophobicContact CG-CG1 4.31Å; D448-V452 PolarHBondContact O-N 3.36Å; L449-V452 PolarHBondContact O-N 2.88Å; V452-I454 VanDerWaalsContact C-N 3.34Å; V452-I454 PolarHBondContact O-N 2.75Å
453	K	96.1	Very high	96.1	Very high	58 Å²	58	35.3 Å²	35.3	25%	0.252	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.4	41.4	175.4	-61.3	-84.1	139.8	-109	0	113.2	Y374 H382 L449 A450 E455 S456 A457	Y374-K453 HydrophobicContact CD1-CB 3.98Å; Y374-K453 HydrophobicContact CD1-CG 4Å; Y374-K453 WeakPolarHBondContact O-CG 3.25Å; H382-K453 PolarHBondContact CE1-O 2.71Å; H382-K453 PolarHBondContact NE2-O 3.46Å; L449-K453 PolarHBondContact O-N 3.32Å; A450-K453 PolarHBondContact O-NZ 3.25Å; K453-E455 VanDerWaalsContact C-OE2 3.22Å; K453-E455 VanDerWaalsContact CA-OE2 3.3Å; K453-E455 WeakPolarHBondContact CA-OE2 3.37Å; K453-E455 IonicContact NZ-OE1 2.7Å; K453-E455 PolarHBondContact NZ-OE1 2.75Å; K453-E455 PolarHBondContact O-N 2.75Å; K453-E455 VanDerWaalsContact O-N 3.08Å; K453-S456 PolarHBondContact O-N 2.71Å; K453-S456 PolarHBondContact O-OG 3.28Å; K453-A457 PolarHBondContact O-N 3.47Å
454	I	96.4	Very high	96	Very high	1 Å²	1	35 Å²	35	1%	0.005	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-55.8	-27.4	-179.5	-157.7	68.8	0	0	0	112	V384 L449 V452 S456 A457 C460 I485 Y488 I492	V384-I454 HydrophobicContact CB-CD1 3.68Å; V384-I454 HydrophobicContact CG1-CD1 4.06Å; V384-I454 HydrophobicContact CG2-CD1 3.65Å; L449-I454 HydrophobicContact CB-CG2 3.84Å; L449-I454 PolarHBondContact O-N 3.07Å; V452-I454 VanDerWaalsContact C-N 3.34Å; V452-I454 PolarHBondContact O-N 2.75Å; I454-S456 PolarHBondContact O-N 3.01Å; I454-S456 VanDerWaalsContact O-N 3.1Å; I454-A457 HydrophobicContact CD1-CB 4.29Å; I454-A457 PolarHBondContact O-N 3.5Å; I454-C460 HydrophobicContact CD1-CB 4.1Å; I454-I485 HydrophobicContact CG1-CG2 4.26Å; I454-Y488 HydrophobicContact CG2-CD1 3.28Å; I454-Y488 HydrophobicContact CG2-CE1 3.38Å; I454-Y488 HydrophobicContact CG2-CG 4.3Å; I454-I492 HydrophobicContact CD1-CD1 3.48Å; I454-I492 VanDerWaalsContact CD1-CD1 3.48Å; I454-I492 HydrophobicContact CG1-CD1 3.64Å
455	E	94.3	Very high	95.8	Very high	72 Å²	72	32.1 Å²	32.1	34%	0.336	17%	0.174	S	C	.	.	G	3₁₀ helix	trans	-65.1	-8	175.5	69.1	-86.6	-161.3	0	0	114.9	K453 Y488	K453-E455 VanDerWaalsContact C-OE2 3.22Å; K453-E455 VanDerWaalsContact CA-OE2 3.3Å; K453-E455 WeakPolarHBondContact CA-OE2 3.37Å; K453-E455 IonicContact NZ-OE1 2.7Å; K453-E455 PolarHBondContact NZ-OE1 2.75Å; K453-E455 PolarHBondContact O-N 2.75Å; K453-E455 VanDerWaalsContact O-N 3.08Å; E455-Y488 HydrophobicContact CB-CE1 4.43Å
456	S	93.6	Very high	95.3	Very high	67 Å²	67	31 Å²	31	47%	0.469	17%	0.166	S	C	.	.	G	3₁₀ helix	trans	-135.7	4.3	179.7	55.9	0	0	0	0	113.6	K453 I454	K453-S456 PolarHBondContact O-N 2.71Å; K453-S456 PolarHBondContact O-OG 3.28Å; I454-S456 PolarHBondContact O-N 3.01Å; I454-S456 VanDerWaalsContact O-N 3.1Å
457	A	95.4	Very high	94.7	Very high	14 Å²	14	31 Å²	31	12%	0.116	16%	0.158	C	C	.	.			trans	-73.4	147.7	174.4	0	0	0	0	0	110.4	H382 V384 K453 I454 I492	H382-A457 WeakPolarHBondContact O-CA 3.27Å; V384-A457 HydrophobicContact CG2-CB 3.97Å; K453-A457 PolarHBondContact O-N 3.47Å; I454-A457 HydrophobicContact CD1-CB 4.29Å; I454-A457 PolarHBondContact O-N 3.5Å; A457-I492 HydrophobicContact CB-CD1 4Å
458	D	94.6	Very high	94.2	Very high	55 Å²	55	24.6 Å²	24.6	29%	0.294	13%	0.13	S	C	.	.	S	Bend	trans	-76.9	-39.3	-177.9	-160.8	51.6	0	0	0	111.9	K381 H382 Y967	K381-D458 HydrophobicContact CB-CB 4.34Å; K381-D458 HydrophobicContact CD-CB 4.2Å; K381-D458 WeakPolarHBondContact CD-OD2 3.41Å; K381-D458 VanDerWaalsContact CE-CG 3.5Å; K381-D458 WeakPolarHBondContact CE-OD1 3.37Å; K381-D458 HydrophobicContact CG-CB 4.4Å; K381-D458 IonicContact NZ-OD1 2.73Å; K381-D458 PolarHBondContact NZ-OD1 2.87Å; K381-D458 IonicContact NZ-OD2 3.65Å; K381-D458 PolarHBondContact NZ-OD2 3.41Å; H382-D458 PolarHBondContact O-N 3.01Å; D458-Y967 PolarHBondContact OD2-OH 3.24Å
459	A	95.9	Very high	93.4	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	160	172.6	0	0	0	0	0	110.9	I383 V384 L461 R493 Y967	I383-A459 WeakPolarHBondContact CA-O 3.49Å; I383-A459 HydrophobicContact CG2-CB 4.29Å; V384-A459 PolarHBondContact N-O 2.82Å; V384-A459 VanDerWaalsContact N-O 3.09Å; A459-L461 HydrophobicContact CB-CD1 4.11Å; A459-R493 CarbonylContact C-O 3.59Å; A459-R493 VanDerWaalsContact CA-O 3.28Å; A459-R493 WeakPolarHBondContact CA-O 3.42Å; A459-R493 HydrophobicContact CB-CB 4.2Å; A459-Y967 HydrophobicContact CB-CD2 3.79Å; A459-Y967 HydrophobicContact CB-CE2 3.75Å
460	C	97.5	Very high	92.9	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.007	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	127.3	166.4	-164.8	0	0	0	0	109.9	V384 I454 I485 I492 R493 I494 I495	V384-C460 CarbonylContact O-C 3.47Å; V384-C460 VanDerWaalsContact O-CA 3.3Å; V384-C460 WeakPolarHBondContact O-CA 3.18Å; V384-C460 PolarHBondContact O-SG 3.18Å; V384-C460 VanDerWaalsContact O-SG 3.34Å; I454-C460 HydrophobicContact CD1-CB 4.1Å; C460-I485 HydrophobicContact CB-CD1 4.34Å; C460-I485 VanDerWaalsContact SG-CD1 3.59Å; C460-I492 HydrophobicContact CB-CD1 3.97Å; C460-R493 PolarHBondContact N-O 3.19Å; C460-I494 HydrophobicContact CB-CG1 4.45Å; C460-I494 WeakPolarHBondContact O-CA 3.17Å; C460-I495 PolarHBondContact O-N 3.42Å
461	L	97.8	Very high	92.6	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	133.1	178.5	-72	75.3	0	0	0	109.3	I383 V384 V385 C386 F397 A459 I495 M963	I383-L461 HydrophobicContact CB-CD1 4.13Å; I383-L461 HydrophobicContact CD1-CD1 4.04Å; I383-L461 HydrophobicContact CD1-CD2 4.48Å; I383-L461 HydrophobicContact CG2-CD1 4.28Å; V384-L461 PolarHBondContact O-N 3.21Å; V385-L461 WeakPolarHBondContact CA-O 3.28Å; V385-L461 HydrophobicContact CG2-CB 4.39Å; C386-L461 PolarHBondContact N-O 2.98Å; C386-L461 PolarHBondContact SG-O 3.21Å; C386-L461 VanDerWaalsContact SG-O 3.41Å; F397-L461 HydrophobicContact CE2-CD2 3.51Å; F397-L461 HydrophobicContact CZ-CD2 3.76Å; A459-L461 HydrophobicContact CB-CD1 4.11Å; L461-I495 CarbonylContact C-O 3.31Å; L461-I495 WeakPolarHBondContact CA-O 3.23Å; L461-I495 HydrophobicContact CG-CB 4.42Å; L461-M963 HydrophobicContact CB-CE 3.98Å; L461-M963 HydrophobicContact CD2-CE 4.29Å; L461-M963 HydrophobicContact CG-CE 4.26Å
462	I	97.9	Very high	92.4	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	112	-179.2	-42.1	-174.8	0	0	0	109.1	C386 N478 R481 V482 I485 I494 I495 Q497	C386-I462 WeakPolarHBondContact O-CA 3.48Å; I462-N478 WeakPolarHBondContact CG2-OD1 3.18Å; I462-R481 HydrophobicContact CD1-CB 4.15Å; I462-R481 HydrophobicContact CG2-CB 4.49Å; I462-V482 HydrophobicContact CD1-CB 4.5Å; I462-V482 HydrophobicContact CD1-CG2 3.53Å; I462-I485 HydrophobicContact CD1-CD1 4.02Å; I462-I494 HydrophobicContact CD1-CG2 3.84Å; I462-I494 HydrophobicContact CG1-CG2 4.15Å; I462-I495 PolarHBondContact N-O 3.46Å; I462-Q497 PolarHBondContact O-N 3.06Å
463	L	95.8	Very high	92.3	Very high	5 Å²	5	34.3 Å²	34.3	3%	0.026	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.3	137.8	177	-58.6	175.7	0	0	0	110.2	V385 C386 G387 H388 M963	V385-L463 HydrophobicContact CG1-CD1 3.88Å; V385-L463 HydrophobicContact CG1-CG 4.19Å; C386-L463 PolarHBondContact O-N 3.31Å; G387-L463 WeakPolarHBondContact CA-O 3.46Å; H388-L463 PolarHBondContact N-O 3.16Å; L463-M963 HydrophobicContact CD2-CE 4.19Å; L463-M963 HydrophobicContact CD2-CG 4.41Å
464	A	94.6	Very high	92.2	Very high	2 Å²	2	33 Å²	33	2%	0.017	19%	0.194	C	C	.	.			trans	-101	152.8	176.9	0	0	0	0	0	111.2	K466 N478 Q497 L499	A464-K466 PolarHBondContact O-N 3.46Å; A464-N478 WeakPolarHBondContact CB-ND2 3.15Å; A464-Q497 HydrophobicContact CB-CB 3.75Å; A464-L499 HydrophobicContact CB-CD2 4.08Å; A464-L499 HydrophobicContact CB-CG 4.41Å
465	N	91.3	Very high	92.2	Very high	36 Å²	36	33 Å²	33	19%	0.193	19%	0.194	C	C	.	.			trans	-76.2	109.4	165.4	-177.1	1.5	0	0	0	109	H388 Y467 C468 E474	H388-N465 HydrophobicContact CB-CB 4.15Å; N465-Y467 PolarHBondContact O-N 3.08Å; N465-Y467 PolarHBondContact OD1-N 3.05Å; N465-C468 HydrophobicContact CB-CB 4.08Å; N465-C468 PolarHBondContact O-SG 2.93Å; N465-C468 VanDerWaalsContact O-SG 3.41Å; N465-E474 HydrophobicContact CB-CG 4.32Å
466	K	87.6	Confident	92.3	Very high	30 Å²	30	31.9 Å²	31.9	13%	0.13	20%	0.197	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-26	178.3	-66.6	-170.6	-73.3	-76.4	0	113.3	A464 L524 V956 D960	A464-K466 PolarHBondContact O-N 3.46Å; K466-L524 HydrophobicContact CD-CD1 4.04Å; K466-L524 HydrophobicContact CG-CD1 3.81Å; K466-V956 HydrophobicContact CD-CG1 3.95Å; K466-D960 IonicContact NZ-OD1 3.45Å; K466-D960 PolarHBondContact NZ-OD1 2.88Å; K466-D960 IonicContact NZ-OD2 2.85Å; K466-D960 PolarHBondContact NZ-OD2 2.82Å
467	Y	82.8	Confident	92.4	Very high	69 Å²	69	31 Å²	31	27%	0.271	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-115.5	32	-170.4	-33.9	-59.7	0	0	0	111.7	E392 N465 V922	E392-Y467 VanDerWaalsContact OE1-CE2 3.31Å; E392-Y467 WeakPolarHBondContact OE1-CE2 3.24Å; E392-Y467 PolarHBondContact OE1-OH 2.96Å; N465-Y467 PolarHBondContact O-N 3.08Å; N465-Y467 PolarHBondContact OD1-N 3.05Å; Y467-V922 HydrophobicContact CD1-CG1 3.53Å; Y467-V922 HydrophobicContact CE1-CG1 3.56Å
468	C	84.2	Confident	92.5	Very high	14 Å²	14	30.4 Å²	30.4	10%	0.095	19%	0.186	C	C	.	.			trans	-77.8	144.9	178.8	60.9	0	0	0	0	112.5	N465 D470 E474 L499 N847	N465-C468 HydrophobicContact CB-CB 4.08Å; N465-C468 PolarHBondContact O-SG 2.93Å; N465-C468 VanDerWaalsContact O-SG 3.41Å; C468-D470 VanDerWaalsContact C-N 3.29Å; C468-D470 PolarHBondContact O-N 2.81Å; C468-E474 HydrophobicContact CB-CB 4.36Å; C468-L499 WeakPolarHBondContact SG-CD1 3.4Å; C468-N847 PolarHBondContact O-ND2 3.03Å
469	A	80.6	Confident	92.6	Very high	83 Å²	83	28.6 Å²	28.6	69%	0.686	18%	0.176	S	C	*	.	S	Bend	trans	-55.2	-40.3	-179.2	0	0	0	0	0	114.1	N847	A469-N847 PolarHBondContact O-ND2 3.11Å
470	D	86.5	Confident	92.7	Very high	87 Å²	87	33.6 Å²	33.6	47%	0.465	20%	0.201	S	C	.	.			trans	-125.4	105.4	177.6	178.7	-4.7	0	0	0	109.8	C468 D472 A473 E474	C468-D470 VanDerWaalsContact C-N 3.29Å; C468-D470 PolarHBondContact O-N 2.81Å; D470-D472 VanDerWaalsContact C-N 3.31Å; D470-D472 PolarHBondContact O-N 2.97Å; D470-D472 PolarHBondContact OD1-N 3.02Å; D470-A473 HydrophobicContact CB-CB 3.99Å; D470-A473 PolarHBondContact O-N 3.27Å; D470-A473 PolarHBondContact OD1-N 3.49Å; D470-E474 PolarHBondContact O-N 3.08Å
471	P	90.6	Very high	92.7	Very high	16 Å²	16	35.6 Å²	35.6	10%	0.104	21%	0.208	C	C	.	.	H	α-helix	trans	-61.6	-32.7	178	-27.4	37.5	0	0	0	114.8	A473 D475 L499 Q500 A769	P471-A473 VanDerWaalsContact C-N 3.31Å; P471-A473 PolarHBondContact O-N 2.96Å; P471-D475 WeakPolarHBondContact O-CB 3.41Å; P471-D475 PolarHBondContact O-N 2.88Å; P471-L499 HydrophobicContact CB-CB 3.99Å; P471-L499 HydrophobicContact CB-CD1 3.82Å; P471-Q500 HydrophobicContact CB-CG 4.1Å; P471-A769 HydrophobicContact CG-CB 3.98Å
472	D	91.3	Very high	92.7	Very high	64 Å²	64	35.6 Å²	35.6	34%	0.342	21%	0.208	S	C	.	.	H	α-helix	trans	-71.4	-30.7	-179	-70.3	-48.1	0	0	0	111.1	D470 A476 H502 N503	D470-D472 VanDerWaalsContact C-N 3.31Å; D470-D472 PolarHBondContact O-N 2.97Å; D470-D472 PolarHBondContact OD1-N 3.02Å; D472-A476 VanDerWaalsContact O-CB 3.25Å; D472-A476 WeakPolarHBondContact O-CB 3.3Å; D472-A476 PolarHBondContact O-N 3.41Å; D472-H502 IonicContact OD1-CD2 3.7Å; D472-H502 IonicContact OD1-CE1 3.89Å; D472-H502 IonicContact OD1-NE2 2.77Å; D472-H502 PolarHBondContact OD1-NE2 3.27Å; D472-H502 IonicContact OD2-NE2 3.27Å; D472-N503 PolarHBondContact OD1-ND2 3.3Å
473	A	92.8	Very high	92.7	Very high	47 Å²	47	38.9 Å²	38.9	39%	0.388	23%	0.225	S	C	.	.	H	α-helix	trans	-72.5	-37.5	176.2	0	0	0	0	0	113.9	D470 P471 S477	D470-A473 HydrophobicContact CB-CB 3.99Å; D470-A473 PolarHBondContact O-N 3.27Å; D470-A473 PolarHBondContact OD1-N 3.49Å; P471-A473 VanDerWaalsContact C-N 3.31Å; P471-A473 PolarHBondContact O-N 2.96Å; A473-S477 WeakPolarHBondContact O-CB 3.36Å; A473-S477 PolarHBondContact O-N 2.87Å; A473-S477 VanDerWaalsContact O-N 3.07Å; A473-S477 PolarHBondContact O-OG 3.09Å
474	E	94.6	Very high	92.8	Very high	30 Å²	30	39.8 Å²	39.8	14%	0.14	23%	0.232	C	C	.	.	H	α-helix	trans	-74.7	-36.9	174.4	-175.7	58.9	-162.8	0	0	111.2	N465 C468 D470 S477 N478 R481 L499	N465-E474 HydrophobicContact CB-CG 4.32Å; C468-E474 HydrophobicContact CB-CB 4.36Å; D470-E474 PolarHBondContact O-N 3.08Å; E474-S477 CarbonylContact O-C 3.52Å; E474-S477 WeakPolarHBondContact O-CA 2.79Å; E474-S477 WeakPolarHBondContact O-CB 3.39Å; E474-S477 PolarHBondContact O-N 2.84Å; E474-S477 VanDerWaalsContact O-N 3.15Å; E474-N478 PolarHBondContact O-N 3.32Å; E474-N478 PolarHBondContact O-ND2 3.22Å; E474-R481 IonicContact OE1-CZ 3.24Å; E474-R481 VanDerWaalsContact OE1-CZ 3.28Å; E474-R481 IonicContact OE1-NH1 3.31Å; E474-R481 PolarHBondContact OE1-NH1 2.85Å; E474-R481 IonicContact OE1-NH2 3.45Å; E474-R481 PolarHBondContact OE1-NH2 3.22Å; E474-R481 IonicContact OE2-NH2 3.04Å; E474-R481 PolarHBondContact OE2-NH2 2.83Å; E474-L499 HydrophobicContact CB-CD1 4.26Å
475	D	96.1	Very high	92.9	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-62	-45.5	171.6	-86.6	-9.9	0	0	0	112.4	P471 S477 N478 I479 M498 L499 Q500 N503	P471-D475 WeakPolarHBondContact O-CB 3.41Å; P471-D475 PolarHBondContact O-N 2.88Å; D475-S477 PolarHBondContact O-N 2.89Å; D475-N478 WeakPolarHBondContact O-CB 3.24Å; D475-N478 PolarHBondContact O-N 3.2Å; D475-N478 VanDerWaalsContact O-N 3.11Å; D475-I479 WeakPolarHBondContact O-CD1 3.44Å; D475-I479 WeakPolarHBondContact O-CG1 3.5Å; D475-I479 PolarHBondContact O-N 3.02Å; D475-M498 HydrophobicContact CB-CE 3.72Å; D475-M498 WeakPolarHBondContact OD1-CA 3.21Å; D475-L499 PolarHBondContact OD1-N 3.27Å; D475-L499 PolarHBondContact OD2-N 3.03Å; D475-Q500 PolarHBondContact OD2-N 3.17Å; D475-N503 HydrophobicContact CB-CB 3.84Å; D475-N503 VanDerWaalsContact CB-ND2 3.25Å; D475-N503 WeakPolarHBondContact CB-ND2 3.35Å; D475-N503 WeakPolarHBondContact OD2-CB 3.27Å; D475-N503 PolarHBondContact OD2-ND2 3.17Å
476	A	96.1	Very high	93.2	Very high	49 Å²	49	38.3 Å²	38.3	41%	0.405	22%	0.224	S	C	.	.	H	α-helix	trans	-59.5	-36.9	172.8	0	0	0	0	0	111.7	D472 I479 M480	D472-A476 VanDerWaalsContact O-CB 3.25Å; D472-A476 WeakPolarHBondContact O-CB 3.3Å; D472-A476 PolarHBondContact O-N 3.41Å; A476-I479 PolarHBondContact O-N 3.11Å; A476-M480 WeakPolarHBondContact O-CG 3.49Å; A476-M480 PolarHBondContact O-N 3.44Å
477	S	96.1	Very high	93.6	Very high	50 Å²	50	43.6 Å²	43.6	35%	0.35	25%	0.254	S	S	.	.	H	α-helix	trans	-66.6	-38.7	174.2	-61.9	0	0	0	0	112.3	A473 E474 D475 M480 R481	A473-S477 WeakPolarHBondContact O-CB 3.36Å; A473-S477 PolarHBondContact O-N 2.87Å; A473-S477 VanDerWaalsContact O-N 3.07Å; A473-S477 PolarHBondContact O-OG 3.09Å; E474-S477 CarbonylContact O-C 3.52Å; E474-S477 WeakPolarHBondContact O-CA 2.79Å; E474-S477 WeakPolarHBondContact O-CB 3.39Å; E474-S477 PolarHBondContact O-N 2.84Å; E474-S477 VanDerWaalsContact O-N 3.15Å; D475-S477 PolarHBondContact O-N 2.89Å; S477-M480 PolarHBondContact O-N 3.03Å; S477-R481 VanDerWaalsContact O-CG 3.25Å; S477-R481 WeakPolarHBondContact O-CG 3.43Å; S477-R481 PolarHBondContact O-N 2.84Å
478	N	97.3	Very high	94.3	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-65.3	-46.5	172.9	-76.9	-36.3	0	0	0	112.3	I462 A464 E474 D475 M480 R481 V482 M498	I462-N478 WeakPolarHBondContact CG2-OD1 3.18Å; A464-N478 WeakPolarHBondContact CB-ND2 3.15Å; E474-N478 PolarHBondContact O-N 3.32Å; E474-N478 PolarHBondContact O-ND2 3.22Å; D475-N478 WeakPolarHBondContact O-CB 3.24Å; D475-N478 PolarHBondContact O-N 3.2Å; D475-N478 VanDerWaalsContact O-N 3.11Å; N478-M480 VanDerWaalsContact C-N 3.25Å; N478-M480 PolarHBondContact O-N 3Å; N478-R481 WeakPolarHBondContact O-CA 3.28Å; N478-R481 WeakPolarHBondContact O-CB 3.32Å; N478-R481 PolarHBondContact O-N 3.45Å; N478-R481 PolarHBondContact OD1-NH1 3.34Å; N478-V482 WeakPolarHBondContact O-CG2 3.28Å; N478-V482 PolarHBondContact O-N 2.92Å; N478-M498 HydrophobicContact CB-SD 4.4Å
479	I	97.8	Very high	94.9	Very high	17 Å²	17	46.4 Å²	46.4	9%	0.087	26%	0.264	C	S	.	.	H	α-helix	trans	-56.7	-41.2	175.1	-67.3	157.2	0	0	0	110.6	D475 A476 V482 I483 M498 N503 H506 L507	D475-I479 WeakPolarHBondContact O-CD1 3.44Å; D475-I479 WeakPolarHBondContact O-CG1 3.5Å; D475-I479 PolarHBondContact O-N 3.02Å; A476-I479 PolarHBondContact O-N 3.11Å; I479-V482 PolarHBondContact O-N 3.2Å; I479-I483 HydrophobicContact CG2-CD1 3.83Å; I479-I483 HydrophobicContact CG2-CG1 4.46Å; I479-I483 VanDerWaalsContact O-CG1 3.27Å; I479-I483 WeakPolarHBondContact O-CG1 3.46Å; I479-I483 PolarHBondContact O-N 3.13Å; I479-M498 HydrophobicContact CD1-CE 3.86Å; I479-M498 HydrophobicContact CG1-CE 3.91Å; I479-N503 HydrophobicContact CD1-CB 4.26Å; I479-H506 HydrophobicContact CD1-CB 3.91Å; I479-L507 HydrophobicContact CB-CD2 4.46Å; I479-L507 HydrophobicContact CG1-CD2 3.86Å; I479-L507 HydrophobicContact CG1-CG 4.37Å
480	M	97.3	Very high	95.6	Very high	105 Å²	105	45.7 Å²	45.7	52%	0.517	25%	0.253	S	S	.	.	H	α-helix	trans	-67.2	-33.2	174.7	-72.2	-59.2	-59	0	0	113.6	L444 A476 S477 N478 I483 S484	L444-M480 HydrophobicContact CD2-CB 4.42Å; L444-M480 WeakPolarHBondContact CD2-O 3.5Å; A476-M480 WeakPolarHBondContact O-CG 3.49Å; A476-M480 PolarHBondContact O-N 3.44Å; S477-M480 PolarHBondContact O-N 3.03Å; N478-M480 VanDerWaalsContact C-N 3.25Å; N478-M480 PolarHBondContact O-N 3Å; M480-I483 HydrophobicContact SD-CD1 4.17Å; M480-S484 PolarHBondContact O-N 3.33Å; M480-S484 VanDerWaalsContact O-N 3.11Å
481	R	97.8	Very high	96	Very high	43 Å²	43	49.1 Å²	49.1	16%	0.162	26%	0.264	C	S	.	.	H	α-helix	trans	-63.8	-48.1	170.9	-65.3	160.9	-157.5	164	4.4	110.2	V443 I462 E474 S477 N478 I483 S484 I485	V443-R481 HydrophobicContact CG1-CB 4.15Å; I462-R481 HydrophobicContact CD1-CB 4.15Å; I462-R481 HydrophobicContact CG2-CB 4.49Å; E474-R481 IonicContact OE1-CZ 3.24Å; E474-R481 VanDerWaalsContact OE1-CZ 3.28Å; E474-R481 IonicContact OE1-NH1 3.31Å; E474-R481 PolarHBondContact OE1-NH1 2.85Å; E474-R481 IonicContact OE1-NH2 3.45Å; E474-R481 PolarHBondContact OE1-NH2 3.22Å; E474-R481 IonicContact OE2-NH2 3.04Å; E474-R481 PolarHBondContact OE2-NH2 2.83Å; S477-R481 VanDerWaalsContact O-CG 3.25Å; S477-R481 WeakPolarHBondContact O-CG 3.43Å; S477-R481 PolarHBondContact O-N 2.84Å; N478-R481 WeakPolarHBondContact O-CA 3.28Å; N478-R481 WeakPolarHBondContact O-CB 3.32Å; N478-R481 PolarHBondContact O-N 3.45Å; N478-R481 PolarHBondContact OD1-NH1 3.34Å; R481-I483 PolarHBondContact O-N 3.09Å; R481-S484 PolarHBondContact O-N 2.99Å; R481-I485 WeakPolarHBondContact O-CD1 3.4Å; R481-I485 WeakPolarHBondContact O-CG1 3.39Å; R481-I485 PolarHBondContact O-N 3.32Å; R481-I485 VanDerWaalsContact O-N 3.11Å
482	V	98	Very high	96.2	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-56.4	-50.3	175.2	177.2	0	0	0	0	111.6	I462 N478 I479 S484 I485 K486 I494 T496 L507 I510 W513	I462-V482 HydrophobicContact CD1-CB 4.5Å; I462-V482 HydrophobicContact CD1-CG2 3.53Å; N478-V482 WeakPolarHBondContact O-CG2 3.28Å; N478-V482 PolarHBondContact O-N 2.92Å; I479-V482 PolarHBondContact O-N 3.2Å; V482-S484 VanDerWaalsContact C-N 3.3Å; V482-S484 PolarHBondContact O-N 2.93Å; V482-I485 PolarHBondContact O-N 3.15Å; V482-K486 HydrophobicContact CG1-CG 4.28Å; V482-K486 PolarHBondContact O-N 2.69Å; V482-I494 HydrophobicContact CG1-CD1 4.15Å; V482-I494 HydrophobicContact CG2-CG2 4.23Å; V482-T496 HydrophobicContact CG2-CG2 4.34Å; V482-L507 HydrophobicContact CB-CD2 4.19Å; V482-L507 HydrophobicContact CG1-CD2 4.13Å; V482-L507 HydrophobicContact CG2-CD2 3.97Å; V482-I510 HydrophobicContact CB-CD1 4.45Å; V482-I510 HydrophobicContact CG1-CD1 3.81Å; V482-W513 HydrophobicContact CG1-CE3 3.81Å; V482-W513 HydrophobicContact CG1-CZ3 3.83Å; V482-W513 HydrophobicContact CG2-CZ3 4.46Å
483	I	97.6	Very high	96.5	Very high	69 Å²	69	47 Å²	47	35%	0.354	25%	0.249	S	C	.	.	H	α-helix	trans	-58.6	-41.9	179.8	-70.8	166.5	0	0	0	111	I479 M480 R481 N487 I510	I479-I483 HydrophobicContact CG2-CD1 3.83Å; I479-I483 HydrophobicContact CG2-CG1 4.46Å; I479-I483 VanDerWaalsContact O-CG1 3.27Å; I479-I483 WeakPolarHBondContact O-CG1 3.46Å; I479-I483 PolarHBondContact O-N 3.13Å; M480-I483 HydrophobicContact SD-CD1 4.17Å; R481-I483 PolarHBondContact O-N 3.09Å; I483-N487 WeakPolarHBondContact O-CB 3.46Å; I483-N487 PolarHBondContact O-N 2.88Å; I483-I510 HydrophobicContact CD1-CD1 4.43Å; I483-I510 HydrophobicContact CG1-CD1 3.66Å; I483-I510 HydrophobicContact CG1-CG1 4.15Å
484	S	97.9	Very high	96.7	Very high	24 Å²	24	44.8 Å²	44.8	17%	0.168	23%	0.231	C	C	.	.	H	α-helix	trans	-64.1	-44.8	178.8	-160.6	0	0	0	0	112.3	V443 L444 M480 R481 V482 N487 Y488	V443-S484 PolarHBondContact O-OG 3.19Å; L444-S484 WeakPolarHBondContact CA-OG 3.37Å; M480-S484 PolarHBondContact O-N 3.33Å; M480-S484 VanDerWaalsContact O-N 3.11Å; R481-S484 PolarHBondContact O-N 2.99Å; V482-S484 VanDerWaalsContact C-N 3.3Å; V482-S484 PolarHBondContact O-N 2.93Å; S484-N487 PolarHBondContact O-N 3Å; S484-Y488 PolarHBondContact O-N 2.95Å; S484-Y488 VanDerWaalsContact O-N 3.14Å
485	I	97.8	Very high	96.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-64.4	-51.4	178.2	-61.9	157.4	0	0	0	110.7	V443 L449 I454 C460 I462 R481 V482 N487 Y488 H489 I492 I494	V443-I485 HydrophobicContact CG1-CD1 3.66Å; V443-I485 HydrophobicContact CG1-CG1 3.48Å; V443-I485 VanDerWaalsContact CG1-CG1 3.48Å; L449-I485 HydrophobicContact CD2-CG1 4.32Å; I454-I485 HydrophobicContact CG1-CG2 4.26Å; C460-I485 HydrophobicContact CB-CD1 4.34Å; C460-I485 VanDerWaalsContact SG-CD1 3.59Å; I462-I485 HydrophobicContact CD1-CD1 4.02Å; R481-I485 WeakPolarHBondContact O-CD1 3.4Å; R481-I485 WeakPolarHBondContact O-CG1 3.39Å; R481-I485 PolarHBondContact O-N 3.32Å; R481-I485 VanDerWaalsContact O-N 3.11Å; V482-I485 PolarHBondContact O-N 3.15Å; I485-N487 VanDerWaalsContact C-N 3.29Å; I485-N487 PolarHBondContact O-N 3.14Å; I485-Y488 PolarHBondContact O-N 2.89Å; I485-H489 PolarHBondContact O-N 3.13Å; I485-I492 HydrophobicContact CG2-CG2 3.52Å; I485-I494 HydrophobicContact CB-CD1 3.8Å; I485-I494 HydrophobicContact CD1-CD1 4.34Å; I485-I494 HydrophobicContact CG2-CD1 3.58Å; I485-I494 HydrophobicContact CG2-CG1 4.23Å
486	K	96.8	Very high	96.9	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.03	22%	0.224	C	C	.	.	H	α-helix	trans	-63	-33.1	180	-72.3	-59.6	-165.4	173.6	0	112.8	V482 Y488 H489 P490 I492 I494 S512 D519	V482-K486 HydrophobicContact CG1-CG 4.28Å; V482-K486 PolarHBondContact O-N 2.69Å; K486-Y488 VanDerWaalsContact C-N 3.32Å; K486-H489 CarbonylContact O-C 3.58Å; K486-P490 WeakPolarHBondContact CD-O 3.26Å; K486-P490 PolarHBondContact NZ-O 2.89Å; K486-P490 VanDerWaalsContact NZ-O 3.12Å; K486-P490 VanDerWaalsContact O-CA 3.28Å; K486-P490 WeakPolarHBondContact O-CA 3.47Å; K486-P490 WeakPolarHBondContact O-CD 3.45Å; K486-P490 WeakPolarHBondContact O-CG 3.16Å; K486-I492 PolarHBondContact NZ-O 2.67Å; K486-I494 HydrophobicContact CD-CD1 3.75Å; K486-I494 HydrophobicContact CD-CG1 4.45Å; K486-I494 HydrophobicContact CG-CD1 3.69Å; K486-S512 WeakPolarHBondContact CD-O 3.33Å; K486-S512 WeakPolarHBondContact CE-O 3.41Å; K486-S512 PolarHBondContact NZ-O 2.59Å; K486-S512 VanDerWaalsContact NZ-O 3.14Å; K486-D519 WeakPolarHBondContact CE-OD1 3.25Å; K486-D519 VanDerWaalsContact CE-OD2 3.25Å; K486-D519 WeakPolarHBondContact CE-OD2 3.11Å; K486-D519 IonicContact NZ-OD1 3Å; K486-D519 PolarHBondContact NZ-OD1 2.97Å; K486-D519 IonicContact NZ-OD2 3.64Å; K486-D519 PolarHBondContact NZ-OD2 3.39Å
487	N	96.8	Very high	96.9	Very high	142 Å²	142	41.1 Å²	41.1	76%	0.759	21%	0.205	S	C	*	.	H	α-helix	trans	-70.5	-27	174.2	-175.1	52.5	0	0	0	112.8	I483 S484 I485	I483-N487 WeakPolarHBondContact O-CB 3.46Å; I483-N487 PolarHBondContact O-N 2.88Å; S484-N487 PolarHBondContact O-N 3Å; I485-N487 VanDerWaalsContact C-N 3.29Å; I485-N487 PolarHBondContact O-N 3.14Å
488	Y	97.1	Very high	96.9	Very high	81 Å²	81	38.7 Å²	38.7	32%	0.318	19%	0.189	S	C	.	.	H	α-helix	trans	-81.8	-46.7	174.1	-172.8	-86.1	0	0	0	112.3	P446 L449 A450 I454 E455 S484 I485 K486	P446-Y488 HydrophobicContact CB-CD2 3.84Å; P446-Y488 HydrophobicContact CB-CE2 4.11Å; P446-Y488 WeakPolarHBondContact O-CE2 3.3Å; L449-Y488 HydrophobicContact CB-CD1 4.28Å; L449-Y488 HydrophobicContact CB-CD2 4.16Å; L449-Y488 HydrophobicContact CB-CE1 4.44Å; L449-Y488 HydrophobicContact CB-CE2 4.32Å; L449-Y488 HydrophobicContact CB-CG 4.15Å; L449-Y488 HydrophobicContact CD1-CD1 4.48Å; L449-Y488 HydrophobicContact CD1-CD2 4.11Å; L449-Y488 HydrophobicContact CD1-CG 3.81Å; A450-Y488 HydrophobicContact CB-CE2 4.48Å; A450-Y488 VanDerWaalsContact CB-OH 3.28Å; A450-Y488 WeakPolarHBondContact CB-OH 3.34Å; I454-Y488 HydrophobicContact CG2-CD1 3.28Å; I454-Y488 HydrophobicContact CG2-CE1 3.38Å; I454-Y488 HydrophobicContact CG2-CG 4.3Å; E455-Y488 HydrophobicContact CB-CE1 4.43Å; S484-Y488 PolarHBondContact O-N 2.95Å; S484-Y488 VanDerWaalsContact O-N 3.14Å; I485-Y488 PolarHBondContact O-N 2.89Å; K486-Y488 VanDerWaalsContact C-N 3.32Å
489	H	96.4	Very high	96.7	Very high	60 Å²	60	39.5 Å²	39.5	28%	0.278	19%	0.193	S	C	.	.			trans	-142.6	96.4	178	-165.7	95.6	0	0	0	111	I485 K486 K491 I492	I485-H489 PolarHBondContact O-N 3.13Å; K486-H489 CarbonylContact O-C 3.58Å; H489-K491 PolarHBondContact O-N 2.93Å; H489-K491 VanDerWaalsContact O-N 3.11Å; H489-I492 WeakPolarHBondContact O-CG2 3.34Å; H489-I492 PolarHBondContact O-N 2.79Å
490	P	95.4	Very high	96.4	Very high	68 Å²	68	39.2 Å²	39.2	44%	0.442	19%	0.191	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-27.8	-172.9	-29.1	35.1	0	0	0	116	K486	K486-P490 WeakPolarHBondContact CD-O 3.26Å; K486-P490 PolarHBondContact NZ-O 2.89Å; K486-P490 VanDerWaalsContact NZ-O 3.12Å; K486-P490 VanDerWaalsContact O-CA 3.28Å; K486-P490 WeakPolarHBondContact O-CA 3.47Å; K486-P490 WeakPolarHBondContact O-CD 3.45Å; K486-P490 WeakPolarHBondContact O-CG 3.16Å
491	K	94.7	Very high	96	Very high	160 Å²	160	35.2 Å²	35.2	70%	0.696	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-0.9	-171.4	-66.3	-167.8	169.7	-156.6	0	115.6	H489	H489-K491 PolarHBondContact O-N 2.93Å; H489-K491 VanDerWaalsContact O-N 3.11Å
492	I	95.7	Very high	95.5	Very high	7 Å²	7	35.8 Å²	35.8	4%	0.036	18%	0.175	C	C	.	.	S	Bend	trans	-74.3	136.3	179	-170.8	173.7	0	0	0	109	I454 A457 C460 I485 K486 H489 I494	I454-I492 HydrophobicContact CD1-CD1 3.48Å; I454-I492 VanDerWaalsContact CD1-CD1 3.48Å; I454-I492 HydrophobicContact CG1-CD1 3.64Å; A457-I492 HydrophobicContact CB-CD1 4Å; C460-I492 HydrophobicContact CB-CD1 3.97Å; I485-I492 HydrophobicContact CG2-CG2 3.52Å; K486-I492 PolarHBondContact NZ-O 2.67Å; H489-I492 WeakPolarHBondContact O-CG2 3.34Å; H489-I492 PolarHBondContact O-N 2.79Å; I492-I494 HydrophobicContact CG2-CD1 4.32Å; I492-I494 HydrophobicContact CG2-CG1 4.05Å; I492-I494 PolarHBondContact O-N 3.37Å
493	R	96.8	Very high	95.3	Very high	28 Å²	28	36.4 Å²	36.4	11%	0.106	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.1	126.2	171.3	-172.3	-177.5	174.4	-170.1	2.6	109.7	A459 C460 G518 D520 T966 Y967 D970	A459-R493 CarbonylContact C-O 3.59Å; A459-R493 VanDerWaalsContact CA-O 3.28Å; A459-R493 WeakPolarHBondContact CA-O 3.42Å; A459-R493 HydrophobicContact CB-CB 4.2Å; C460-R493 PolarHBondContact N-O 3.19Å; R493-G518 WeakPolarHBondContact CD-O 3.13Å; R493-G518 WeakPolarHBondContact CG-O 3.27Å; R493-G518 PolarHBondContact NE-O 2.8Å; R493-D520 IonicContact CZ-OD2 2.69Å; R493-D520 IonicContact NE-OD2 3.31Å; R493-D520 IonicContact NH2-OD2 3.94Å; R493-D520 PolarHBondContact NH2-OD2 3.25Å; R493-T966 PolarHBondContact NH1-O 2.82Å; R493-T966 PolarHBondContact NH2-O 2.66Å; R493-Y967 PolarHBondContact NH1-O 3.28Å; R493-Y967 VanDerWaalsContact NH1-O 3.12Å; R493-D970 IonicContact CZ-OD1 3.97Å; R493-D970 VanDerWaalsContact CZ-OD1 3.26Å; R493-D970 IonicContact CZ-OD2 3.01Å; R493-D970 IonicContact NE-OD2 3.83Å; R493-D970 VanDerWaalsContact NH1-CG 3.27Å; R493-D970 IonicContact NH1-OD1 2.72Å; R493-D970 PolarHBondContact NH1-OD1 3.21Å; R493-D970 IonicContact NH1-OD2 2.98Å; R493-D970 VanDerWaalsContact NH2-CG 3.27Å; R493-D970 IonicContact NH2-OD1 2.8Å; R493-D970 PolarHBondContact NH2-OD1 2.98Å; R493-D970 IonicContact NH2-OD2 3.29Å
494	I	97.6	Very high	94.9	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	128.2	176.1	-56.3	-177.7	0	0	0	110.2	C460 I462 V482 I485 K486 I492 W513 D519 D520	C460-I494 HydrophobicContact CB-CG1 4.45Å; C460-I494 WeakPolarHBondContact O-CA 3.17Å; I462-I494 HydrophobicContact CD1-CG2 3.84Å; I462-I494 HydrophobicContact CG1-CG2 4.15Å; V482-I494 HydrophobicContact CG1-CD1 4.15Å; V482-I494 HydrophobicContact CG2-CG2 4.23Å; I485-I494 HydrophobicContact CB-CD1 3.8Å; I485-I494 HydrophobicContact CD1-CD1 4.34Å; I485-I494 HydrophobicContact CG2-CD1 3.58Å; I485-I494 HydrophobicContact CG2-CG1 4.23Å; K486-I494 HydrophobicContact CD-CD1 3.75Å; K486-I494 HydrophobicContact CD-CG1 4.45Å; K486-I494 HydrophobicContact CG-CD1 3.69Å; I492-I494 HydrophobicContact CG2-CD1 4.32Å; I492-I494 HydrophobicContact CG2-CG1 4.05Å; I492-I494 PolarHBondContact O-N 3.37Å; I494-W513 HydrophobicContact CB-CZ3 4.21Å; I494-W513 HydrophobicContact CG2-CZ3 4.3Å; I494-D519 PolarHBondContact N-OD1 3.29Å; I494-D519 CarbonylContact O-C 3.57Å; I494-D519 WeakPolarHBondContact O-CA 3.29Å; I494-D520 PolarHBondContact O-N 3.05Å
495	I	97.5	Very high	94.5	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	119.7	171.1	-51	175.3	0	0	0	107.2	C460 L461 I462 D520 I522 M963 T966 Y967	C460-I495 PolarHBondContact O-N 3.42Å; L461-I495 CarbonylContact C-O 3.31Å; L461-I495 WeakPolarHBondContact CA-O 3.23Å; L461-I495 HydrophobicContact CG-CB 4.42Å; I462-I495 PolarHBondContact N-O 3.46Å; I495-D520 WeakPolarHBondContact CA-O 3.41Å; I495-D520 HydrophobicContact CG1-CB 4.37Å; I495-D520 HydrophobicContact CG2-CB 4.24Å; I495-I522 HydrophobicContact CG2-CD1 4.11Å; I495-M963 HydrophobicContact CB-CE 4.38Å; I495-M963 HydrophobicContact CG2-CE 3.93Å; I495-M963 HydrophobicContact CG2-SD 3.8Å; I495-T966 HydrophobicContact CD1-CG2 4.23Å; I495-T966 HydrophobicContact CG2-CG2 4.29Å; I495-Y967 HydrophobicContact CD1-CD2 4.48Å
496	T	97.2	Very high	94.1	Very high	0 Å²	0	38.1 Å²	38.1	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	136.8	-178.9	-169.7	0	0	0	0	111.5	V482 M498 L507 W513 D520 A521 I522	V482-T496 HydrophobicContact CG2-CG2 4.34Å; T496-M498 HydrophobicContact CG2-CG 4.22Å; T496-M498 HydrophobicContact CG2-SD 4.11Å; T496-L507 HydrophobicContact CG2-CD1 3.69Å; T496-W513 HydrophobicContact CG2-CH2 4.07Å; T496-D520 PolarHBondContact N-O 3.03Å; T496-A521 HydrophobicContact CG2-CB 4.24Å; T496-I522 PolarHBondContact O-N 3.37Å
497	Q	96	Very high	94	Very high	2 Å²	2	37.9 Å²	37.9	1%	0.009	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	141.4	160.5	-66.2	-179.2	-40.1	0	0	109.1	I462 A464 I522 D960 M963	I462-Q497 PolarHBondContact O-N 3.06Å; A464-Q497 HydrophobicContact CB-CB 3.75Å; Q497-I522 WeakPolarHBondContact CA-O 3.32Å; Q497-D960 PolarHBondContact NE2-OD1 3.43Å; Q497-D960 VanDerWaalsContact NE2-OD1 3.11Å; Q497-M963 HydrophobicContact CG-CE 4.3Å; Q497-M963 HydrophobicContact CG-CG 3.96Å; Q497-M963 HydrophobicContact CG-SD 3.52Å; Q497-M963 VanDerWaalsContact CG-SD 3.52Å
498	M	94.8	Very high	93.5	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	138.3	169.4	-62.5	-59.9	-63	0	0	107.9	D475 N478 I479 T496 N503 L507 A521 I522 C523 L524	D475-M498 HydrophobicContact CB-CE 3.72Å; D475-M498 WeakPolarHBondContact OD1-CA 3.21Å; N478-M498 HydrophobicContact CB-SD 4.4Å; I479-M498 HydrophobicContact CD1-CE 3.86Å; I479-M498 HydrophobicContact CG1-CE 3.91Å; T496-M498 HydrophobicContact CG2-CG 4.22Å; T496-M498 HydrophobicContact CG2-SD 4.11Å; M498-N503 HydrophobicContact CE-CB 3.61Å; M498-L507 HydrophobicContact CG-CD1 4.04Å; M498-L507 HydrophobicContact SD-CD1 3.94Å; M498-A521 HydrophobicContact CG-CB 4.43Å; M498-I522 PolarHBondContact N-O 3.2Å; M498-C523 HydrophobicContact CB-CB 4.48Å; M498-C523 CarbonylContact O-C 3.57Å; M498-C523 VanDerWaalsContact O-CA 3.29Å; M498-C523 WeakPolarHBondContact O-CA 3.31Å; M498-L524 PolarHBondContact O-N 3.46Å
499	L	92.9	Very high	93.2	Very high	16 Å²	16	35.9 Å²	35.9	8%	0.084	18%	0.178	C	C	.	.	S	Bend	trans	-81.3	-49.3	180	-56.9	177.4	0	0	0	109.9	A464 C468 P471 E474 D475 L524 A525	A464-L499 HydrophobicContact CB-CD2 4.08Å; A464-L499 HydrophobicContact CB-CG 4.41Å; C468-L499 WeakPolarHBondContact SG-CD1 3.4Å; P471-L499 HydrophobicContact CB-CB 3.99Å; P471-L499 HydrophobicContact CB-CD1 3.82Å; E474-L499 HydrophobicContact CB-CD1 4.26Å; D475-L499 PolarHBondContact OD1-N 3.27Å; D475-L499 PolarHBondContact OD2-N 3.03Å; L499-L524 HydrophobicContact CD2-CD1 3.99Å; L499-A525 WeakPolarHBondContact O-CB 3.29Å; L499-A525 PolarHBondContact O-N 2.78Å
500	Q	91.6	Very high	93	Very high	11 Å²	11	34 Å²	34	5%	0.051	17%	0.17	C	C	.	.	S	Bend	trans	-104.6	151.5	-175.8	-63.5	-65.9	-18.3	0	0	113.7	P471 D475 H502 L770	P471-Q500 HydrophobicContact CB-CG 4.1Å; D475-Q500 PolarHBondContact OD2-N 3.17Å; Q500-H502 VanDerWaalsContact CB-CE1 3.48Å; Q500-H502 WeakPolarHBondContact CB-CE1 3.4Å; Q500-L770 PolarHBondContact NE2-O 2.85Å
501	Y	90.2	Very high	92.9	Very high	21 Å²	21	37 Å²	37	8%	0.082	19%	0.19	C	C	.	.	H	α-helix	trans	-75.3	-38	-178.5	-176.6	-83.5	0	0	0	113.1	N503 K504 E526 L992	Y501-N503 PolarHBondContact O-N 3.06Å; Y501-K504 WeakPolarHBondContact O-CB 3.41Å; Y501-K504 PolarHBondContact O-N 3.33Å; Y501-E526 HydrophobicContact CD2-CB 4.03Å; Y501-E526 HydrophobicContact CD2-CG 3.92Å; Y501-E526 HydrophobicContact CE2-CG 4.11Å; Y501-L992 HydrophobicContact CE1-CD1 4.14Å
502	H	87.7	Confident	92.9	Very high	56 Å²	56	31.6 Å²	31.6	26%	0.259	17%	0.172	S	C	.	.	H	α-helix	trans	-65.5	-38.2	-179.7	48.3	-87.7	0	0	0	112.3	D472 Q500 K504 A505	D472-H502 IonicContact OD1-CD2 3.7Å; D472-H502 IonicContact OD1-CE1 3.89Å; D472-H502 IonicContact OD1-NE2 2.77Å; D472-H502 PolarHBondContact OD1-NE2 3.27Å; D472-H502 IonicContact OD2-NE2 3.27Å; Q500-H502 VanDerWaalsContact CB-CE1 3.48Å; Q500-H502 WeakPolarHBondContact CB-CE1 3.4Å; H502-K504 PolarHBondContact O-N 2.86Å; H502-A505 VanDerWaalsContact O-CB 3.32Å; H502-A505 WeakPolarHBondContact O-CB 3.31Å; H502-A505 PolarHBondContact O-N 2.92Å; H502-A505 VanDerWaalsContact O-N 3.1Å
503	N	92	Very high	92.8	Very high	13 Å²	13	32.6 Å²	32.6	7%	0.07	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-31.2	178.6	-66.5	-30.2	0	0	0	112.7	D472 D475 I479 M498 Y501 A505 H506	D472-N503 PolarHBondContact OD1-ND2 3.3Å; D475-N503 HydrophobicContact CB-CB 3.84Å; D475-N503 VanDerWaalsContact CB-ND2 3.25Å; D475-N503 WeakPolarHBondContact CB-ND2 3.35Å; D475-N503 WeakPolarHBondContact OD2-CB 3.27Å; D475-N503 PolarHBondContact OD2-ND2 3.17Å; I479-N503 HydrophobicContact CD1-CB 4.26Å; M498-N503 HydrophobicContact CE-CB 3.61Å; Y501-N503 PolarHBondContact O-N 3.06Å; N503-A505 PolarHBondContact O-N 3.48Å; N503-H506 WeakPolarHBondContact O-CB 3.49Å; N503-H506 PolarHBondContact O-N 2.87Å
504	K	90.6	Very high	92.5	Very high	12 Å²	12	33.8 Å²	33.8	5%	0.052	18%	0.183	C	C	.	.	H	α-helix	trans	-54.5	-35.1	174.6	-163.2	-167.5	-174.6	-170.7	0	112.8	Y501 H502 H506 L507 A521 C523 E526 E989	Y501-K504 WeakPolarHBondContact O-CB 3.41Å; Y501-K504 PolarHBondContact O-N 3.33Å; H502-K504 PolarHBondContact O-N 2.86Å; K504-H506 PolarHBondContact O-N 2.88Å; K504-L507 WeakPolarHBondContact O-CB 3.48Å; K504-L507 PolarHBondContact O-N 2.86Å; K504-L507 VanDerWaalsContact O-N 3.12Å; K504-A521 WeakPolarHBondContact CE-O 3.46Å; K504-A521 HydrophobicContact CG-CB 3.92Å; K504-C523 HydrophobicContact CD-CB 4.22Å; K504-E526 IonicContact NZ-OE1 3.26Å; K504-E526 IonicContact NZ-OE2 2.74Å; K504-E526 PolarHBondContact NZ-OE2 3.12Å; K504-E989 IonicContact NZ-OE1 3.86Å; K504-E989 PolarHBondContact NZ-OE1 3.07Å
505	A	88.2	Confident	91.9	Very high	19 Å²	19	39.9 Å²	39.9	16%	0.157	21%	0.207	C	C	.	.	H	α-helix	trans	-63.2	-26.6	178.3	0	0	0	0	0	112.9	H502 N503 L507 L508 N509 A993	H502-A505 VanDerWaalsContact O-CB 3.32Å; H502-A505 WeakPolarHBondContact O-CB 3.31Å; H502-A505 PolarHBondContact O-N 2.92Å; H502-A505 VanDerWaalsContact O-N 3.1Å; N503-A505 PolarHBondContact O-N 3.48Å; A505-L507 VanDerWaalsContact C-N 3.27Å; A505-L507 PolarHBondContact O-N 2.87Å; A505-L508 PolarHBondContact O-N 3.31Å; A505-N509 PolarHBondContact O-ND2 3.43Å; A505-A993 HydrophobicContact CB-CB 3.79Å
506	H	91	Very high	91.3	Very high	98 Å²	98	45.8 Å²	45.8	45%	0.454	23%	0.232	S	C	.	.	H	α-helix	trans	-68.2	-25.1	176.4	-59.2	-39.5	0	0	0	113	I479 N503 K504 N509	I479-H506 HydrophobicContact CD1-CB 3.91Å; N503-H506 WeakPolarHBondContact O-CB 3.49Å; N503-H506 PolarHBondContact O-N 2.87Å; K504-H506 PolarHBondContact O-N 2.88Å; H506-N509 PolarHBondContact O-N 3.46Å
507	L	93.3	Very high	90.7	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.005	26%	0.258	C	S	.	.	H	α-helix	trans	-69.3	-39.3	174.6	-60.5	173.8	0	0	0	111.6	I479 V482 T496 M498 K504 A505 N509 I510 W513 A521	I479-L507 HydrophobicContact CB-CD2 4.46Å; I479-L507 HydrophobicContact CG1-CD2 3.86Å; I479-L507 HydrophobicContact CG1-CG 4.37Å; V482-L507 HydrophobicContact CB-CD2 4.19Å; V482-L507 HydrophobicContact CG1-CD2 4.13Å; V482-L507 HydrophobicContact CG2-CD2 3.97Å; T496-L507 HydrophobicContact CG2-CD1 3.69Å; M498-L507 HydrophobicContact CG-CD1 4.04Å; M498-L507 HydrophobicContact SD-CD1 3.94Å; K504-L507 WeakPolarHBondContact O-CB 3.48Å; K504-L507 PolarHBondContact O-N 2.86Å; K504-L507 VanDerWaalsContact O-N 3.12Å; A505-L507 VanDerWaalsContact C-N 3.27Å; A505-L507 PolarHBondContact O-N 2.87Å; L507-N509 PolarHBondContact O-N 2.84Å; L507-I510 HydrophobicContact CD2-CD1 4.02Å; L507-I510 WeakPolarHBondContact O-CB 3.33Å; L507-I510 PolarHBondContact O-N 3.03Å; L507-W513 HydrophobicContact CB-CD2 4.15Å; L507-W513 HydrophobicContact CB-CE3 4.39Å; L507-W513 HydrophobicContact CD1-CH2 4.17Å; L507-W513 HydrophobicContact CD1-CZ2 4.33Å; L507-W513 HydrophobicContact CD1-CZ3 4.48Å; L507-W513 HydrophobicContact CD2-CZ3 4.48Å; L507-W513 WeakPolarHBondContact O-CB 3.42Å; L507-A521 HydrophobicContact CD1-CB 3.59Å
508	L	88	Confident	90.3	Very high	70 Å²	70	51.3 Å²	51.3	37%	0.366	26%	0.259	S	S	.	.	H	α-helix	trans	-63.7	-21.4	176.9	-59.9	178.3	0	0	0	113.1	A505 I510 E989	A505-L508 PolarHBondContact O-N 3.31Å; L508-I510 VanDerWaalsContact C-N 3.32Å; L508-E989 HydrophobicContact CD1-CB 4.12Å
509	N	89.6	Confident	90.3	Very high	111 Å²	111	51.5 Å²	51.5	59%	0.594	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.6	175	-66.5	-41.1	0	0	0	113.5	A505 H506 L507	A505-N509 PolarHBondContact O-ND2 3.43Å; H506-N509 PolarHBondContact O-N 3.46Å; L507-N509 PolarHBondContact O-N 2.84Å
510	I	93.1	Very high	90.4	Very high	21 Å²	21	51.6 Å²	51.6	11%	0.108	26%	0.261	C	S	.	.	S	Bend	trans	-80.9	119.5	177	-58.7	172.9	0	0	0	108.4	V482 I483 L507 L508 S512 W513	V482-I510 HydrophobicContact CB-CD1 4.45Å; V482-I510 HydrophobicContact CG1-CD1 3.81Å; I483-I510 HydrophobicContact CD1-CD1 4.43Å; I483-I510 HydrophobicContact CG1-CD1 3.66Å; I483-I510 HydrophobicContact CG1-CG1 4.15Å; L507-I510 HydrophobicContact CD2-CD1 4.02Å; L507-I510 WeakPolarHBondContact O-CB 3.33Å; L507-I510 PolarHBondContact O-N 3.03Å; L508-I510 VanDerWaalsContact C-N 3.32Å; I510-S512 PolarHBondContact O-N 3.37Å; I510-W513 HydrophobicContact CB-CB 4.03Å; I510-W513 HydrophobicContact CG2-CB 4.46Å; I510-W513 WeakPolarHBondContact O-CB 3.24Å; I510-W513 PolarHBondContact O-N 2.9Å
511	P	92.4	Very high	90.5	Very high	132 Å²	132	51.6 Å²	51.6	86%	0.857	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	3.8	-172.1	31	-38.3	0	0	0	114.8
512	S	94.4	Very high	90.7	Very high	45 Å²	45	50.6 Å²	50.6	32%	0.315	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.2	12.8	175.2	-55.8	0	0	0	0	112.3	K486 I510	K486-S512 WeakPolarHBondContact CD-O 3.33Å; K486-S512 WeakPolarHBondContact CE-O 3.41Å; K486-S512 PolarHBondContact NZ-O 2.59Å; K486-S512 VanDerWaalsContact NZ-O 3.14Å; I510-S512 PolarHBondContact O-N 3.37Å
513	W	94	Very high	91	Very high	28 Å²	28	48 Å²	48	11%	0.106	25%	0.247	C	C	.	.			trans	-88.1	119.6	167.5	-176.4	-86.4	0	0	0	108.9	V482 I494 T496 L507 I510 D519 A521	V482-W513 HydrophobicContact CG1-CE3 3.81Å; V482-W513 HydrophobicContact CG1-CZ3 3.83Å; V482-W513 HydrophobicContact CG2-CZ3 4.46Å; I494-W513 HydrophobicContact CB-CZ3 4.21Å; I494-W513 HydrophobicContact CG2-CZ3 4.3Å; T496-W513 HydrophobicContact CG2-CH2 4.07Å; L507-W513 HydrophobicContact CB-CD2 4.15Å; L507-W513 HydrophobicContact CB-CE3 4.39Å; L507-W513 HydrophobicContact CD1-CH2 4.17Å; L507-W513 HydrophobicContact CD1-CZ2 4.33Å; L507-W513 HydrophobicContact CD1-CZ3 4.48Å; L507-W513 HydrophobicContact CD2-CZ3 4.48Å; L507-W513 WeakPolarHBondContact O-CB 3.42Å; I510-W513 HydrophobicContact CB-CB 4.03Å; I510-W513 HydrophobicContact CG2-CB 4.46Å; I510-W513 WeakPolarHBondContact O-CB 3.24Å; I510-W513 PolarHBondContact O-N 2.9Å; W513-D519 HydrophobicContact CD2-CB 3.75Å; W513-D519 HydrophobicContact CE3-CB 4.01Å; W513-D519 HydrophobicContact CG-CB 4.28Å; W513-D519 HydrophobicContact CH2-CB 4.01Å; W513-D519 VanDerWaalsContact CZ2-C 3.42Å; W513-D519 HydrophobicContact CZ2-CB 3.77Å; W513-D519 WeakPolarHBondContact CZ2-O 3.49Å; W513-D519 HydrophobicContact CZ3-CB 4.13Å; W513-A521 HydrophobicContact CH2-CB 4.33Å; W513-A521 HydrophobicContact CZ2-CB 3.97Å
514	N	90.2	Very high	91.1	Very high	53 Å²	53	47.8 Å²	47.8	28%	0.283	25%	0.246	S	C	.	.			trans	-134.4	95.3	-175.2	-174.6	11.2	0	0	0	111.3	K516 E517 G518 D519	N514-K516 PolarHBondContact O-N 2.84Å; N514-K516 VanDerWaalsContact O-N 3.08Å; N514-K516 WeakPolarHBondContact OD1-CB 3.3Å; N514-K516 PolarHBondContact OD1-N 3.41Å; N514-E517 HydrophobicContact CB-CB 4.3Å; N514-E517 VanDerWaalsContact ND2-CD 3.27Å; N514-E517 VanDerWaalsContact ND2-CG 3.31Å; N514-E517 WeakPolarHBondContact ND2-CG 3.29Å; N514-E517 PolarHBondContact ND2-OE2 3.45Å; N514-E517 PolarHBondContact O-N 3.49Å; N514-G518 PolarHBondContact O-N 2.73Å; N514-D519 PolarHBondContact N-OD2 3.48Å; N514-D519 PolarHBondContact O-N 3.01Å
515	W	85.4	Confident	91.1	Very high	129 Å²	129	47.6 Å²	47.6	49%	0.489	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-60.1	-16.9	174.8	63.2	-93.7	0	0	0	113.8	P986	W515-P986 HydrophobicContact CH2-CB 4.5Å; W515-P986 HydrophobicContact CH2-CG 4.09Å; W515-P986 HydrophobicContact CZ2-CB 4.12Å; W515-P986 HydrophobicContact CZ2-CG 4.2Å
516	K	84	Confident	91.4	Very high	124 Å²	124	47 Å²	47	54%	0.539	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-84.3	-7.8	173.5	-58.6	-171.9	176.7	-173	0	113.4	N514 E614	N514-K516 PolarHBondContact O-N 2.84Å; N514-K516 VanDerWaalsContact O-N 3.08Å; N514-K516 WeakPolarHBondContact OD1-CB 3.3Å; N514-K516 PolarHBondContact OD1-N 3.41Å; K516-E614 IonicContact NZ-OE1 2.87Å; K516-E614 PolarHBondContact NZ-OE1 3.31Å
517	E	86.1	Confident	91.5	Very high	114 Å²	114	42.4 Å²	42.4	53%	0.533	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-110.3	15.5	169.6	-77.8	174.2	140.9	0	0	111.7	N514	N514-E517 HydrophobicContact CB-CB 4.3Å; N514-E517 VanDerWaalsContact ND2-CD 3.27Å; N514-E517 VanDerWaalsContact ND2-CG 3.31Å; N514-E517 WeakPolarHBondContact ND2-CG 3.29Å; N514-E517 PolarHBondContact ND2-OE2 3.45Å; N514-E517 PolarHBondContact O-N 3.49Å
518	G	87.6	Confident	91.5	Very high	4 Å²	4	43.2 Å²	43.2	4%	0.041	22%	0.223	C	C	.	.	T	Hydrogen-bonded Turn	trans	86.7	14.8	175	0	0	0	0	0	115.6	R493 N514 D520	R493-G518 WeakPolarHBondContact CD-O 3.13Å; R493-G518 WeakPolarHBondContact CG-O 3.27Å; R493-G518 PolarHBondContact NE-O 2.8Å; N514-G518 PolarHBondContact O-N 2.73Å; G518-D520 PolarHBondContact O-N 3.13Å; G518-D520 VanDerWaalsContact O-N 3.15Å; G518-D520 VanDerWaalsContact O-OD2 3.1Å
519	D	94.4	Very high	91.7	Very high	4 Å²	4	40.3 Å²	40.3	2%	0.021	21%	0.209	C	C	.	.			trans	-69.7	109.4	171	-71.7	-38.3	0	0	0	110.5	K486 I494 W513 N514	K486-D519 WeakPolarHBondContact CE-OD1 3.25Å; K486-D519 VanDerWaalsContact CE-OD2 3.25Å; K486-D519 WeakPolarHBondContact CE-OD2 3.11Å; K486-D519 IonicContact NZ-OD1 3Å; K486-D519 PolarHBondContact NZ-OD1 2.97Å; K486-D519 IonicContact NZ-OD2 3.64Å; K486-D519 PolarHBondContact NZ-OD2 3.39Å; I494-D519 PolarHBondContact N-OD1 3.29Å; I494-D519 CarbonylContact O-C 3.57Å; I494-D519 WeakPolarHBondContact O-CA 3.29Å; W513-D519 HydrophobicContact CD2-CB 3.75Å; W513-D519 HydrophobicContact CE3-CB 4.01Å; W513-D519 HydrophobicContact CG-CB 4.28Å; W513-D519 HydrophobicContact CH2-CB 4.01Å; W513-D519 VanDerWaalsContact CZ2-C 3.42Å; W513-D519 HydrophobicContact CZ2-CB 3.77Å; W513-D519 WeakPolarHBondContact CZ2-O 3.49Å; W513-D519 HydrophobicContact CZ3-CB 4.13Å; N514-D519 PolarHBondContact N-OD2 3.48Å; N514-D519 PolarHBondContact O-N 3.01Å
520	D	93.9	Very high	92	Very high	17 Å²	17	35 Å²	35	9%	0.091	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117	132.7	-168.2	-77.1	-56.1	0	0	0	112.2	R493 I494 I495 T496 G518 T966 L973	R493-D520 IonicContact CZ-OD2 2.69Å; R493-D520 IonicContact NE-OD2 3.31Å; R493-D520 IonicContact NH2-OD2 3.94Å; R493-D520 PolarHBondContact NH2-OD2 3.25Å; I494-D520 PolarHBondContact O-N 3.05Å; I495-D520 WeakPolarHBondContact CA-O 3.41Å; I495-D520 HydrophobicContact CG1-CB 4.37Å; I495-D520 HydrophobicContact CG2-CB 4.24Å; T496-D520 PolarHBondContact N-O 3.03Å; G518-D520 PolarHBondContact O-N 3.13Å; G518-D520 VanDerWaalsContact O-N 3.15Å; G518-D520 VanDerWaalsContact O-OD2 3.1Å; D520-T966 HydrophobicContact CB-CG2 3.77Å; D520-T966 VanDerWaalsContact OD2-CG2 3.27Å; D520-T966 WeakPolarHBondContact OD2-CG2 3.21Å; D520-L973 HydrophobicContact CB-CD2 3.88Å
521	A	94.3	Very high	92.1	Very high	12 Å²	12	34.1 Å²	34.1	10%	0.099	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	101.3	177.5	0	0	0	0	0	110.3	T496 M498 K504 L507 W513 C523	T496-A521 HydrophobicContact CG2-CB 4.24Å; M498-A521 HydrophobicContact CG-CB 4.43Å; K504-A521 WeakPolarHBondContact CE-O 3.46Å; K504-A521 HydrophobicContact CG-CB 3.92Å; L507-A521 HydrophobicContact CD1-CB 3.59Å; W513-A521 HydrophobicContact CH2-CB 4.33Å; W513-A521 HydrophobicContact CZ2-CB 3.97Å; A521-C523 PolarHBondContact O-N 3.48Å
522	I	95.1	Very high	92.2	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	96.6	-179.2	-61.5	-177.9	0	0	0	108.3	I495 T496 Q497 M498 L524 L527 L962 M963 T966 L973	I495-I522 HydrophobicContact CG2-CD1 4.11Å; T496-I522 PolarHBondContact O-N 3.37Å; Q497-I522 WeakPolarHBondContact CA-O 3.32Å; M498-I522 PolarHBondContact N-O 3.2Å; I522-L524 HydrophobicContact CG2-CD2 4.25Å; I522-L524 PolarHBondContact O-N 3.23Å; I522-L527 HydrophobicContact CG2-CD1 3.75Å; I522-L962 HydrophobicContact CD1-CG 4.16Å; I522-L962 HydrophobicContact CG2-CD2 4.14Å; I522-M963 HydrophobicContact CD1-CG 4.36Å; I522-M963 HydrophobicContact CD1-SD 3.73Å; I522-T966 HydrophobicContact CD1-CG2 4.49Å; I522-L973 HydrophobicContact CG1-CD1 4.06Å; I522-L973 HydrophobicContact CG1-CD2 3.76Å
523	C	94	Very high	92.2	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.007	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	114	176.3	-177.7	0	0	0	0	110.9	M498 K504 A521 E526 L527	M498-C523 HydrophobicContact CB-CB 4.48Å; M498-C523 CarbonylContact O-C 3.57Å; M498-C523 VanDerWaalsContact O-CA 3.29Å; M498-C523 WeakPolarHBondContact O-CA 3.31Å; K504-C523 HydrophobicContact CD-CB 4.22Å; A521-C523 PolarHBondContact O-N 3.48Å; C523-E526 HydrophobicContact CB-CB 3.63Å; C523-E526 WeakPolarHBondContact O-CB 3.37Å; C523-E526 PolarHBondContact O-N 3.47Å; C523-E526 PolarHBondContact SG-N 3.33Å; C523-L527 WeakPolarHBondContact O-CG 3.33Å; C523-L527 PolarHBondContact O-N 3.3Å; C523-L527 VanDerWaalsContact O-N 3.11Å
524	L	93.1	Very high	92.2	Very high	8 Å²	8	24.9 Å²	24.9	4%	0.042	12%	0.118	C	C	.	.	H	α-helix	trans	-67.3	-43.2	-177.6	-59.4	-173.7	0	0	0	111.5	K466 M498 L499 I522 E526 L527 K528 V956 L959	K466-L524 HydrophobicContact CD-CD1 4.04Å; K466-L524 HydrophobicContact CG-CD1 3.81Å; M498-L524 PolarHBondContact O-N 3.46Å; L499-L524 HydrophobicContact CD2-CD1 3.99Å; I522-L524 HydrophobicContact CG2-CD2 4.25Å; I522-L524 PolarHBondContact O-N 3.23Å; L524-E526 VanDerWaalsContact C-N 3.3Å; L524-E526 PolarHBondContact O-N 2.82Å; L524-L527 PolarHBondContact O-N 3.5Å; L524-K528 WeakPolarHBondContact O-CB 3.09Å; L524-K528 PolarHBondContact O-N 3.42Å; L524-V956 HydrophobicContact CD1-CG1 4.33Å; L524-L959 HydrophobicContact CD2-CB 3.85Å; L524-L959 HydrophobicContact CD2-CD1 4Å
525	A	91.8	Very high	92.5	Very high	9 Å²	9	22.4 Å²	22.4	7%	0.074	10%	0.104	C	C	.	.	H	α-helix	trans	-66.5	-27.8	175.3	0	0	0	0	0	113.6	L499 A529 N775	L499-A525 WeakPolarHBondContact O-CB 3.29Å; L499-A525 PolarHBondContact O-N 2.78Å; A525-A529 VanDerWaalsContact O-CB 3.25Å; A525-A529 WeakPolarHBondContact O-CB 3.31Å; A525-A529 PolarHBondContact O-N 3.45Å; A525-N775 PolarHBondContact O-ND2 3.45Å
526	E	93.2	Very high	92.9	Very high	6 Å²	6	16.3 Å²	16.3	3%	0.028	8%	0.081	C	C	.	.	H	α-helix	trans	-67.1	-51.4	173.6	-171.1	-174.9	159.8	0	0	110.7	Y501 K504 C523 L524 G530 R977 T981	Y501-E526 HydrophobicContact CD2-CB 4.03Å; Y501-E526 HydrophobicContact CD2-CG 3.92Å; Y501-E526 HydrophobicContact CE2-CG 4.11Å; K504-E526 IonicContact NZ-OE1 3.26Å; K504-E526 IonicContact NZ-OE2 2.74Å; K504-E526 PolarHBondContact NZ-OE2 3.12Å; C523-E526 HydrophobicContact CB-CB 3.63Å; C523-E526 WeakPolarHBondContact O-CB 3.37Å; C523-E526 PolarHBondContact O-N 3.47Å; C523-E526 PolarHBondContact SG-N 3.33Å; L524-E526 VanDerWaalsContact C-N 3.3Å; L524-E526 PolarHBondContact O-N 2.82Å; E526-G530 PolarHBondContact O-N 2.62Å; E526-G530 VanDerWaalsContact O-N 3.08Å; E526-R977 IonicContact OE1-CZ 3.05Å; E526-R977 IonicContact OE1-NE 3.67Å; E526-R977 PolarHBondContact OE1-NE 3.24Å; E526-R977 IonicContact OE1-NH2 3.94Å; E526-R977 PolarHBondContact OE1-NH2 3.41Å; E526-R977 IonicContact OE2-NE 3.45Å; E526-R977 IonicContact OE2-NH2 3.34Å; E526-T981 HydrophobicContact CG-CG2 4.12Å; E526-T981 WeakPolarHBondContact OE1-CG2 3.45Å
527	L	93.4	Very high	93.4	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-74.2	-47.3	-174.7	-68.1	172	0	0	0	112	I522 C523 L524 A529 G530 F531 L959 L962 L973 I976 R977	I522-L527 HydrophobicContact CG2-CD1 3.75Å; C523-L527 WeakPolarHBondContact O-CG 3.33Å; C523-L527 PolarHBondContact O-N 3.3Å; C523-L527 VanDerWaalsContact O-N 3.11Å; L524-L527 PolarHBondContact O-N 3.5Å; L527-A529 PolarHBondContact O-N 3.27Å; L527-G530 CarbonylContact O-C 3.55Å; L527-G530 PolarHBondContact O-N 3.31Å; L527-G530 VanDerWaalsContact O-N 3.16Å; L527-F531 HydrophobicContact CB-CD2 4.31Å; L527-F531 HydrophobicContact CB-CE2 4.02Å; L527-F531 HydrophobicContact CD2-CE2 4.46Å; L527-F531 WeakPolarHBondContact O-CD2 3.29Å; L527-F531 PolarHBondContact O-N 2.66Å; L527-L959 HydrophobicContact CB-CD1 4.23Å; L527-L959 HydrophobicContact CB-CD2 4.37Å; L527-L962 HydrophobicContact CD1-CD2 3.46Å; L527-L962 VanDerWaalsContact CD1-CD2 3.46Å; L527-L973 HydrophobicContact CD1-CD1 4.3Å; L527-I976 HydrophobicContact CD2-CG2 4.08Å; L527-R977 HydrophobicContact CD2-CG 4.19Å
528	K	93.1	Very high	93.7	Very high	18 Å²	18	6.3 Å²	6.3	8%	0.078	4%	0.038	C	C	.	.	H	α-helix	trans	-53.1	-57.3	177.5	-179.5	-176.1	78.8	161.6	0	111.5	L524 G530 F531 I532 E920 F954 V956 L959	L524-K528 WeakPolarHBondContact O-CB 3.09Å; L524-K528 PolarHBondContact O-N 3.42Å; K528-G530 VanDerWaalsContact C-N 3.26Å; K528-G530 PolarHBondContact O-N 3.05Å; K528-F531 PolarHBondContact O-N 2.9Å; K528-I532 HydrophobicContact CG-CD1 4.3Å; K528-I532 WeakPolarHBondContact O-CG1 3.47Å; K528-I532 PolarHBondContact O-N 3.47Å; K528-E920 HydrophobicContact CD-CG 4.25Å; K528-E920 WeakPolarHBondContact CD-OE1 3.47Å; K528-E920 WeakPolarHBondContact CE-OE1 3.4Å; K528-E920 WeakPolarHBondContact CE-OE2 3.32Å; K528-E920 IonicContact NZ-OE1 2.68Å; K528-E920 PolarHBondContact NZ-OE1 2.98Å; K528-E920 IonicContact NZ-OE2 2.87Å; K528-E920 PolarHBondContact NZ-OE2 3.2Å; K528-F954 HydrophobicContact CB-CE1 4.29Å; K528-F954 HydrophobicContact CG-CD1 4.23Å; K528-F954 HydrophobicContact CG-CE1 3.97Å; K528-V956 HydrophobicContact CD-CG2 3.83Å; K528-L959 HydrophobicContact CB-CD1 4.32Å
529	A	93.5	Very high	94	Very high	8 Å²	8	8.3 Å²	8.3	7%	0.066	5%	0.046	C	C	.	.	H	α-helix	trans	-64.5	-33.7	179.8	0	0	0	0	0	111.8	A525 L527 A533 N775 L776	A525-A529 VanDerWaalsContact O-CB 3.25Å; A525-A529 WeakPolarHBondContact O-CB 3.31Å; A525-A529 PolarHBondContact O-N 3.45Å; L527-A529 PolarHBondContact O-N 3.27Å; A529-A533 VanDerWaalsContact O-CB 3.24Å; A529-A533 WeakPolarHBondContact O-CB 3.49Å; A529-A533 PolarHBondContact O-N 3.31Å; A529-N775 HydrophobicContact CB-CB 3.71Å; A529-L776 HydrophobicContact CB-CB 4.17Å; A529-L776 WeakPolarHBondContact O-CD1 3.49Å
530	G	94.4	Very high	94	Very high	1 Å²	1	8.1 Å²	8.1	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-66.8	-46	175.4	0	0	0	0	0	114.3	E526 L527 K528 I532 A533 Q534 V980	E526-G530 PolarHBondContact O-N 2.62Å; E526-G530 VanDerWaalsContact O-N 3.08Å; L527-G530 CarbonylContact O-C 3.55Å; L527-G530 PolarHBondContact O-N 3.31Å; L527-G530 VanDerWaalsContact O-N 3.16Å; K528-G530 VanDerWaalsContact C-N 3.26Å; K528-G530 PolarHBondContact O-N 3.05Å; G530-I532 VanDerWaalsContact C-N 3.29Å; G530-I532 PolarHBondContact O-N 3.47Å; G530-A533 WeakPolarHBondContact O-CB 3.48Å; G530-A533 PolarHBondContact O-N 3.49Å; G530-A533 VanDerWaalsContact O-N 3.16Å; G530-Q534 WeakPolarHBondContact O-CG 3.34Å; G530-Q534 PolarHBondContact O-N 2.99Å; G530-V980 VanDerWaalsContact CA-CG1 3.5Å
531	F	94.9	Very high	94	Very high	1 Å²	1	7.3 Å²	7.3	0%	0.004	4%	0.04	C	C	.	.	H	α-helix	trans	-62.2	-39.4	177.3	-74.7	-61	0	0	0	111.4	L527 K528 S535 L545 F549 F954 L959 I976 V980	L527-F531 HydrophobicContact CB-CD2 4.31Å; L527-F531 HydrophobicContact CB-CE2 4.02Å; L527-F531 HydrophobicContact CD2-CE2 4.46Å; L527-F531 WeakPolarHBondContact O-CD2 3.29Å; L527-F531 PolarHBondContact O-N 2.66Å; K528-F531 PolarHBondContact O-N 2.9Å; F531-S535 WeakPolarHBondContact O-CB 3.47Å; F531-S535 PolarHBondContact O-N 3.38Å; F531-S535 PolarHBondContact O-OG 2.92Å; F531-L545 HydrophobicContact CD1-CB 4.08Å; F531-L545 HydrophobicContact CD1-CD1 3.98Å; F531-L545 HydrophobicContact CE1-CB 3.56Å; F531-L545 HydrophobicContact CE1-CD1 3.77Å; F531-L545 HydrophobicContact CE1-CG 4.32Å; F531-F549 HydrophobicContact CE1-CE1 4.33Å; F531-F549 HydrophobicContact CE2-CE1 4.37Å; F531-F549 HydrophobicContact CE2-CZ 4.29Å; F531-F549 AromaticContact CZ-CE1 3.69Å; F531-F549 HydrophobicContact CZ-CE1 3.69Å; F531-F549 HydrophobicContact CZ-CZ 4.06Å; F531-F954 HydrophobicContact CB-CE2 3.99Å; F531-F954 HydrophobicContact CB-CZ 4.04Å; F531-F954 HydrophobicContact CD2-CE2 4.25Å; F531-F954 AromaticContact CD2-CZ 3.8Å; F531-F954 HydrophobicContact CD2-CZ 3.8Å; F531-F954 HydrophobicContact CG-CE2 4.27Å; F531-F954 HydrophobicContact CG-CZ 4.21Å; F531-L959 HydrophobicContact CD2-CD2 4.08Å; F531-L959 HydrophobicContact CE2-CD2 3.64Å; F531-I976 HydrophobicContact CE1-CG2 4.26Å; F531-I976 HydrophobicContact CZ-CG2 3.72Å; F531-V980 HydrophobicContact CD1-CG1 4.3Å; F531-V980 HydrophobicContact CD1-CG2 3.89Å; F531-V980 HydrophobicContact CE1-CG2 3.56Å; F531-V980 HydrophobicContact CG-CG1 4.44Å; F531-V980 HydrophobicContact CZ-CG2 4.2Å
532	I	95.6	Very high	94	Very high	1 Å²	1	6.7 Å²	6.7	1%	0.005	4%	0.036	C	C	.	.	H	α-helix	trans	-65.7	-43.8	172.9	-65.8	171.9	0	0	0	110.7	K528 G530 Q534 S535 C536 L776 V840 L842 I918 F954	K528-I532 HydrophobicContact CG-CD1 4.3Å; K528-I532 WeakPolarHBondContact O-CG1 3.47Å; K528-I532 PolarHBondContact O-N 3.47Å; G530-I532 VanDerWaalsContact C-N 3.29Å; G530-I532 PolarHBondContact O-N 3.47Å; I532-Q534 PolarHBondContact O-N 2.91Å; I532-S535 WeakPolarHBondContact O-CB 3.39Å; I532-S535 PolarHBondContact O-N 2.9Å; I532-S535 VanDerWaalsContact O-N 3.15Å; I532-C536 PolarHBondContact O-N 2.75Å; I532-C536 PolarHBondContact O-SG 2.82Å; I532-L776 HydrophobicContact CB-CD1 4.2Å; I532-L776 HydrophobicContact CG2-CD1 3.73Å; I532-V840 HydrophobicContact CG2-CB 4.35Å; I532-V840 HydrophobicContact CG2-CG1 3.45Å; I532-V840 VanDerWaalsContact CG2-CG1 3.45Å; I532-V840 HydrophobicContact CG2-CG2 3.93Å; I532-L842 HydrophobicContact CD1-CD2 3.99Å; I532-I918 HydrophobicContact CG1-CD1 4.15Å; I532-I918 HydrophobicContact CG2-CG2 3.99Å; I532-F954 HydrophobicContact CD1-CD1 4.33Å; I532-F954 HydrophobicContact CG1-CB 4.49Å; I532-F954 HydrophobicContact CG1-CD1 4.37Å; I532-F954 HydrophobicContact CG1-CG 4.47Å
533	A	95.3	Very high	94	Very high	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-60.3	-44.9	176.8	0	0	0	0	0	112.8	A529 G530 S535 C536 L776 P779 L780	A529-A533 VanDerWaalsContact O-CB 3.24Å; A529-A533 WeakPolarHBondContact O-CB 3.49Å; A529-A533 PolarHBondContact O-N 3.31Å; G530-A533 WeakPolarHBondContact O-CB 3.48Å; G530-A533 PolarHBondContact O-N 3.49Å; G530-A533 VanDerWaalsContact O-N 3.16Å; A533-S535 VanDerWaalsContact C-N 3.3Å; A533-S535 PolarHBondContact O-N 3.26Å; A533-C536 WeakPolarHBondContact O-CB 3.43Å; A533-C536 PolarHBondContact O-N 3.01Å; A533-L776 HydrophobicContact CB-CD1 4.11Å; A533-L776 WeakPolarHBondContact CB-O 3.13Å; A533-P779 HydrophobicContact CB-CB 3.96Å; A533-P779 HydrophobicContact CB-CG 3.93Å; A533-L780 HydrophobicContact CB-CG 4.16Å; A533-L780 WeakPolarHBondContact O-CD2 3.4Å
534	Q	93.9	Very high	94	Very high	10 Å²	10	6.7 Å²	6.7	5%	0.047	4%	0.035	C	C	.	.	H	α-helix	trans	-67.4	-32.5	175.1	-63.5	-61.5	-32.6	0	0	111.9	G530 I532 C536 L537 A538 L541 L979 V980	G530-Q534 WeakPolarHBondContact O-CG 3.34Å; G530-Q534 PolarHBondContact O-N 2.99Å; I532-Q534 PolarHBondContact O-N 2.91Å; Q534-C536 VanDerWaalsContact C-N 3.25Å; Q534-C536 PolarHBondContact O-N 3.09Å; Q534-L537 WeakPolarHBondContact O-CA 3.28Å; Q534-L537 WeakPolarHBondContact O-CB 3.34Å; Q534-L537 PolarHBondContact O-N 3.16Å; Q534-A538 PolarHBondContact O-N 3.46Å; Q534-L541 HydrophobicContact CB-CD2 3.62Å; Q534-L541 HydrophobicContact CG-CD2 4.36Å; Q534-L979 PolarHBondContact NE2-O 3.44Å; Q534-V980 HydrophobicContact CG-CG1 4.48Å; Q534-V980 PolarHBondContact NE2-O 3.39Å
535	S	95.6	Very high	94	Very high	1 Å²	1	6.6 Å²	6.6	1%	0.007	4%	0.035	C	C	.	.	H	α-helix	trans	-67.4	-25.8	174.8	-57.7	0	0	0	0	113	F531 I532 A533 L537 A538 Q539 S542	F531-S535 WeakPolarHBondContact O-CB 3.47Å; F531-S535 PolarHBondContact O-N 3.38Å; F531-S535 PolarHBondContact O-OG 2.92Å; I532-S535 WeakPolarHBondContact O-CB 3.39Å; I532-S535 PolarHBondContact O-N 2.9Å; I532-S535 VanDerWaalsContact O-N 3.15Å; A533-S535 VanDerWaalsContact C-N 3.3Å; A533-S535 PolarHBondContact O-N 3.26Å; S535-L537 PolarHBondContact O-N 3.23Å; S535-A538 WeakPolarHBondContact CA-O 3.36Å; S535-A538 CarbonylContact O-C 3.59Å; S535-Q539 WeakPolarHBondContact O-CA 3.45Å; S535-Q539 PolarHBondContact O-N 3.24Å; S535-S542 WeakPolarHBondContact OG-CB 3.31Å; S535-S542 PolarHBondContact OG-N 2.74Å; S535-S542 PolarHBondContact OG-OG 2.91Å
536	C	94.9	Very high	94	Very high	1 Å²	1	6.2 Å²	6.2	1%	0.007	3%	0.032	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-11.8	168.8	-58.2	0	0	0	0	113.5	I532 A533 Q534 V758 L780 K791 M838 V840	I532-C536 PolarHBondContact O-N 2.75Å; I532-C536 PolarHBondContact O-SG 2.82Å; A533-C536 WeakPolarHBondContact O-CB 3.43Å; A533-C536 PolarHBondContact O-N 3.01Å; Q534-C536 VanDerWaalsContact C-N 3.25Å; Q534-C536 PolarHBondContact O-N 3.09Å; C536-V758 HydrophobicContact CB-CG2 4.05Å; C536-L780 HydrophobicContact CB-CD1 4.45Å; C536-L780 HydrophobicContact CB-CD2 4.1Å; C536-K791 WeakPolarHBondContact O-CE 3.34Å; C536-K791 PolarHBondContact O-NZ 2.98Å; C536-M838 HydrophobicContact CB-CB 4.07Å; C536-M838 HydrophobicContact CB-CG 4.33Å; C536-M838 VanDerWaalsContact SG-CG 3.6Å; C536-V840 WeakPolarHBondContact SG-CG2 3.44Å
537	L	92.5	Very high	93.9	Very high	29 Å²	29	6 Å²	6	15%	0.152	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-39.9	173.8	-59.9	171	0	0	0	111.4	Q534 S535 L780 F785	Q534-L537 WeakPolarHBondContact O-CA 3.28Å; Q534-L537 WeakPolarHBondContact O-CB 3.34Å; Q534-L537 PolarHBondContact O-N 3.16Å; S535-L537 PolarHBondContact O-N 3.23Å; L537-L780 HydrophobicContact CD1-CD2 4.29Å; L537-L780 HydrophobicContact CD2-CD2 3.75Å; L537-L780 HydrophobicContact CG-CD2 3.8Å; L537-F785 HydrophobicContact CD1-CE2 3.97Å; L537-F785 HydrophobicContact CD1-CZ 3.79Å; L537-F785 HydrophobicContact CD2-CE1 4.35Å; L537-F785 HydrophobicContact CD2-CE2 4.36Å; L537-F785 HydrophobicContact CD2-CZ 3.86Å; L537-F785 HydrophobicContact CG-CZ 4.4Å
538	A	94.1	Very high	93.8	Very high	0 Å²	0	6 Å²	6	0%	0	3%	0.031	C	C	.	.	S	Bend	trans	-142.8	105.2	176.7	0	0	0	0	0	110.1	Q534 S535 G540 L541 V1016 Q1018 F1089	Q534-A538 PolarHBondContact O-N 3.46Å; S535-A538 WeakPolarHBondContact CA-O 3.36Å; S535-A538 CarbonylContact O-C 3.59Å; A538-G540 PolarHBondContact O-N 2.89Å; A538-L541 WeakPolarHBondContact O-CB 3.41Å; A538-L541 PolarHBondContact O-N 3.36Å; A538-V1016 HydrophobicContact CB-CG1 3.91Å; A538-Q1018 HydrophobicContact CB-CG 3.86Å; A538-F1089 HydrophobicContact CB-CD1 4.15Å; A538-F1089 HydrophobicContact CB-CE1 4.11Å
539	Q	93.9	Very high	93.3	Very high	45 Å²	45	5.6 Å²	5.6	21%	0.21	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	136.5	-173.3	-173.6	179.6	2.9	0	0	111.3	S535 M838 Q1018 Y1054 F1089	S535-Q539 WeakPolarHBondContact O-CA 3.45Å; S535-Q539 PolarHBondContact O-N 3.24Å; Q539-M838 HydrophobicContact CB-CE 3.95Å; Q539-M838 HydrophobicContact CG-CE 3.76Å; Q539-Q1018 VanDerWaalsContact N-OE1 3.16Å; Q539-Q1018 PolarHBondContact O-NE2 3.12Å; Q539-Y1054 HydrophobicContact CB-CE1 3.95Å; Q539-Y1054 VanDerWaalsContact CD-OH 3.27Å; Q539-Y1054 HydrophobicContact CG-CE1 4.06Å; Q539-Y1054 WeakPolarHBondContact CG-OH 3.26Å; Q539-Y1054 PolarHBondContact NE2-OH 3.34Å; Q539-F1089 WeakPolarHBondContact O-CE1 3.42Å; Q539-F1089 WeakPolarHBondContact O-CZ 3.43Å
540	G	93.2	Very high	92.8	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.1	-4.5	-175.6	0	0	0	0	0	115.4	A538 S542 T543 M544 V1072	A538-G540 PolarHBondContact O-N 2.89Å; G540-S542 VanDerWaalsContact C-N 3.28Å; G540-S542 PolarHBondContact O-N 2.9Å; G540-T543 PolarHBondContact O-N 2.93Å; G540-M544 PolarHBondContact O-N 3.12Å; G540-V1072 WeakPolarHBondContact O-CG2 3.42Å
541	L	94.5	Very high	92.1	Very high	0 Å²	0	6.4 Å²	6.4	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-65.8	-30	178.4	-160.8	80.3	0	0	0	113.1	Q534 A538 M544 L545 V1016 F1051 F1089	Q534-L541 HydrophobicContact CB-CD2 3.62Å; Q534-L541 HydrophobicContact CG-CD2 4.36Å; A538-L541 WeakPolarHBondContact O-CB 3.41Å; A538-L541 PolarHBondContact O-N 3.36Å; L541-M544 HydrophobicContact CD1-SD 4.1Å; L541-M544 PolarHBondContact O-N 3.34Å; L541-L545 HydrophobicContact CD2-CD1 3.9Å; L541-L545 HydrophobicContact CG-CD1 3.96Å; L541-L545 HydrophobicContact CG-CG 4.15Å; L541-L545 WeakPolarHBondContact O-CG 3.37Å; L541-L545 PolarHBondContact O-N 3.41Å; L541-V1016 HydrophobicContact CD1-CG1 3.91Å; L541-V1016 HydrophobicContact CD2-CB 4.3Å; L541-V1016 HydrophobicContact CD2-CG1 3.85Å; L541-V1016 HydrophobicContact CD2-CG2 4.06Å; L541-V1016 HydrophobicContact CG-CG1 4.47Å; L541-F1051 HydrophobicContact CD1-CE2 3.7Å; L541-F1051 HydrophobicContact CD1-CZ 3.77Å; L541-F1089 HydrophobicContact CB-CE1 4.26Å; L541-F1089 HydrophobicContact CD1-CD1 3.85Å; L541-F1089 HydrophobicContact CD1-CE1 4.08Å
542	S	94.5	Very high	91.3	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-55.1	-56.4	172.6	48.7	0	0	0	0	111.8	S535 G540 L545 A546	S535-S542 WeakPolarHBondContact OG-CB 3.31Å; S535-S542 PolarHBondContact OG-N 2.74Å; S535-S542 PolarHBondContact OG-OG 2.91Å; G540-S542 VanDerWaalsContact C-N 3.28Å; G540-S542 PolarHBondContact O-N 2.9Å; S542-L545 PolarHBondContact O-N 3.12Å; S542-A546 VanDerWaalsContact O-CB 3.27Å; S542-A546 WeakPolarHBondContact O-CB 3.47Å; S542-A546 PolarHBondContact O-N 3.49Å
543	T	94.5	Very high	90.1	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-57	-47.9	175.4	-53.6	0	0	0	0	111.6	G540 L545 A546 N547 Y566 F948 G951 V1072	G540-T543 PolarHBondContact O-N 2.93Å; T543-L545 PolarHBondContact O-N 2.76Å; T543-A546 PolarHBondContact O-N 2.87Å; T543-N547 WeakPolarHBondContact O-CB 3.27Å; T543-N547 PolarHBondContact O-N 2.86Å; T543-N547 PolarHBondContact O-OD1 3.47Å; T543-Y566 HydrophobicContact CG2-CE2 4.23Å; T543-F948 WeakPolarHBondContact CB-O 3.19Å; T543-F948 HydrophobicContact CG2-CD1 3.87Å; T543-F948 HydrophobicContact CG2-CE1 3.73Å; T543-F948 HydrophobicContact CG2-CZ 4.49Å; T543-F948 WeakPolarHBondContact CG2-O 3.39Å; T543-F948 PolarHBondContact OG1-O 2.89Å; T543-G951 VanDerWaalsContact OG1-CA 3.26Å; T543-G951 WeakPolarHBondContact OG1-CA 3.5Å; T543-V1072 HydrophobicContact CG2-CB 4.44Å; T543-V1072 HydrophobicContact CG2-CG2 4.27Å
544	M	94.4	Very high	89.3	Confident	0 Å²	0	15.8 Å²	15.8	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-53.2	-52.9	177.3	171.9	157.9	-60.6	0	0	111.6	G540 L541 L548 F1051 V1072 T1074 F1089	G540-M544 PolarHBondContact O-N 3.12Å; L541-M544 HydrophobicContact CD1-SD 4.1Å; L541-M544 PolarHBondContact O-N 3.34Å; M544-L548 WeakPolarHBondContact O-CG 3.26Å; M544-F1051 HydrophobicContact SD-CD2 3.44Å; M544-F1051 WeakPolarHBondContact SD-CD2 3.36Å; M544-F1051 HydrophobicContact SD-CE2 3.31Å; M544-F1051 WeakPolarHBondContact SD-CE2 3.38Å; M544-F1051 HydrophobicContact SD-CZ 4.5Å; M544-V1072 HydrophobicContact CB-CG1 3.86Å; M544-V1072 HydrophobicContact CE-CG1 3.6Å; M544-T1074 HydrophobicContact CB-CG2 4.42Å; M544-T1074 HydrophobicContact CE-CG2 3.9Å; M544-T1074 HydrophobicContact CG-CG2 3.55Å; M544-T1074 HydrophobicContact SD-CG2 4.08Å; M544-F1089 HydrophobicContact CE-CB 4.41Å; M544-F1089 HydrophobicContact CE-CD2 3.33Å; M544-F1089 HydrophobicContact CE-CE2 3.53Å; M544-F1089 HydrophobicContact CE-CG 3.91Å; M544-F1089 HydrophobicContact CE-CZ 4.28Å; M544-F1089 HydrophobicContact SD-CB 4.43Å; M544-F1089 HydrophobicContact SD-CD2 4.21Å; M544-F1089 HydrophobicContact SD-CG 4.2Å
545	L	92.5	Very high	88.7	Confident	7 Å²	7	18.8 Å²	18.8	4%	0.037	10%	0.095	C	C	.	.	H	α-helix	trans	-73.2	-35.7	-176.5	-64	175.2	0	0	0	112	F531 L541 S542 T543 N547 L548 F549 L979 V980	F531-L545 HydrophobicContact CD1-CB 4.08Å; F531-L545 HydrophobicContact CD1-CD1 3.98Å; F531-L545 HydrophobicContact CE1-CB 3.56Å; F531-L545 HydrophobicContact CE1-CD1 3.77Å; F531-L545 HydrophobicContact CE1-CG 4.32Å; L541-L545 HydrophobicContact CD2-CD1 3.9Å; L541-L545 HydrophobicContact CG-CD1 3.96Å; L541-L545 HydrophobicContact CG-CG 4.15Å; L541-L545 WeakPolarHBondContact O-CG 3.37Å; L541-L545 PolarHBondContact O-N 3.41Å; S542-L545 PolarHBondContact O-N 3.12Å; T543-L545 PolarHBondContact O-N 2.76Å; L545-N547 VanDerWaalsContact C-N 3.29Å; L545-N547 PolarHBondContact O-N 3.15Å; L545-L548 HydrophobicContact CD2-CD1 4.13Å; L545-L548 PolarHBondContact O-N 3.14Å; L545-F549 WeakPolarHBondContact O-CD1 3.4Å; L545-F549 WeakPolarHBondContact O-CE1 3.32Å; L545-L979 HydrophobicContact CD1-CD2 4Å; L545-L979 HydrophobicContact CD2-CD2 3.83Å; L545-V980 HydrophobicContact CD1-CG2 3.89Å
546	A	92	Very high	88	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-61	-36.7	175.5	0	0	0	0	0	112.7	S542 T543 L548 F549 F948 V958	S542-A546 VanDerWaalsContact O-CB 3.27Å; S542-A546 WeakPolarHBondContact O-CB 3.47Å; S542-A546 PolarHBondContact O-N 3.49Å; T543-A546 PolarHBondContact O-N 2.87Å; A546-L548 VanDerWaalsContact C-N 3.33Å; A546-L548 PolarHBondContact O-N 3.12Å; A546-F549 HydrophobicContact CB-CZ 4.34Å; A546-F948 HydrophobicContact CB-CZ 4.03Å; A546-V958 HydrophobicContact CB-CB 4.43Å; A546-V958 HydrophobicContact CB-CG2 4.17Å
547	N	92.1	Very high	87.5	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-68.1	-32	177.1	-67.6	-5.7	0	0	0	112.3	T543 L545 F549 R552 Y566	T543-N547 WeakPolarHBondContact O-CB 3.27Å; T543-N547 PolarHBondContact O-N 2.86Å; T543-N547 PolarHBondContact O-OD1 3.47Å; L545-N547 VanDerWaalsContact C-N 3.29Å; L545-N547 PolarHBondContact O-N 3.15Å; N547-F549 VanDerWaalsContact C-N 3.27Å; N547-F549 PolarHBondContact O-N 3.11Å; N547-R552 PolarHBondContact OD1-NH1 3.43Å; N547-R552 PolarHBondContact OD1-NH2 2.68Å; N547-Y566 PolarHBondContact ND2-OH 2.77Å; N547-Y566 VanDerWaalsContact ND2-OH 3.16Å
548	L	90.2	Very high	87	Confident	3 Å²	3	36.3 Å²	36.3	2%	0.016	18%	0.177	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-5.8	-176.8	-64.9	172.2	0	0	0	115.4	M544 L545 A546 N572 M574 I636 T1074	M544-L548 WeakPolarHBondContact O-CG 3.26Å; L545-L548 HydrophobicContact CD2-CD1 4.13Å; L545-L548 PolarHBondContact O-N 3.14Å; A546-L548 VanDerWaalsContact C-N 3.33Å; A546-L548 PolarHBondContact O-N 3.12Å; L548-N572 HydrophobicContact CD2-CB 4.1Å; L548-N572 WeakPolarHBondContact CD2-O 3.21Å; L548-M574 HydrophobicContact CB-CB 4.46Å; L548-M574 HydrophobicContact CB-CE 4.45Å; L548-M574 HydrophobicContact CD1-CE 4.17Å; L548-M574 PolarHBondContact O-N 3.04Å; L548-I636 HydrophobicContact CD1-CD1 3.52Å; L548-I636 HydrophobicContact CD1-CG1 4.29Å; L548-I636 HydrophobicContact CD2-CD1 3.78Å; L548-I636 HydrophobicContact CD2-CG1 4.1Å; L548-I636 HydrophobicContact CD2-CG2 3.75Å; L548-I636 HydrophobicContact CG-CD1 4.33Å; L548-T1074 HydrophobicContact CD2-CG2 4.06Å; L548-T1074 HydrophobicContact CG-CG2 4.31Å
549	F	83.7	Confident	86.5	Confident	9 Å²	9	43.1 Å²	43.1	4%	0.039	21%	0.209	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.7	-2.6	-179.5	63.3	-111.2	0	0	0	116.1	F531 L545 A546 N547 V958 L959 L962 A965 I976	F531-F549 HydrophobicContact CE1-CE1 4.33Å; F531-F549 HydrophobicContact CE2-CE1 4.37Å; F531-F549 HydrophobicContact CE2-CZ 4.29Å; F531-F549 AromaticContact CZ-CE1 3.69Å; F531-F549 HydrophobicContact CZ-CE1 3.69Å; F531-F549 HydrophobicContact CZ-CZ 4.06Å; L545-F549 WeakPolarHBondContact O-CD1 3.4Å; L545-F549 WeakPolarHBondContact O-CE1 3.32Å; A546-F549 HydrophobicContact CB-CZ 4.34Å; N547-F549 VanDerWaalsContact C-N 3.27Å; N547-F549 PolarHBondContact O-N 3.11Å; F549-V958 WeakPolarHBondContact CE2-O 3.36Å; F549-L959 HydrophobicContact CZ-CD2 4.17Å; F549-L962 HydrophobicContact CB-CD1 4.44Å; F549-L962 HydrophobicContact CD2-CB 4.19Å; F549-L962 HydrophobicContact CD2-CD1 4.33Å; F549-L962 HydrophobicContact CE2-CB 4.25Å; F549-L962 HydrophobicContact CG-CD1 4.21Å; F549-A965 HydrophobicContact CB-CB 4.34Å; F549-I976 HydrophobicContact CD1-CD1 3.65Å; F549-I976 HydrophobicContact CE1-CD1 4.2Å; F549-I976 HydrophobicContact CG-CD1 4.36Å
550	S	83.1	Confident	85.9	Confident	8 Å²	8	44.8 Å²	44.8	6%	0.056	22%	0.219	C	C	.	.	S	Bend	trans	-85.2	135.6	160.6	-64	0	0	0	0	109.4	R552 S961	S550-R552 PolarHBondContact O-N 3.21Å; S550-R552 PolarHBondContact OG-NH2 2.87Å; S550-R552 VanDerWaalsContact OG-NH2 3.09Å; S550-S961 PolarHBondContact OG-OG 2.96Å
551	M	77.9	Confident	85.6	Confident	18 Å²	18	46.4 Å²	46.4	9%	0.089	23%	0.229	C	C	.	.			trans	-75	120.9	170.9	-63.1	-62.5	-49.4	0	0	108.9	D400 H403 D405 R406 E573	D400-M551 PolarHBondContact OD1-N 3.28Å; H403-M551 HydrophobicContact CB-CB 3.57Å; H403-M551 HydrophobicContact CB-CG 3.98Å; D405-M551 HydrophobicContact CB-CE 4.09Å; R406-M551 HydrophobicContact CG-CE 3.53Å; R406-M551 HydrophobicContact CG-CG 4.34Å; R406-M551 HydrophobicContact CG-SD 3.82Å; R406-M551 PolarHBondContact NE-SD 3.13Å; R406-M551 VanDerWaalsContact NH2-CG 3.25Å; R406-M551 PolarHBondContact NH2-SD 3.41Å; M551-E573 WeakPolarHBondContact CE-OE1 3.45Å; M551-E573 WeakPolarHBondContact CE-OE2 3.34Å; M551-E573 VanDerWaalsContact SD-OE1 3.34Å
552	R	79.8	Confident	85.4	Confident	25 Å²	25	47.7 Å²	47.7	9%	0.094	23%	0.234	C	C	.	.			trans	-141.3	126.7	-179.6	-58.9	-169.1	-160.1	137.5	12.9	112.8	N547 S550 F554 V570	N547-R552 PolarHBondContact OD1-NH1 3.43Å; N547-R552 PolarHBondContact OD1-NH2 2.68Å; S550-R552 PolarHBondContact O-N 3.21Å; S550-R552 PolarHBondContact OG-NH2 2.87Å; S550-R552 VanDerWaalsContact OG-NH2 3.09Å; R552-F554 PolarHBondContact O-N 3.33Å; R552-V570 HydrophobicContact CB-CG1 4.07Å
553	S	69.1	Low	85.2	Confident	58 Å²	58	51 Å²	51	41%	0.406	25%	0.249	S	C	.	.			trans	-65.3	131.2	175.5	55.7	0	0	0	0	111.2	H403 I555	H403-S553 PolarHBondContact CE1-N 2.87Å; S553-I555 PolarHBondContact O-N 2.89Å
554	F	78.1	Confident	85.1	Confident	116 Å²	116	54.1 Å²	54.1	51%	0.509	26%	0.263	S	S	.	.			trans	-59	133.9	170.1	177.9	-105.4	0	0	0	111.2	R552 E556 A571	R552-F554 PolarHBondContact O-N 3.33Å; F554-E556 HydrophobicContact CE1-CB 3.87Å; F554-E556 HydrophobicContact CE1-CG 4.33Å; F554-E556 HydrophobicContact CZ-CB 4.49Å; F554-A571 HydrophobicContact CB-CB 3.86Å; F554-A571 HydrophobicContact CD2-CB 3.85Å; F554-A571 HydrophobicContact CG-CB 4.29Å
555	I	82.3	Confident	85	Confident	73 Å²	73	56.5 Å²	56.5	37%	0.374	27%	0.273	S	S	.	.			trans	-115.1	121.2	175	-60.5	173	0	0	0	107.2	S553 L567	S553-I555 PolarHBondContact O-N 2.89Å; I555-L567 HydrophobicContact CB-CD1 4.24Å
556	E	79.9	Confident	85	Confident	166 Å²	166	56.3 Å²	56.3	78%	0.776	27%	0.271	S	S	*	.			trans	-83.4	118.1	179.8	-168.8	164	-157.7	0	0	110	F554	F554-E556 HydrophobicContact CE1-CB 3.87Å; F554-E556 HydrophobicContact CE1-CG 4.33Å; F554-E556 HydrophobicContact CZ-CB 4.49Å
557	I	85	Confident	85	Confident	44 Å²	44	56.6 Å²	56.6	23%	0.226	27%	0.273	C	S	.	.			trans	-108.9	118.5	174.8	-61.7	-174.6	0	0	0	108.3	E559 Q563 K564 L567	I557-E559 HydrophobicContact CG2-CB 4.27Å; I557-Q563 HydrophobicContact CD1-CB 3.81Å; I557-K564 HydrophobicContact CB-CB 4.19Å; I557-K564 HydrophobicContact CG2-CB 4.34Å; I557-L567 HydrophobicContact CD1-CD1 3.52Å; I557-L567 HydrophobicContact CG1-CD1 4.02Å
558	E	81.7	Confident	84.9	Confident	189 Å²	189	60.2 Å²	60.2	88%	0.883	29%	0.29	S	S	*	.			trans	-73	-34.7	178.1	-62.6	-171.9	173.8	0	0	112.3
559	E	84.5	Confident	84.9	Confident	143 Å²	143	60 Å²	60	67%	0.668	29%	0.289	S	S	*	.	S	Bend	trans	-70.5	143.2	-178.6	-61.1	-166.5	167.9	0	0	112.5	I557 T561 K564	I557-E559 HydrophobicContact CG2-CB 4.27Å; E559-T561 VanDerWaalsContact C-N 3.27Å; E559-T561 HydrophobicContact CB-CG2 4.05Å; E559-T561 PolarHBondContact O-N 3.29Å; E559-K564 VanDerWaalsContact O-CD 3.25Å; E559-K564 WeakPolarHBondContact O-CD 3.49Å
560	D	81	Confident	85.3	Confident	80 Å²	80	59.9 Å²	59.9	43%	0.428	29%	0.288	S	S	.	.			trans	-83.8	68.2	-176.6	-155.5	49.7	0	0	0	112.1	K564 Y565 H1060	D560-K564 IonicContact OD1-NZ 2.62Å; D560-K564 PolarHBondContact OD1-NZ 3.19Å; D560-Y565 WeakPolarHBondContact OD1-CE2 3.09Å; D560-Y565 PolarHBondContact OD1-OH 2.78Å; D560-H1060 PolarHBondContact O-CD2 2.73Å; D560-H1060 PolarHBondContact O-NE2 3.02Å
561	T	88	Confident	85.5	Confident	34 Å²	34	60.3 Å²	60.3	21%	0.209	29%	0.292	C	S	.	.	S	Bend	trans	-104.9	168.9	179.2	71.4	0	0	0	0	111.8	E559 Q563 K564 Y565	E559-T561 VanDerWaalsContact C-N 3.27Å; E559-T561 HydrophobicContact CB-CG2 4.05Å; E559-T561 PolarHBondContact O-N 3.29Å; T561-Q563 PolarHBondContact O-N 3Å; T561-Q563 PolarHBondContact OG1-N 2.91Å; T561-K564 PolarHBondContact O-N 3.39Å; T561-Y565 VanDerWaalsContact O-CD2 3.31Å; T561-Y565 WeakPolarHBondContact O-CD2 3.36Å
562	W	89.9	Confident	86.2	Confident	27 Å²	27	59.9 Å²	59.9	10%	0.102	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-30.1	172.8	70.7	-96.2	0	0	0	112.9	K564 Y565 Y566 L944 Q946 A949 R1057 Y1071	W562-K564 PolarHBondContact O-N 3.34Å; W562-Y565 PolarHBondContact O-N 2.79Å; W562-Y566 HydrophobicContact CZ3-CD1 4.11Å; W562-Y566 HydrophobicContact CZ3-CG 4.11Å; W562-Y566 WeakPolarHBondContact O-CB 3.46Å; W562-Y566 PolarHBondContact O-N 2.95Å; W562-L944 WeakPolarHBondContact CH2-O 3.23Å; W562-Q946 HydrophobicContact CH2-CB 4.44Å; W562-Q946 HydrophobicContact CZ2-CB 4.06Å; W562-A949 HydrophobicContact CE3-CB 4.5Å; W562-A949 HydrophobicContact CH2-CB 3.77Å; W562-A949 HydrophobicContact CZ3-CB 3.45Å; W562-A949 VanDerWaalsContact CZ3-CB 3.45Å; W562-R1057 HydrophobicContact CB-CG 4.03Å; W562-R1057 HydrophobicContact CD2-CG 4.48Å; W562-R1057 HydrophobicContact CG-CG 3.77Å; W562-Y1071 HydrophobicContact CB-CD1 4.01Å; W562-Y1071 HydrophobicContact CB-CE1 3.73Å; W562-Y1071 HydrophobicContact CE3-CD2 4.43Å; W562-Y1071 HydrophobicContact CE3-CG 4.25Å
563	Q	90.4	Very high	86.6	Confident	69 Å²	69	59.5 Å²	59.5	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-65.1	-37.3	-178.1	-68	176.3	-24.2	0	0	112.3	I557 T561 Y566 L567	I557-Q563 HydrophobicContact CD1-CB 3.81Å; T561-Q563 PolarHBondContact O-N 3Å; T561-Q563 PolarHBondContact OG1-N 2.91Å; Q563-Y566 WeakPolarHBondContact O-CB 3.39Å; Q563-Y566 PolarHBondContact O-N 2.96Å; Q563-L567 WeakPolarHBondContact O-CB 3.4Å; Q563-L567 WeakPolarHBondContact O-CG 3.37Å; Q563-L567 PolarHBondContact O-N 3.34Å
564	K	91.5	Very high	87.5	Confident	67 Å²	67	57.9 Å²	57.9	29%	0.291	28%	0.276	S	S	.	.	H	α-helix	trans	-56	-51.4	175.8	170.9	-178.2	165.4	-169.5	0	112	I557 E559 D560 T561 W562 L567 E568	I557-K564 HydrophobicContact CB-CB 4.19Å; I557-K564 HydrophobicContact CG2-CB 4.34Å; E559-K564 VanDerWaalsContact O-CD 3.25Å; E559-K564 WeakPolarHBondContact O-CD 3.49Å; D560-K564 IonicContact OD1-NZ 2.62Å; D560-K564 PolarHBondContact OD1-NZ 3.19Å; T561-K564 PolarHBondContact O-N 3.39Å; W562-K564 PolarHBondContact O-N 3.34Å; K564-L567 PolarHBondContact O-N 3.03Å; K564-E568 PolarHBondContact O-N 3.25Å
565	Y	91.7	Very high	88	Confident	50 Å²	50	53.8 Å²	53.8	20%	0.196	26%	0.258	C	S	.	.	H	α-helix	trans	-69.6	-32.7	178.4	-61.9	-71.5	0	0	0	112.8	D560 T561 W562 Y1071 F1080	D560-Y565 WeakPolarHBondContact OD1-CE2 3.09Å; D560-Y565 PolarHBondContact OD1-OH 2.78Å; T561-Y565 VanDerWaalsContact O-CD2 3.31Å; T561-Y565 WeakPolarHBondContact O-CD2 3.36Å; W562-Y565 PolarHBondContact O-N 2.79Å; Y565-Y1071 WeakPolarHBondContact CB-OH 3.46Å; Y565-F1080 AromaticContact CD1-CE2 3.86Å; Y565-F1080 HydrophobicContact CD1-CE2 3.86Å; Y565-F1080 HydrophobicContact CD1-CZ 4.01Å; Y565-F1080 HydrophobicContact CE1-CE2 4.36Å
566	Y	93.7	Very high	88.4	Confident	3 Å²	3	51.5 Å²	51.5	1%	0.012	25%	0.247	C	C	.	.	H	α-helix	trans	-65.4	-44.5	172.2	174.4	-110.6	0	0	0	111.9	T543 N547 W562 Q563 G569 V570 Y943 A949 V1072	T543-Y566 HydrophobicContact CG2-CE2 4.23Å; N547-Y566 PolarHBondContact ND2-OH 2.77Å; N547-Y566 VanDerWaalsContact ND2-OH 3.16Å; W562-Y566 HydrophobicContact CZ3-CD1 4.11Å; W562-Y566 HydrophobicContact CZ3-CG 4.11Å; W562-Y566 WeakPolarHBondContact O-CB 3.46Å; W562-Y566 PolarHBondContact O-N 2.95Å; Q563-Y566 WeakPolarHBondContact O-CB 3.39Å; Q563-Y566 PolarHBondContact O-N 2.96Å; Y566-G569 CarbonylContact O-C 3.43Å; Y566-G569 VanDerWaalsContact O-CA 3.26Å; Y566-G569 WeakPolarHBondContact O-CA 3.42Å; Y566-G569 PolarHBondContact O-N 3.11Å; Y566-V570 HydrophobicContact CD1-CG2 3.84Å; Y566-V570 HydrophobicContact CD2-CG2 4.38Å; Y566-V570 HydrophobicContact CE1-CG2 3.46Å; Y566-V570 VanDerWaalsContact CE1-CG2 3.46Å; Y566-V570 HydrophobicContact CE2-CG2 4.04Å; Y566-V570 HydrophobicContact CG-CG2 4.28Å; Y566-V570 WeakPolarHBondContact O-CG2 3.34Å; Y566-V570 PolarHBondContact O-N 2.89Å; Y566-Y943 HydrophobicContact CE1-CD2 4.46Å; Y566-Y943 WeakPolarHBondContact CE1-O 3.49Å; Y566-Y943 VanDerWaalsContact CZ-O 3.22Å; Y566-Y943 PolarHBondContact OH-O 2.92Å; Y566-A949 HydrophobicContact CD1-CB 4.35Å; Y566-A949 HydrophobicContact CD2-CB 4Å; Y566-A949 HydrophobicContact CE1-CB 4.06Å; Y566-A949 HydrophobicContact CE2-CB 3.72Å; Y566-A949 HydrophobicContact CG-CB 4.33Å; Y566-V1072 WeakPolarHBondContact CD2-O 3.41Å
567	L	92.1	Very high	88.9	Confident	5 Å²	5	44.6 Å²	44.6	3%	0.026	22%	0.215	C	C	.	.	H	α-helix	trans	-70.8	-33.2	-176.5	-78.7	166.5	0	0	0	114.1	I555 I557 Q563 K564 G569 V570 A571 Y943 L944	I555-L567 HydrophobicContact CB-CD1 4.24Å; I557-L567 HydrophobicContact CD1-CD1 3.52Å; I557-L567 HydrophobicContact CG1-CD1 4.02Å; Q563-L567 WeakPolarHBondContact O-CB 3.4Å; Q563-L567 WeakPolarHBondContact O-CG 3.37Å; Q563-L567 PolarHBondContact O-N 3.34Å; K564-L567 PolarHBondContact O-N 3.03Å; L567-G569 PolarHBondContact O-N 3.14Å; L567-V570 HydrophobicContact CD2-CB 4.26Å; L567-V570 HydrophobicContact CD2-CG2 4.35Å; L567-V570 PolarHBondContact O-N 3.06Å; L567-V570 VanDerWaalsContact O-N 3.14Å; L567-A571 PolarHBondContact O-N 2.86Å; L567-A571 VanDerWaalsContact O-N 3.15Å; L567-Y943 HydrophobicContact CD2-CE2 4.3Å; L567-L944 HydrophobicContact CD1-CD2 4.48Å; L567-L944 HydrophobicContact CD2-CD2 3.87Å; L567-L944 HydrophobicContact CG-CD2 4.49Å
568	E	89.4	Confident	89.3	Confident	77 Å²	77	47.7 Å²	47.7	36%	0.36	22%	0.224	S	C	.	.	H	α-helix	trans	-55.7	-38.2	165.9	-175.3	178	-162.3	0	0	110.7	K564 N572 P1077	K564-E568 PolarHBondContact O-N 3.25Å; E568-N572 PolarHBondContact O-ND2 3.29Å; E568-P1077 WeakPolarHBondContact OE1-CD 3.12Å; E568-P1077 WeakPolarHBondContact OE1-CG 3.48Å
569	G	90.8	Very high	89.8	Confident	0 Å²	0	39.3 Å²	39.3	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-68.4	-45.3	171.2	0	0	0	0	0	113.9	Y566 L567 A571 N572 T1074	Y566-G569 CarbonylContact O-C 3.43Å; Y566-G569 VanDerWaalsContact O-CA 3.26Å; Y566-G569 WeakPolarHBondContact O-CA 3.42Å; Y566-G569 PolarHBondContact O-N 3.11Å; L567-G569 PolarHBondContact O-N 3.14Å; G569-A571 VanDerWaalsContact C-N 3.28Å; G569-A571 PolarHBondContact O-N 3.2Å; G569-N572 WeakPolarHBondContact O-CB 3.45Å; G569-N572 PolarHBondContact O-N 3.5Å; G569-N572 PolarHBondContact O-ND2 2.73Å; G569-T1074 WeakPolarHBondContact CA-OG1 3.39Å; G569-T1074 PolarHBondContact O-OG1 3.48Å
570	V	91.4	Very high	90.1	Very high	5 Å²	5	33 Å²	33	3%	0.03	16%	0.157	C	C	.	.	H	α-helix	trans	-60.3	-34.4	-176.5	172.8	0	0	0	0	112.5	R552 Y566 L567 N572 Y943	R552-V570 HydrophobicContact CB-CG1 4.07Å; Y566-V570 HydrophobicContact CD1-CG2 3.84Å; Y566-V570 HydrophobicContact CD2-CG2 4.38Å; Y566-V570 HydrophobicContact CE1-CG2 3.46Å; Y566-V570 VanDerWaalsContact CE1-CG2 3.46Å; Y566-V570 HydrophobicContact CE2-CG2 4.04Å; Y566-V570 HydrophobicContact CG-CG2 4.28Å; Y566-V570 WeakPolarHBondContact O-CG2 3.34Å; Y566-V570 PolarHBondContact O-N 2.89Å; L567-V570 HydrophobicContact CD2-CB 4.26Å; L567-V570 HydrophobicContact CD2-CG2 4.35Å; L567-V570 PolarHBondContact O-N 3.06Å; L567-V570 VanDerWaalsContact O-N 3.14Å; V570-N572 PolarHBondContact O-N 3.25Å; V570-Y943 HydrophobicContact CG1-CD2 4.08Å; V570-Y943 HydrophobicContact CG1-CE2 4Å; V570-Y943 HydrophobicContact CG2-CD2 4.37Å
571	A	88.4	Confident	90.5	Very high	17 Å²	17	31.9 Å²	31.9	14%	0.14	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	16.1	178.8	0	0	0	0	0	114.7	F554 L567 G569 S638	F554-A571 HydrophobicContact CB-CB 3.86Å; F554-A571 HydrophobicContact CD2-CB 3.85Å; F554-A571 HydrophobicContact CG-CB 4.29Å; L567-A571 PolarHBondContact O-N 2.86Å; L567-A571 VanDerWaalsContact O-N 3.15Å; G569-A571 VanDerWaalsContact C-N 3.28Å; G569-A571 PolarHBondContact O-N 3.2Å; A571-S638 VanDerWaalsContact O-CA 3.23Å; A571-S638 WeakPolarHBondContact O-CA 3.39Å; A571-S638 WeakPolarHBondContact O-CB 3.43Å
572	N	90.8	Very high	90.6	Very high	9 Å²	9	32 Å²	32	5%	0.048	16%	0.16	C	C	.	.			trans	-103.1	134.2	174.3	-75.5	-91.8	0	0	0	110.7	L548 E568 G569 V570 I636 N1075	L548-N572 HydrophobicContact CD2-CB 4.1Å; L548-N572 WeakPolarHBondContact CD2-O 3.21Å; E568-N572 PolarHBondContact O-ND2 3.29Å; G569-N572 WeakPolarHBondContact O-CB 3.45Å; G569-N572 PolarHBondContact O-N 3.5Å; G569-N572 PolarHBondContact O-ND2 2.73Å; V570-N572 PolarHBondContact O-N 3.25Å; N572-I636 HydrophobicContact CB-CG2 3.66Å; N572-N1075 PolarHBondContact OD1-ND2 2.97Å
573	E	88.7	Confident	90.7	Very high	18 Å²	18	30.8 Å²	30.8	8%	0.084	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	160.8	-178.8	-64.1	179.8	169.9	0	0	111.2	M551 Y575 I636 A637	M551-E573 WeakPolarHBondContact CE-OE1 3.45Å; M551-E573 WeakPolarHBondContact CE-OE2 3.34Å; M551-E573 VanDerWaalsContact SD-OE1 3.34Å; E573-Y575 HydrophobicContact CB-CD2 4.38Å; E573-Y575 HydrophobicContact CB-CE2 3.72Å; E573-Y575 VanDerWaalsContact OE2-CZ 3.27Å; E573-Y575 PolarHBondContact OE2-OH 3.41Å; E573-I636 WeakPolarHBondContact O-CA 3.48Å; E573-A637 PolarHBondContact N-O 3.08Å; E573-A637 PolarHBondContact O-N 3.07Å
574	M	89.1	Confident	90.7	Very high	24 Å²	24	30.6 Å²	30.6	12%	0.118	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.3	178	-166.3	-179	-63.5	0	0	112.1	L548 F635 I972 L975	L548-M574 HydrophobicContact CB-CB 4.46Å; L548-M574 HydrophobicContact CB-CE 4.45Å; L548-M574 HydrophobicContact CD1-CE 4.17Å; L548-M574 PolarHBondContact O-N 3.04Å; M574-F635 WeakPolarHBondContact CA-O 3.3Å; M574-I972 HydrophobicContact CB-CD1 3.93Å; M574-I972 HydrophobicContact CG-CD1 3.53Å; M574-I972 WeakPolarHBondContact O-CD1 3.08Å; M574-I972 HydrophobicContact SD-CD1 3.69Å; M574-L975 HydrophobicContact SD-CD2 3.53Å; M574-L975 VanDerWaalsContact SD-CD2 3.53Å; M574-L975 HydrophobicContact SD-CG 4.23Å
575	Y	88.3	Confident	90.6	Very high	29 Å²	29	29.2 Å²	29.2	11%	0.114	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	158.1	-174.9	-66.8	-71.4	0	0	0	113	E573 F634 F635 A637 A640 V643	E573-Y575 HydrophobicContact CB-CD2 4.38Å; E573-Y575 HydrophobicContact CB-CE2 3.72Å; E573-Y575 VanDerWaalsContact OE2-CZ 3.27Å; E573-Y575 PolarHBondContact OE2-OH 3.41Å; Y575-F634 WeakPolarHBondContact O-CA 3.49Å; Y575-F635 PolarHBondContact N-O 2.87Å; Y575-F635 PolarHBondContact O-N 2.91Å; Y575-A637 HydrophobicContact CD2-CB 4.24Å; Y575-A637 HydrophobicContact CE2-CB 4.48Å; Y575-A637 WeakPolarHBondContact CE2-O 3.37Å; Y575-A640 HydrophobicContact CD1-CB 4.16Å; Y575-A640 HydrophobicContact CE1-CB 3.67Å; Y575-A640 VanDerWaalsContact CZ-N 3.32Å; Y575-A640 PolarHBondContact OH-N 2.88Å; Y575-V643 HydrophobicContact CD2-CG2 3.61Å; Y575-V643 HydrophobicContact CE2-CG2 4.36Å; Y575-V643 HydrophobicContact CG-CG2 3.84Å
576	T	89.8	Confident	90.6	Very high	26 Å²	26	29.8 Å²	29.8	16%	0.16	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122	135.3	173.9	75.9	0	0	0	0	111.6	G633 F634 N969 I972	T576-G633 WeakPolarHBondContact CA-O 3.33Å; T576-F634 HydrophobicContact CG2-CD1 3.63Å; T576-F634 HydrophobicContact CG2-CE1 3.73Å; T576-F634 HydrophobicContact CG2-CG 4.49Å; T576-N969 PolarHBondContact OG1-OD1 2.88Å; T576-I972 HydrophobicContact CG2-CD1 4.19Å
577	E	91.7	Very high	90.6	Very high	20 Å²	20	30.8 Å²	30.8	9%	0.093	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.1	146.4	-179	-167.9	75	-109.6	0	0	111.5	G633 F635 V643 K644 F647	E577-G633 PolarHBondContact N-O 3.19Å; E577-G633 PolarHBondContact O-N 3.22Å; E577-F635 HydrophobicContact CB-CD2 4.33Å; E577-F635 HydrophobicContact CB-CE2 4.08Å; E577-V643 HydrophobicContact CB-CG1 3.68Å; E577-V643 HydrophobicContact CG-CG1 4.34Å; E577-K644 IonicContact OE1-NZ 3.64Å; E577-K644 PolarHBondContact OE1-NZ 3.33Å; E577-K644 WeakPolarHBondContact OE2-CD 3.33Å; E577-K644 VanDerWaalsContact OE2-CE 3.22Å; E577-K644 WeakPolarHBondContact OE2-CE 3.42Å; E577-K644 IonicContact OE2-NZ 3.53Å; E577-K644 PolarHBondContact OE2-NZ 3.19Å; E577-F647 HydrophobicContact CG-CB 4.13Å
578	Y	92.3	Very high	90.7	Very high	109 Å²	109	30.5 Å²	30.5	43%	0.427	18%	0.176	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	135.4	173.3	-72.2	-78.9	0	0	0	111.9	L632 F647	Y578-L632 HydrophobicContact CD1-CB 4.45Å; Y578-L632 HydrophobicContact CD1-CD1 4.2Å; Y578-L632 HydrophobicContact CD2-CD1 4.09Å; Y578-L632 HydrophobicContact CE1-CB 4.27Å; Y578-L632 HydrophobicContact CE1-CD1 4.12Å; Y578-L632 HydrophobicContact CE2-CD1 4Å; Y578-L632 HydrophobicContact CG-CD1 4.2Å; Y578-F647 WeakPolarHBondContact O-CA 3.14Å; Y578-F647 WeakPolarHBondContact O-CB 3.31Å; Y578-F647 WeakPolarHBondContact O-CD2 3.44Å
579	L	92.3	Very high	90.9	Very high	14 Å²	14	27.2 Å²	27.2	7%	0.073	16%	0.161	C	C	.	.	P	Polyproline II helix	trans	-71.3	143	175.8	-67.8	172.2	0	0	0	111.4	F583 I606 L627 T631 F635	L579-F583 HydrophobicContact CB-CD2 4.17Å; L579-F583 HydrophobicContact CD2-CD2 4.12Å; L579-F583 HydrophobicContact CD2-CE2 4.45Å; L579-I606 HydrophobicContact CD1-CG2 4.26Å; L579-L627 HydrophobicContact CD1-CD1 4.11Å; L579-L627 HydrophobicContact CD1-CD2 3.77Å; L579-L627 HydrophobicContact CD1-CG 4.48Å; L579-T631 HydrophobicContact CD1-CG2 3.91Å; L579-T631 PolarHBondContact N-O 2.74Å; L579-T631 VanDerWaalsContact N-O 3.08Å; L579-F635 HydrophobicContact CD2-CE2 4.46Å; L579-F635 HydrophobicContact CD2-CZ 3.78Å
580	S	91.6	Very high	91.1	Very high	9 Å²	9	30 Å²	30	6%	0.063	18%	0.178	C	C	.	.	P	Polyproline II helix	trans	-60.5	148.2	170.8	176.6	0	0	0	0	112.2	A582 F583 A646 Y649	S580-A582 PolarHBondContact O-N 3.08Å; S580-A582 PolarHBondContact OG-N 3.27Å; S580-F583 PolarHBondContact O-N 2.85Å; S580-A646 VanDerWaalsContact CB-O 3.27Å; S580-A646 WeakPolarHBondContact CB-O 3.36Å; S580-A646 PolarHBondContact N-O 2.87Å; S580-A646 VanDerWaalsContact N-O 3.16Å; S580-Y649 VanDerWaalsContact CB-O 3.28Å; S580-Y649 WeakPolarHBondContact CB-O 3.14Å; S580-Y649 PolarHBondContact OG-O 2.96Å
581	S	89.1	Confident	91.2	Very high	57 Å²	57	29.7 Å²	29.7	40%	0.399	18%	0.176	S	C	.	.	G	3₁₀ helix	trans	-59.3	-17.5	171.8	57.1	0	0	0	0	113.3	F583 V584	S581-F583 PolarHBondContact O-N 3.36Å; S581-V584 PolarHBondContact O-N 2.7Å
582	A	89.2	Confident	91.5	Very high	36 Å²	36	29 Å²	29	30%	0.298	17%	0.17	S	C	.	.	G	3₁₀ helix	trans	-63.9	-14.5	171	0	0	0	0	0	114.4	S580 Y649	S580-A582 PolarHBondContact O-N 3.08Å; S580-A582 PolarHBondContact OG-N 3.27Å; A582-Y649 HydrophobicContact CB-CD1 4.28Å
583	F	91.8	Very high	91.6	Very high	3 Å²	3	31 Å²	31	1%	0.013	18%	0.179	C	C	.	.	G	3₁₀ helix	trans	-99.9	-7.2	178.9	-60.6	-55.6	0	0	0	114.1	L579 S580 S581 G585 L586 V591 L594 L599 L627 Y649	L579-F583 HydrophobicContact CB-CD2 4.17Å; L579-F583 HydrophobicContact CD2-CD2 4.12Å; L579-F583 HydrophobicContact CD2-CE2 4.45Å; S580-F583 PolarHBondContact O-N 2.85Å; S581-F583 PolarHBondContact O-N 3.36Å; F583-G585 PolarHBondContact O-N 2.74Å; F583-L586 HydrophobicContact CD1-CD1 4.37Å; F583-L586 WeakPolarHBondContact O-CB 3.4Å; F583-L586 PolarHBondContact O-N 3.36Å; F583-V591 HydrophobicContact CB-CG1 4.3Å; F583-V591 HydrophobicContact CB-CG2 4.1Å; F583-V591 HydrophobicContact CD1-CB 4.37Å; F583-V591 HydrophobicContact CD1-CG1 3.72Å; F583-V591 HydrophobicContact CD1-CG2 3.77Å; F583-V591 HydrophobicContact CD2-CG1 4.41Å; F583-V591 HydrophobicContact CE1-CG1 4.07Å; F583-V591 HydrophobicContact CG-CG1 3.91Å; F583-V591 HydrophobicContact CG-CG2 4.24Å; F583-L594 HydrophobicContact CE1-CB 4.44Å; F583-L594 HydrophobicContact CE1-CD1 4.4Å; F583-L599 HydrophobicContact CZ-CD1 4.31Å; F583-L627 HydrophobicContact CB-CD1 4.13Å; F583-Y649 AromaticContact CE1-CD1 3.71Å; F583-Y649 HydrophobicContact CE1-CD1 3.71Å; F583-Y649 HydrophobicContact CE1-CE1 4.12Å; F583-Y649 HydrophobicContact CE2-CD1 4.25Å; F583-Y649 AromaticContact CZ-CD1 3.48Å; F583-Y649 HydrophobicContact CZ-CD1 3.48Å; F583-Y649 VanDerWaalsContact CZ-CD1 3.48Å; F583-Y649 HydrophobicContact CZ-CE1 4.28Å; F583-Y649 AromaticContact CZ-CG 3.91Å; F583-Y649 HydrophobicContact CZ-CG 3.91Å
584	V	91.4	Very high	91.8	Very high	65 Å²	65	32.7 Å²	32.7	39%	0.394	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.7	134.6	-175.3	176.7	0	0	0	0	111.1	S581 L586 E629	S581-V584 PolarHBondContact O-N 2.7Å; V584-L586 PolarHBondContact O-N 3.16Å; V584-E629 HydrophobicContact CG2-CB 4.01Å
585	G	89.3	Confident	92	Very high	37 Å²	37	31.5 Å²	31.5	38%	0.381	18%	0.183	S	C	.	.	T	Hydrogen-bonded Turn	trans	79.9	-7.9	-179.4	0	0	0	0	0	115.7	F583 K626 L627	F583-G585 PolarHBondContact O-N 2.74Å; G585-K626 WeakPolarHBondContact O-CD 3.26Å; G585-L627 PolarHBondContact N-O 3Å
586	L	92.6	Very high	92.2	Very high	63 Å²	63	30.6 Å²	30.6	33%	0.33	18%	0.179	S	C	.	.	S	Bend	trans	-74.9	157.5	168.5	-57.6	-177.7	0	0	0	110.9	F583 V584 V591 L594 K626 L627	F583-L586 HydrophobicContact CD1-CD1 4.37Å; F583-L586 WeakPolarHBondContact O-CB 3.4Å; F583-L586 PolarHBondContact O-N 3.36Å; V584-L586 PolarHBondContact O-N 3.16Å; L586-V591 HydrophobicContact CB-CG2 3.72Å; L586-V591 HydrophobicContact CD1-CG2 3.72Å; L586-V591 HydrophobicContact CG-CG2 4.35Å; L586-L594 HydrophobicContact CD1-CD1 4.34Å; L586-K626 WeakPolarHBondContact O-CA 3.44Å; L586-L627 PolarHBondContact O-N 3.3Å
587	S	93.4	Very high	92.3	Very high	23 Å²	23	32.4 Å²	32.4	16%	0.161	19%	0.19	C	C	.	.	B	Isolated β-bridge	trans	-79	151	169.7	52.3	0	0	0	0	111.2	T590 V591	S587-T590 PolarHBondContact O-N 3.09Å; S587-T590 PolarHBondContact OG-OG1 3.11Å; S587-V591 PolarHBondContact O-N 3.42Å
588	F	93.6	Very high	92.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-56	-48.6	-177.9	172.1	-87.2	0	0	0	113.5	T590 V591 C592 L603 I606 N620 P621	F588-T590 VanDerWaalsContact C-N 3.33Å; F588-T590 PolarHBondContact O-N 2.96Å; F588-V591 PolarHBondContact O-N 3.35Å; F588-C592 WeakPolarHBondContact CE1-SG 3.41Å; F588-C592 WeakPolarHBondContact CZ-SG 3.26Å; F588-C592 PolarHBondContact O-N 2.86Å; F588-L603 HydrophobicContact CD2-CD2 4.31Å; F588-L603 HydrophobicContact CE2-CD1 4.4Å; F588-L603 HydrophobicContact CE2-CD2 3.98Å; F588-L603 HydrophobicContact CE2-CG 3.79Å; F588-L603 HydrophobicContact CZ-CG 4.24Å; F588-I606 HydrophobicContact CD2-CD1 4.13Å; F588-I606 HydrophobicContact CD2-CG1 4.19Å; F588-I606 HydrophobicContact CD2-CG2 3.96Å; F588-I606 HydrophobicContact CE2-CG1 4.47Å; F588-I606 HydrophobicContact CE2-CG2 3.99Å; F588-N620 HydrophobicContact CE1-CB 4.29Å; F588-N620 WeakPolarHBondContact CE1-OD1 3.49Å; F588-P621 HydrophobicContact CB-CG 3.97Å; F588-P621 HydrophobicContact CD1-CG 4.05Å; F588-P621 VanDerWaalsContact CD1-O 3.26Å; F588-P621 WeakPolarHBondContact CD1-O 3.46Å; F588-P621 HydrophobicContact CD2-CG 3.84Å; F588-P621 HydrophobicContact CE2-CG 4.33Å; F588-P621 HydrophobicContact CG-CG 3.69Å
589	P	94.5	Very high	92.2	Very high	8 Å²	8	29.3 Å²	29.3	5%	0.052	18%	0.178	C	C	.	.	H	α-helix	trans	-59.1	-36.5	179.2	-29.6	39.4	0	0	0	114.7	V591 C592 E593 N623 L1043	P589-V591 VanDerWaalsContact C-N 3.28Å; P589-V591 PolarHBondContact O-N 2.96Å; P589-C592 PolarHBondContact O-N 2.9Å; P589-E593 PolarHBondContact O-N 3.23Å; P589-N623 WeakPolarHBondContact CD-OD1 3.26Å; P589-N623 WeakPolarHBondContact CG-OD1 3.25Å; P589-L1043 HydrophobicContact CB-CD1 3.88Å; P589-L1043 HydrophobicContact CB-CG 4.04Å; P589-L1043 HydrophobicContact CG-CD1 4.43Å; P589-L1043 WeakPolarHBondContact O-CD2 3.23Å
590	T	93.2	Very high	92.2	Very high	57 Å²	57	34.2 Å²	34.2	35%	0.35	20%	0.199	S	C	.	.	H	α-helix	trans	-67.5	-29.3	175.7	-60.5	0	0	0	0	112.3	S587 F588 L594	S587-T590 PolarHBondContact O-N 3.09Å; S587-T590 PolarHBondContact OG-OG1 3.11Å; F588-T590 VanDerWaalsContact C-N 3.33Å; F588-T590 PolarHBondContact O-N 2.96Å; T590-L594 WeakPolarHBondContact O-CG 3.22Å; T590-L594 PolarHBondContact O-N 3.45Å
591	V	93.9	Very high	92.3	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-82.8	-33.4	175.3	175.7	0	0	0	0	112	F583 L586 S587 F588 P589 E593 L594 C595 L603 L627	F583-V591 HydrophobicContact CB-CG1 4.3Å; F583-V591 HydrophobicContact CB-CG2 4.1Å; F583-V591 HydrophobicContact CD1-CB 4.37Å; F583-V591 HydrophobicContact CD1-CG1 3.72Å; F583-V591 HydrophobicContact CD1-CG2 3.77Å; F583-V591 HydrophobicContact CD2-CG1 4.41Å; F583-V591 HydrophobicContact CE1-CG1 4.07Å; F583-V591 HydrophobicContact CG-CG1 3.91Å; F583-V591 HydrophobicContact CG-CG2 4.24Å; L586-V591 HydrophobicContact CB-CG2 3.72Å; L586-V591 HydrophobicContact CD1-CG2 3.72Å; L586-V591 HydrophobicContact CG-CG2 4.35Å; S587-V591 PolarHBondContact O-N 3.42Å; F588-V591 PolarHBondContact O-N 3.35Å; P589-V591 VanDerWaalsContact C-N 3.28Å; P589-V591 PolarHBondContact O-N 2.96Å; V591-E593 VanDerWaalsContact C-N 3.34Å; V591-E593 PolarHBondContact O-N 2.66Å; V591-L594 PolarHBondContact O-N 3.07Å; V591-C595 VanDerWaalsContact O-CB 3.29Å; V591-C595 WeakPolarHBondContact O-CB 3.31Å; V591-C595 PolarHBondContact O-N 2.88Å; V591-C595 PolarHBondContact O-SG 3.03Å; V591-L603 HydrophobicContact CG1-CD2 4Å; V591-L627 HydrophobicContact CB-CD1 3.77Å; V591-L627 HydrophobicContact CG1-CD1 3.95Å; V591-L627 HydrophobicContact CG2-CD1 3.48Å; V591-L627 VanDerWaalsContact CG2-CD1 3.48Å
592	C	94.6	Very high	92.6	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	18%	0.177	C	C	.	.	H	α-helix	trans	-59.9	-42.7	168	-69.9	0	0	0	0	112.1	F588 P589 C595 Y596 L603 L1043 L1049	F588-C592 WeakPolarHBondContact CE1-SG 3.41Å; F588-C592 WeakPolarHBondContact CZ-SG 3.26Å; F588-C592 PolarHBondContact O-N 2.86Å; P589-C592 PolarHBondContact O-N 2.9Å; C592-C595 PolarHBondContact O-N 3.05Å; C592-Y596 WeakPolarHBondContact O-CB 3.39Å; C592-Y596 PolarHBondContact O-N 3.32Å; C592-L603 PolarHBondContact SG-O 2.66Å; C592-L1043 HydrophobicContact CB-CD2 3.75Å; C592-L1049 HydrophobicContact CB-CD1 4.19Å
593	E	94.2	Very high	92.9	Very high	53 Å²	53	29.4 Å²	29.4	25%	0.248	16%	0.163	C	C	.	.	H	α-helix	trans	-58.1	-51.4	172.2	180	-176.4	177	0	0	111.7	P589 V591 C595 Y596 V597 K1044	P589-E593 PolarHBondContact O-N 3.23Å; V591-E593 VanDerWaalsContact C-N 3.34Å; V591-E593 PolarHBondContact O-N 2.66Å; E593-C595 PolarHBondContact O-N 3.48Å; E593-Y596 PolarHBondContact O-N 2.85Å; E593-V597 HydrophobicContact CG-CG2 4.31Å; E593-V597 WeakPolarHBondContact O-CB 3.03Å; E593-V597 VanDerWaalsContact O-CG2 3.31Å; E593-V597 WeakPolarHBondContact O-CG2 3.46Å; E593-V597 PolarHBondContact O-N 3.3Å; E593-K1044 VanDerWaalsContact CD-NZ 3.31Å; E593-K1044 WeakPolarHBondContact OE1-CE 3.25Å; E593-K1044 IonicContact OE1-NZ 3.95Å; E593-K1044 PolarHBondContact OE1-NZ 3.28Å; E593-K1044 WeakPolarHBondContact OE2-CE 3.28Å; E593-K1044 IonicContact OE2-NZ 3.02Å; E593-K1044 PolarHBondContact OE2-NZ 2.98Å
594	L	91.9	Very high	93	Very high	52 Å²	52	30.2 Å²	30.2	27%	0.272	17%	0.167	S	C	.	.	H	α-helix	trans	-62.5	-42.8	179.5	-72.1	168.8	0	0	0	112.2	F583 L586 T590 V591 K598 L599	F583-L594 HydrophobicContact CE1-CB 4.44Å; F583-L594 HydrophobicContact CE1-CD1 4.4Å; L586-L594 HydrophobicContact CD1-CD1 4.34Å; T590-L594 WeakPolarHBondContact O-CG 3.22Å; T590-L594 PolarHBondContact O-N 3.45Å; V591-L594 PolarHBondContact O-N 3.07Å; L594-K598 WeakPolarHBondContact O-CA 3.25Å; L594-K598 VanDerWaalsContact O-CB 3.3Å; L594-K598 WeakPolarHBondContact O-CB 3.48Å; L594-K598 PolarHBondContact O-N 3.04Å; L594-L599 PolarHBondContact O-N 3.26Å
595	C	93.6	Very high	93.1	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	15%	0.148	C	C	.	.	I	π-helix	trans	-63.1	-45.6	177	-73.2	0	0	0	0	111.7	V591 C592 E593 L599 K600 L601 L603	V591-C595 VanDerWaalsContact O-CB 3.29Å; V591-C595 WeakPolarHBondContact O-CB 3.31Å; V591-C595 PolarHBondContact O-N 2.88Å; V591-C595 PolarHBondContact O-SG 3.03Å; C592-C595 PolarHBondContact O-N 3.05Å; E593-C595 PolarHBondContact O-N 3.48Å; C595-L599 CarbonylContact O-C 3.46Å; C595-L599 VanDerWaalsContact O-C 3.31Å; C595-L599 VanDerWaalsContact O-CA 3.28Å; C595-L599 WeakPolarHBondContact O-CA 3.22Å; C595-L599 VanDerWaalsContact O-CB 3.24Å; C595-L599 WeakPolarHBondContact O-CB 3.37Å; C595-L599 PolarHBondContact O-N 2.94Å; C595-K600 PolarHBondContact O-N 3.26Å; C595-L601 CarbonylContact C-O 3.54Å; C595-L601 HydrophobicContact CB-CB 4.44Å; C595-L601 WeakPolarHBondContact CB-O 3.29Å; C595-L601 PolarHBondContact O-N 3.47Å; C595-L603 HydrophobicContact CB-CB 4.45Å
596	Y	93.4	Very high	93.3	Very high	9 Å²	9	25.4 Å²	25.4	4%	0.035	13%	0.131	C	C	.	.	I	π-helix	trans	-70.4	-48.5	-178.6	-169.4	-100.8	0	0	0	111.7	C592 E593 K600 L601 L602 Y1035 F1039 P1076 Y1078	C592-Y596 WeakPolarHBondContact O-CB 3.39Å; C592-Y596 PolarHBondContact O-N 3.32Å; E593-Y596 PolarHBondContact O-N 2.85Å; Y596-K600 WeakPolarHBondContact O-CA 3.35Å; Y596-K600 PolarHBondContact O-N 3.33Å; Y596-L601 WeakPolarHBondContact CA-O 3.25Å; Y596-L601 PolarHBondContact N-O 3.17Å; Y596-L602 HydrophobicContact CD2-CB 4.43Å; Y596-L602 HydrophobicContact CD2-CD1 4.45Å; Y596-Y1035 WeakPolarHBondContact OH-CD1 3.4Å; Y596-F1039 AromaticContact CD1-CD1 3.64Å; Y596-F1039 HydrophobicContact CD1-CD1 3.64Å; Y596-F1039 AromaticContact CD1-CE1 3.89Å; Y596-F1039 HydrophobicContact CD1-CE1 3.89Å; Y596-F1039 HydrophobicContact CD1-CG 4.09Å; Y596-F1039 HydrophobicContact CD2-CZ 4.42Å; Y596-F1039 HydrophobicContact CE1-CB 4.41Å; Y596-F1039 HydrophobicContact CE1-CD1 4.25Å; Y596-F1039 HydrophobicContact CE1-CG 4.26Å; Y596-F1039 AromaticContact CG-CD1 4Å; Y596-F1039 HydrophobicContact CG-CD1 4Å; Y596-F1039 AromaticContact CG-CE1 3.76Å; Y596-F1039 HydrophobicContact CG-CE1 3.76Å; Y596-F1039 HydrophobicContact CG-CE2 4.48Å; Y596-F1039 HydrophobicContact CG-CG 4.46Å; Y596-F1039 HydrophobicContact CG-CZ 4.02Å; Y596-P1076 PolarHBondContact OH-O 3.24Å; Y596-Y1078 HydrophobicContact CD1-CD2 4.09Å; Y596-Y1078 AromaticContact CE1-CD2 3.74Å; Y596-Y1078 HydrophobicContact CE1-CD2 3.74Å; Y596-Y1078 HydrophobicContact CE1-CE2 4.5Å; Y596-Y1078 PolarHBondContact OH-N 2.92Å
597	V	91.4	Very high	93.1	Very high	64 Å²	64	23.4 Å²	23.4	39%	0.388	12%	0.12	S	C	.	.	I	π-helix	trans	-75.3	-44.9	-175.5	-179.3	0	0	0	0	113.1	E593 Y1078	E593-V597 HydrophobicContact CG-CG2 4.31Å; E593-V597 WeakPolarHBondContact O-CB 3.03Å; E593-V597 VanDerWaalsContact O-CG2 3.31Å; E593-V597 WeakPolarHBondContact O-CG2 3.46Å; E593-V597 PolarHBondContact O-N 3.3Å; V597-Y1078 HydrophobicContact CG2-CD2 4.48Å; V597-Y1078 HydrophobicContact CG2-CE2 3.98Å
598	K	89.6	Confident	92.6	Very high	64 Å²	64	25.1 Å²	25.1	28%	0.278	12%	0.124	S	C	.	.	I	π-helix	trans	-94.6	-36.1	-175.9	-73.2	-77.6	-177.1	169.1	0	113.8	L594 D655 I657	L594-K598 WeakPolarHBondContact O-CA 3.25Å; L594-K598 VanDerWaalsContact O-CB 3.3Å; L594-K598 WeakPolarHBondContact O-CB 3.48Å; L594-K598 PolarHBondContact O-N 3.04Å; K598-D655 PolarHBondContact NZ-O 3.32Å; K598-I657 PolarHBondContact NZ-O 2.85Å; K598-I657 VanDerWaalsContact NZ-O 3.15Å
599	L	90.8	Very high	91.8	Very high	1 Å²	1	29 Å²	29	1%	0.005	14%	0.141	C	C	.	.	I	π-helix	trans	-99	-11.8	-176.8	-48.9	-175.5	0	0	0	113.4	F583 L594 C595 L601 R645 A646 Y649 I663	F583-L599 HydrophobicContact CZ-CD1 4.31Å; L594-L599 PolarHBondContact O-N 3.26Å; C595-L599 CarbonylContact O-C 3.46Å; C595-L599 VanDerWaalsContact O-C 3.31Å; C595-L599 VanDerWaalsContact O-CA 3.28Å; C595-L599 WeakPolarHBondContact O-CA 3.22Å; C595-L599 VanDerWaalsContact O-CB 3.24Å; C595-L599 WeakPolarHBondContact O-CB 3.37Å; C595-L599 PolarHBondContact O-N 2.94Å; L599-L601 VanDerWaalsContact C-N 3.27Å; L599-L601 HydrophobicContact CB-CB 4.3Å; L599-L601 HydrophobicContact CB-CD1 3.89Å; L599-L601 HydrophobicContact CB-CG 3.92Å; L599-L601 HydrophobicContact CD1-CD1 4.17Å; L599-L601 PolarHBondContact O-N 2.97Å; L599-R645 HydrophobicContact CD2-CB 4.48Å; L599-R645 VanDerWaalsContact O-CZ 3.28Å; L599-R645 PolarHBondContact O-NE 3.35Å; L599-R645 PolarHBondContact O-NH2 2.72Å; L599-A646 HydrophobicContact CD1-CB 4.27Å; L599-Y649 HydrophobicContact CD2-CD2 3.72Å; L599-Y649 HydrophobicContact CD2-CE2 4.26Å; L599-Y649 HydrophobicContact CD2-CG 4.37Å; L599-I663 HydrophobicContact CD2-CD1 3.44Å; L599-I663 VanDerWaalsContact CD2-CD1 3.44Å
600	K	92.9	Very high	90.3	Very high	117 Å²	117	31.4 Å²	31.4	51%	0.509	16%	0.158	S	C	.	.			trans	51.8	44.7	-168.3	-58.4	-164.9	175.9	-163.2	0	112.4	C595 Y596 P660	C595-K600 PolarHBondContact O-N 3.26Å; Y596-K600 WeakPolarHBondContact O-CA 3.35Å; Y596-K600 PolarHBondContact O-N 3.33Å; K600-P660 HydrophobicContact CD-CG 4.32Å; K600-P660 HydrophobicContact CG-CG 4.33Å
601	L	94.3	Very high	88.7	Confident	0 Å²	0	38 Å²	38	0%	0	19%	0.185	C	C	.	.			trans	-126.5	128.1	178.8	-62.3	176.1	0	0	0	110.4	C595 Y596 L599 L603 F635 A637 E642 V643 A646	C595-L601 CarbonylContact C-O 3.54Å; C595-L601 HydrophobicContact CB-CB 4.44Å; C595-L601 WeakPolarHBondContact CB-O 3.29Å; C595-L601 PolarHBondContact O-N 3.47Å; Y596-L601 WeakPolarHBondContact CA-O 3.25Å; Y596-L601 PolarHBondContact N-O 3.17Å; L599-L601 VanDerWaalsContact C-N 3.27Å; L599-L601 HydrophobicContact CB-CB 4.3Å; L599-L601 HydrophobicContact CB-CD1 3.89Å; L599-L601 HydrophobicContact CB-CG 3.92Å; L599-L601 HydrophobicContact CD1-CD1 4.17Å; L599-L601 PolarHBondContact O-N 2.97Å; L601-L603 PolarHBondContact O-N 2.57Å; L601-F635 HydrophobicContact CB-CD1 3.89Å; L601-F635 HydrophobicContact CB-CE1 4.26Å; L601-F635 HydrophobicContact CD1-CD1 4.46Å; L601-F635 HydrophobicContact CD1-CE1 4.42Å; L601-A637 HydrophobicContact CD2-CB 3.68Å; L601-E642 HydrophobicContact CD2-CB 4.15Å; L601-V643 HydrophobicContact CD2-CG2 4.27Å; L601-A646 HydrophobicContact CD1-CB 4.06Å
602	L	95.6	Very high	86.9	Confident	1 Å²	1	46.2 Å²	46.2	1%	0.005	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	100.9	179.2	176.1	59.6	0	0	0	110.6	Y596 I604 F635 I636 F1039 L1049 F1051 N1075	Y596-L602 HydrophobicContact CD2-CB 4.43Å; Y596-L602 HydrophobicContact CD2-CD1 4.45Å; L602-I604 HydrophobicContact CD2-CD1 4.4Å; L602-I604 HydrophobicContact CG-CD1 4.41Å; L602-I604 HydrophobicContact CG-CG1 4.12Å; L602-F635 CarbonylContact O-C 3.56Å; L602-F635 VanDerWaalsContact O-CA 3.29Å; L602-F635 WeakPolarHBondContact O-CA 3.35Å; L602-I636 HydrophobicContact CB-CB 4.31Å; L602-I636 HydrophobicContact CD2-CB 4.38Å; L602-I636 HydrophobicContact CD2-CD1 4.31Å; L602-I636 PolarHBondContact N-O 2.67Å; L602-I636 PolarHBondContact O-N 3.31Å; L602-F1039 HydrophobicContact CD1-CE2 3.62Å; L602-F1039 HydrophobicContact CD1-CZ 4.11Å; L602-L1049 HydrophobicContact CD1-CD1 4.38Å; L602-L1049 HydrophobicContact CD1-CD2 4.5Å; L602-L1049 HydrophobicContact CD1-CG 4.48Å; L602-F1051 HydrophobicContact CD2-CB 3.81Å; L602-N1075 VanDerWaalsContact CB-OD1 3.31Å; L602-N1075 WeakPolarHBondContact CB-OD1 3.42Å; L602-N1075 HydrophobicContact CD2-CB 4.05Å; L602-N1075 WeakPolarHBondContact CD2-OD1 3.43Å
603	L	95.5	Very high	84.8	Confident	0 Å²	0	57.5 Å²	57.5	0%	0	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	118.3	177.2	175.1	61.5	0	0	0	110.7	F588 V591 C592 C595 L601 A605 I606 F635 L1049	F588-L603 HydrophobicContact CD2-CD2 4.31Å; F588-L603 HydrophobicContact CE2-CD1 4.4Å; F588-L603 HydrophobicContact CE2-CD2 3.98Å; F588-L603 HydrophobicContact CE2-CG 3.79Å; F588-L603 HydrophobicContact CZ-CG 4.24Å; V591-L603 HydrophobicContact CG1-CD2 4Å; C592-L603 PolarHBondContact SG-O 2.66Å; C595-L603 HydrophobicContact CB-CB 4.45Å; L601-L603 PolarHBondContact O-N 2.57Å; L603-A605 WeakPolarHBondContact CD1-O 3.11Å; L603-I606 HydrophobicContact CD1-CG2 4.39Å; L603-F635 HydrophobicContact CB-CD1 3.96Å; L603-F635 HydrophobicContact CB-CE1 3.8Å; L603-F635 HydrophobicContact CD1-CD1 4.22Å; L603-F635 HydrophobicContact CD1-CE1 3.9Å; L603-F635 HydrophobicContact CD1-CE2 4.31Å; L603-F635 HydrophobicContact CD1-CZ 3.95Å; L603-F635 HydrophobicContact CG-CE1 4.3Å; L603-L1049 WeakPolarHBondContact O-CD2 3.36Å
604	I	94.1	Very high	83.2	Confident	19 Å²	19	60 Å²	60	10%	0.097	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	-39.6	-174.6	-66.7	-171.3	0	0	0	113.4	L602 I619 N620 F634 I636 L1049 F1051 L1091	L602-I604 HydrophobicContact CD2-CD1 4.4Å; L602-I604 HydrophobicContact CG-CD1 4.41Å; L602-I604 HydrophobicContact CG-CG1 4.12Å; I604-I619 HydrophobicContact CG2-CG2 4.35Å; I604-N620 PolarHBondContact O-N 3.1Å; I604-F634 PolarHBondContact N-O 2.88Å; I604-I636 HydrophobicContact CD1-CD1 3.36Å; I604-I636 HydrophobicContact CD1-CG1 3.77Å; I604-L1049 HydrophobicContact CB-CD2 4.31Å; I604-L1049 HydrophobicContact CG1-CD2 3.96Å; I604-F1051 HydrophobicContact CD1-CB 4.34Å; I604-L1091 HydrophobicContact CG2-CD1 4.05Å
605	A	93.1	Very high	82.1	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	164.6	-175.7	0	0	0	0	0	111.7	L603 I617 L618 I619 F634 L975	L603-A605 WeakPolarHBondContact CD1-O 3.11Å; A605-I617 HydrophobicContact CB-CG2 4.04Å; A605-L618 VanDerWaalsContact CA-O 3.24Å; A605-L618 WeakPolarHBondContact CA-O 3.3Å; A605-L618 WeakPolarHBondContact CB-O 3.47Å; A605-I619 HydrophobicContact CB-CG1 4.16Å; A605-F634 HydrophobicContact CB-CB 4.05Å; A605-F634 HydrophobicContact CB-CD2 3.93Å; A605-F634 HydrophobicContact CB-CG 4.21Å; A605-F634 PolarHBondContact O-N 3Å; A605-L975 HydrophobicContact CB-CD1 3.93Å; A605-L975 HydrophobicContact CB-CD2 4.46Å
606	I	92.8	Very high	81.3	Confident	1 Å²	1	63.7 Å²	63.7	1%	0.005	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	150.2	173.3	51.3	169.7	0	0	0	111.7	L579 F588 L603 L618 P621 V625 L627 T631 L632	L579-I606 HydrophobicContact CD1-CG2 4.26Å; F588-I606 HydrophobicContact CD2-CD1 4.13Å; F588-I606 HydrophobicContact CD2-CG1 4.19Å; F588-I606 HydrophobicContact CD2-CG2 3.96Å; F588-I606 HydrophobicContact CE2-CG1 4.47Å; F588-I606 HydrophobicContact CE2-CG2 3.99Å; L603-I606 HydrophobicContact CD1-CG2 4.39Å; I606-L618 HydrophobicContact CG1-CB 4.43Å; I606-L618 PolarHBondContact N-O 3.21Å; I606-L618 PolarHBondContact O-N 3.09Å; I606-P621 HydrophobicContact CD1-CG 3.81Å; I606-P621 HydrophobicContact CG1-CG 3.84Å; I606-V625 HydrophobicContact CD1-CG1 4.24Å; I606-L627 HydrophobicContact CD1-CD2 3.67Å; I606-L627 HydrophobicContact CG2-CD2 3.96Å; I606-T631 HydrophobicContact CB-CG2 3.73Å; I606-T631 HydrophobicContact CG2-CG2 3.8Å; I606-L632 CarbonylContact C-O 3.41Å; I606-L632 WeakPolarHBondContact CA-O 3.42Å
607	E	89.6	Confident	81	Confident	22 Å²	22	64.4 Å²	64.4	10%	0.103	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	113.5	165.4	-171.9	-153.8	178.1	0	0	109.8	K609 S615 L632	E607-K609 WeakPolarHBondContact OE1-CE 2.87Å; E607-K609 IonicContact OE1-NZ 3.03Å; E607-K609 PolarHBondContact OE1-NZ 2.87Å; E607-K609 IonicContact OE2-NZ 2.64Å; E607-K609 PolarHBondContact OE2-NZ 3.14Å; E607-S615 WeakPolarHBondContact OE1-CB 3.26Å; E607-L632 HydrophobicContact CB-CB 3.86Å; E607-L632 PolarHBondContact N-O 3.23Å
608	F	81.9	Confident	80.8	Confident	59 Å²	59	63.9 Å²	63.9	26%	0.259	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	125.7	175.2	-171.8	-94.6	0	0	0	110.5	S615 S616 L618 V625	F608-S615 WeakPolarHBondContact O-CA 3.06Å; F608-S616 PolarHBondContact N-O 3.17Å; F608-S616 PolarHBondContact O-N 3.39Å; F608-L618 HydrophobicContact CB-CD1 3.56Å; F608-L618 HydrophobicContact CB-CG 3.88Å; F608-L618 HydrophobicContact CD1-CD1 4.41Å; F608-L618 HydrophobicContact CD2-CD1 4.31Å; F608-L618 HydrophobicContact CG-CD1 3.85Å; F608-V625 HydrophobicContact CD2-CG1 4.01Å; F608-V625 HydrophobicContact CE2-CG1 4.09Å
609	K	77.1	Confident	80.9	Confident	82 Å²	82	62.1 Å²	62.1	36%	0.357	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	115.5	179.5	-72.4	170	168.8	110.2	0	109.4	E607 Q628 G630	E607-K609 WeakPolarHBondContact OE1-CE 2.87Å; E607-K609 IonicContact OE1-NZ 3.03Å; E607-K609 PolarHBondContact OE1-NZ 2.87Å; E607-K609 IonicContact OE2-NZ 2.64Å; E607-K609 PolarHBondContact OE2-NZ 3.14Å; K609-Q628 PolarHBondContact O-NE2 3.48Å; K609-G630 PolarHBondContact NZ-O 3.08Å
610	S	63.6	Low	81	Confident	57 Å²	57	62.1 Å²	62.1	40%	0.399	30%	0.3	S	S	.	.			trans	-80.9	156	178.6	-176.9	0	0	0	0	111.7	Q612 R613 E614	S610-Q612 PolarHBondContact O-N 3.26Å; S610-R613 PolarHBondContact O-N 2.91Å; S610-E614 PolarHBondContact N-O 2.8Å; S610-E614 VanDerWaalsContact N-O 3.08Å
611	E	58.6	Low	80.9	Confident	195 Å²	195	57 Å²	57	91%	0.911	28%	0.279	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-24.5	175.1	-65.4	-169	159.6	0	0	112.9	R613	E611-R613 PolarHBondContact O-N 3.47Å
612	Q	56.3	Low	80.5	Confident	174 Å²	174	57.3 Å²	57.3	81%	0.813	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	6.8	176.2	-61.4	-173.3	-1.6	0	0	114	S610 E614	S610-Q612 PolarHBondContact O-N 3.26Å; Q612-E614 VanDerWaalsContact C-N 3.3Å; Q612-E614 PolarHBondContact O-N 2.95Å
613	R	50.3	Low	80.1	Confident	237 Å²	237	61.1 Å²	61.1	89%	0.894	30%	0.302	S	S	*	.	S	Bend	trans	67.1	17.3	177.6	-57.5	-179.7	168.1	-169.8	-5.3	116.5	S610 E611	S610-R613 PolarHBondContact O-N 2.91Å; E611-R613 PolarHBondContact O-N 3.47Å
614	E	61.1	Low	79.5	Confident	106 Å²	106	68.6 Å²	68.6	50%	0.495	34%	0.337	S	S	.	.			trans	-97.9	134.3	167.4	-55.8	-141.7	114.1	0	0	109.7	K516 S610 Q612	K516-E614 IonicContact NZ-OE1 2.87Å; K516-E614 PolarHBondContact NZ-OE1 3.31Å; S610-E614 PolarHBondContact N-O 2.8Å; S610-E614 VanDerWaalsContact N-O 3.08Å; Q612-E614 VanDerWaalsContact C-N 3.3Å; Q612-E614 PolarHBondContact O-N 2.95Å
615	S	68	Low	79.2	Confident	75 Å²	75	68.5 Å²	68.5	52%	0.524	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	132.4	172.3	39.4	0	0	0	0	109.7	E607 F608	E607-S615 WeakPolarHBondContact OE1-CB 3.26Å; F608-S615 WeakPolarHBondContact O-CA 3.06Å
616	S	76.4	Confident	79	Confident	54 Å²	54	75 Å²	75	38%	0.378	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	143.5	174.4	59.1	0	0	0	0	110.4	F608	F608-S616 PolarHBondContact N-O 3.17Å; F608-S616 PolarHBondContact O-N 3.39Å
617	I	87.9	Confident	78.9	Confident	25 Å²	25	75.1 Å²	75.1	13%	0.128	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	116.7	175.9	-60.5	176	0	0	0	107.9	A605 F634 T974 L975	A605-I617 HydrophobicContact CB-CG2 4.04Å; I617-F634 HydrophobicContact CD1-CE1 4.28Å; I617-F634 HydrophobicContact CD1-CE2 4.32Å; I617-F634 HydrophobicContact CD1-CZ 3.64Å; I617-F634 HydrophobicContact CG1-CE2 4.18Å; I617-F634 HydrophobicContact CG1-CZ 3.97Å; I617-F634 HydrophobicContact CG2-CD2 4.47Å; I617-F634 HydrophobicContact CG2-CE2 3.99Å; I617-F634 HydrophobicContact CG2-CZ 4.26Å; I617-T974 HydrophobicContact CD1-CG2 3.78Å; I617-L975 HydrophobicContact CD1-CB 4.28Å; I617-L975 HydrophobicContact CG2-CB 4.47Å; I617-L975 HydrophobicContact CG2-CD1 3.91Å
618	L	87.9	Confident	78.8	Confident	53 Å²	53	77.8 Å²	77.8	28%	0.277	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	118	176.9	-59.7	-175.5	0	0	0	109.7	A605 I606 F608 P621	A605-L618 VanDerWaalsContact CA-O 3.24Å; A605-L618 WeakPolarHBondContact CA-O 3.3Å; A605-L618 WeakPolarHBondContact CB-O 3.47Å; I606-L618 HydrophobicContact CG1-CB 4.43Å; I606-L618 PolarHBondContact N-O 3.21Å; I606-L618 PolarHBondContact O-N 3.09Å; F608-L618 HydrophobicContact CB-CD1 3.56Å; F608-L618 HydrophobicContact CB-CG 3.88Å; F608-L618 HydrophobicContact CD1-CD1 4.41Å; F608-L618 HydrophobicContact CD2-CD1 4.31Å; F608-L618 HydrophobicContact CG-CD1 3.85Å; L618-P621 HydrophobicContact CB-CB 4.17Å; L618-P621 HydrophobicContact CB-CG 4.1Å; L618-P621 HydrophobicContact CD1-CB 4.43Å
619	I	91.3	Very high	79	Confident	27 Å²	27	81.7 Å²	81.7	14%	0.138	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	120.6	-179.6	-57.8	176.7	0	0	0	109.1	I604 A605 L975 T978 L979 L1091	I604-I619 HydrophobicContact CG2-CG2 4.35Å; A605-I619 HydrophobicContact CB-CG1 4.16Å; I619-L975 HydrophobicContact CD1-CD1 3.72Å; I619-L975 HydrophobicContact CG1-CD1 3.71Å; I619-T978 HydrophobicContact CD1-CG2 3.85Å; I619-T978 HydrophobicContact CG1-CG2 4.49Å; I619-L979 HydrophobicContact CD1-CB 3.83Å; I619-L979 HydrophobicContact CD1-CD1 4.21Å; I619-L1091 HydrophobicContact CG2-CD1 3.68Å; I619-L1091 HydrophobicContact CG2-CD2 4.26Å
620	N	93.1	Very high	79.5	Confident	0 Å²	0	79.5 Å²	79.5	0%	0	40%	0.398	C	S	.	.	S	Bend	trans	40.3	62.2	-172.7	-178	33.1	0	0	0	114.3	F588 I604 C1014 N1047 L1049 L1091 Q1093	F588-N620 HydrophobicContact CE1-CB 4.29Å; F588-N620 WeakPolarHBondContact CE1-OD1 3.49Å; I604-N620 PolarHBondContact O-N 3.1Å; N620-C1014 PolarHBondContact O-SG 2.77Å; N620-N1047 PolarHBondContact ND2-O 2.95Å; N620-L1049 HydrophobicContact CB-CB 4.32Å; N620-L1091 HydrophobicContact CB-CB 4.11Å; N620-L1091 HydrophobicContact CB-CD1 3.87Å; N620-L1091 PolarHBondContact ND2-O 3.31Å; N620-L1091 VanDerWaalsContact ND2-O 3.13Å; N620-Q1093 PolarHBondContact ND2-NE2 3.29Å; N620-Q1093 PolarHBondContact O-NE2 3Å
621	P	90.6	Very high	80.7	Confident	11 Å²	11	77 Å²	77	7%	0.071	38%	0.38	C	S	.	.			trans	-67.7	136.7	177.3	25.6	-31.5	0	0	0	112.3	F588 I606 L618 V625	F588-P621 HydrophobicContact CB-CG 3.97Å; F588-P621 HydrophobicContact CD1-CG 4.05Å; F588-P621 VanDerWaalsContact CD1-O 3.26Å; F588-P621 WeakPolarHBondContact CD1-O 3.46Å; F588-P621 HydrophobicContact CD2-CG 3.84Å; F588-P621 HydrophobicContact CE2-CG 4.33Å; F588-P621 HydrophobicContact CG-CG 3.69Å; I606-P621 HydrophobicContact CD1-CG 3.81Å; I606-P621 HydrophobicContact CG1-CG 3.84Å; L618-P621 HydrophobicContact CB-CB 4.17Å; L618-P621 HydrophobicContact CB-CG 4.1Å; L618-P621 HydrophobicContact CD1-CB 4.43Å; P621-V625 HydrophobicContact CB-CB 3.98Å; P621-V625 HydrophobicContact CB-CG1 4.37Å; P621-V625 HydrophobicContact CB-CG2 3.73Å
622	G	85.6	Confident	82.3	Confident	6 Å²	6	68.1 Å²	68.1	6%	0.062	34%	0.339	C	S	.	.			trans	-69.2	171.7	-178.9	0	0	0	0	0	114.8	H624 V625	G622-H624 PolarHBondContact O-N 2.9Å; G622-V625 PolarHBondContact O-N 3.3Å
623	N	86.8	Confident	84.1	Confident	80 Å²	80	59.8 Å²	59.8	43%	0.428	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.6	-14.1	-174.4	-77.4	-40.9	0	0	0	117.4	P589 N1047	P589-N623 WeakPolarHBondContact CD-OD1 3.26Å; P589-N623 WeakPolarHBondContact CG-OD1 3.25Å; N623-N1047 PolarHBondContact ND2-OD1 3.4Å
624	H	84.3	Confident	86.2	Confident	158 Å²	158	48.6 Å²	48.6	73%	0.731	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.4	-24.7	175.5	62.8	-98	0	0	0	112.7	G622	G622-H624 PolarHBondContact O-N 2.9Å
625	V	86.8	Confident	87.8	Confident	16 Å²	16	43.6 Å²	43.6	10%	0.097	23%	0.234	C	C	.	.			trans	-82.3	128	175.1	-175	0	0	0	0	109.8	I606 F608 P621 G622	I606-V625 HydrophobicContact CD1-CG1 4.24Å; F608-V625 HydrophobicContact CD2-CG1 4.01Å; F608-V625 HydrophobicContact CE2-CG1 4.09Å; P621-V625 HydrophobicContact CB-CB 3.98Å; P621-V625 HydrophobicContact CB-CG1 4.37Å; P621-V625 HydrophobicContact CB-CG2 3.73Å; G622-V625 PolarHBondContact O-N 3.3Å
626	K	89.6	Confident	89	Confident	136 Å²	136	40.1 Å²	40.1	59%	0.591	21%	0.21	S	C	*	.	B	Isolated β-bridge	trans	-109	143	173	-68.6	-175.6	168.2	-170.2	0	110.7	G585 L586	G585-K626 WeakPolarHBondContact O-CD 3.26Å; L586-K626 WeakPolarHBondContact O-CA 3.44Å
627	L	89.4	Confident	89.7	Confident	5 Å²	5	37.6 Å²	37.6	3%	0.026	19%	0.193	C	C	.	.	P	Polyproline II helix	trans	-71.6	135.4	179.8	-64.2	166.8	0	0	0	111.1	L579 F583 G585 L586 V591 I606 T631	L579-L627 HydrophobicContact CD1-CD1 4.11Å; L579-L627 HydrophobicContact CD1-CD2 3.77Å; L579-L627 HydrophobicContact CD1-CG 4.48Å; F583-L627 HydrophobicContact CB-CD1 4.13Å; G585-L627 PolarHBondContact N-O 3Å; L586-L627 PolarHBondContact O-N 3.3Å; V591-L627 HydrophobicContact CB-CD1 3.77Å; V591-L627 HydrophobicContact CG1-CD1 3.95Å; V591-L627 HydrophobicContact CG2-CD1 3.48Å; V591-L627 VanDerWaalsContact CG2-CD1 3.48Å; I606-L627 HydrophobicContact CD1-CD2 3.67Å; I606-L627 HydrophobicContact CG2-CD2 3.96Å; L627-T631 HydrophobicContact CD2-CG2 4.07Å
628	Q	88.1	Confident	89.6	Confident	77 Å²	77	39.9 Å²	39.9	36%	0.36	21%	0.21	S	C	.	.	P	Polyproline II helix	trans	-96.2	167.8	176	-59.8	-179.4	14.3	0	0	110	K609 T631	K609-Q628 PolarHBondContact O-NE2 3.48Å; Q628-T631 PolarHBondContact N-OG1 3.26Å; Q628-T631 PolarHBondContact O-OG1 2.83Å
629	E	87.1	Confident	89.4	Confident	142 Å²	142	39.7 Å²	39.7	66%	0.664	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.5	137	169.3	-172.7	154.5	-141.7	0	0	110.2	V584 T631	V584-E629 HydrophobicContact CG2-CB 4.01Å; E629-T631 VanDerWaalsContact C-N 3.35Å
630	G	86	Confident	88.9	Confident	35 Å²	35	39.3 Å²	39.3	36%	0.361	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	75.5	17.4	-175.2	0	0	0	0	0	115.1	K609	K609-G630 PolarHBondContact NZ-O 3.08Å
631	T	90.6	Very high	88.5	Confident	4 Å²	4	44.6 Å²	44.6	3%	0.025	23%	0.234	C	C	.	.			trans	-67.4	126.6	166.4	-69.4	0	0	0	0	110.7	L579 I606 L627 Q628 E629	L579-T631 HydrophobicContact CD1-CG2 3.91Å; L579-T631 PolarHBondContact N-O 2.74Å; L579-T631 VanDerWaalsContact N-O 3.08Å; I606-T631 HydrophobicContact CB-CG2 3.73Å; I606-T631 HydrophobicContact CG2-CG2 3.8Å; L627-T631 HydrophobicContact CD2-CG2 4.07Å; Q628-T631 PolarHBondContact N-OG1 3.26Å; Q628-T631 PolarHBondContact O-OG1 2.83Å; E629-T631 VanDerWaalsContact C-N 3.35Å
632	L	91.8	Very high	88.3	Confident	9 Å²	9	46 Å²	46	5%	0.047	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	132.4	167.4	-168.9	75.2	0	0	0	109.4	Y578 I606 E607 F634	Y578-L632 HydrophobicContact CD1-CB 4.45Å; Y578-L632 HydrophobicContact CD1-CD1 4.2Å; Y578-L632 HydrophobicContact CD2-CD1 4.09Å; Y578-L632 HydrophobicContact CE1-CB 4.27Å; Y578-L632 HydrophobicContact CE1-CD1 4.12Å; Y578-L632 HydrophobicContact CE2-CD1 4Å; Y578-L632 HydrophobicContact CG-CD1 4.2Å; I606-L632 CarbonylContact C-O 3.41Å; I606-L632 WeakPolarHBondContact CA-O 3.42Å; E607-L632 HydrophobicContact CB-CB 3.86Å; E607-L632 PolarHBondContact N-O 3.23Å; L632-F634 HydrophobicContact CD2-CE2 4.47Å; L632-F634 HydrophobicContact CD2-CZ 4.28Å
633	G	93.5	Very high	88.5	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	145	172.6	0	0	0	0	0	111.7	T576 E577 F635	T576-G633 WeakPolarHBondContact CA-O 3.33Å; E577-G633 PolarHBondContact N-O 3.19Å; E577-G633 PolarHBondContact O-N 3.22Å; G633-F635 WeakPolarHBondContact O-CD2 3.17Å
634	F	94.4	Very high	88.6	Confident	2 Å²	2	46 Å²	46	1%	0.009	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	120.8	176.4	-64	-100.9	0	0	0	109.5	Y575 T576 I604 A605 I617 L632 N971 L975	Y575-F634 WeakPolarHBondContact O-CA 3.49Å; T576-F634 HydrophobicContact CG2-CD1 3.63Å; T576-F634 HydrophobicContact CG2-CE1 3.73Å; T576-F634 HydrophobicContact CG2-CG 4.49Å; I604-F634 PolarHBondContact N-O 2.88Å; A605-F634 HydrophobicContact CB-CB 4.05Å; A605-F634 HydrophobicContact CB-CD2 3.93Å; A605-F634 HydrophobicContact CB-CG 4.21Å; A605-F634 PolarHBondContact O-N 3Å; I617-F634 HydrophobicContact CD1-CE1 4.28Å; I617-F634 HydrophobicContact CD1-CE2 4.32Å; I617-F634 HydrophobicContact CD1-CZ 3.64Å; I617-F634 HydrophobicContact CG1-CE2 4.18Å; I617-F634 HydrophobicContact CG1-CZ 3.97Å; I617-F634 HydrophobicContact CG2-CD2 4.47Å; I617-F634 HydrophobicContact CG2-CE2 3.99Å; I617-F634 HydrophobicContact CG2-CZ 4.26Å; L632-F634 HydrophobicContact CD2-CE2 4.47Å; L632-F634 HydrophobicContact CD2-CZ 4.28Å; F634-N971 HydrophobicContact CE1-CB 3.61Å; F634-N971 HydrophobicContact CZ-CB 3.76Å; F634-L975 HydrophobicContact CB-CD2 3.72Å; F634-L975 HydrophobicContact CD1-CB 4.21Å; F634-L975 HydrophobicContact CD1-CD2 3.36Å; F634-L975 HydrophobicContact CD1-CG 4.38Å; F634-L975 HydrophobicContact CE1-CB 4.06Å; F634-L975 HydrophobicContact CE1-CD2 4.07Å; F634-L975 HydrophobicContact CG-CD2 3.67Å
635	F	94	Very high	88.9	Confident	0 Å²	0	39 Å²	39	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	149.6	-170.2	-63.3	-89.7	0	0	0	111.8	M574 Y575 E577 L579 L601 L602 L603 G633 V643 A646	M574-F635 WeakPolarHBondContact CA-O 3.3Å; Y575-F635 PolarHBondContact N-O 2.87Å; Y575-F635 PolarHBondContact O-N 2.91Å; E577-F635 HydrophobicContact CB-CD2 4.33Å; E577-F635 HydrophobicContact CB-CE2 4.08Å; L579-F635 HydrophobicContact CD2-CE2 4.46Å; L579-F635 HydrophobicContact CD2-CZ 3.78Å; L601-F635 HydrophobicContact CB-CD1 3.89Å; L601-F635 HydrophobicContact CB-CE1 4.26Å; L601-F635 HydrophobicContact CD1-CD1 4.46Å; L601-F635 HydrophobicContact CD1-CE1 4.42Å; L602-F635 CarbonylContact O-C 3.56Å; L602-F635 VanDerWaalsContact O-CA 3.29Å; L602-F635 WeakPolarHBondContact O-CA 3.35Å; L603-F635 HydrophobicContact CB-CD1 3.96Å; L603-F635 HydrophobicContact CB-CE1 3.8Å; L603-F635 HydrophobicContact CD1-CD1 4.22Å; L603-F635 HydrophobicContact CD1-CE1 3.9Å; L603-F635 HydrophobicContact CD1-CE2 4.31Å; L603-F635 HydrophobicContact CD1-CZ 3.95Å; L603-F635 HydrophobicContact CG-CE1 4.3Å; G633-F635 WeakPolarHBondContact O-CD2 3.17Å; F635-V643 HydrophobicContact CB-CG1 4.03Å; F635-V643 HydrophobicContact CD2-CG1 3.61Å; F635-V643 HydrophobicContact CE2-CG1 4.23Å; F635-V643 HydrophobicContact CG-CG1 3.9Å; F635-A646 HydrophobicContact CE1-CB 4.18Å; F635-A646 HydrophobicContact CE2-CB 4.17Å; F635-A646 HydrophobicContact CZ-CB 3.61Å
636	I	94.1	Very high	89.1	Confident	2 Å²	2	38.2 Å²	38.2	1%	0.01	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	131.6	156	-60.5	179.7	0	0	0	108.4	L548 N572 E573 L602 I604 N1075	L548-I636 HydrophobicContact CD1-CD1 3.52Å; L548-I636 HydrophobicContact CD1-CG1 4.29Å; L548-I636 HydrophobicContact CD2-CD1 3.78Å; L548-I636 HydrophobicContact CD2-CG1 4.1Å; L548-I636 HydrophobicContact CD2-CG2 3.75Å; L548-I636 HydrophobicContact CG-CD1 4.33Å; N572-I636 HydrophobicContact CB-CG2 3.66Å; E573-I636 WeakPolarHBondContact O-CA 3.48Å; L602-I636 HydrophobicContact CB-CB 4.31Å; L602-I636 HydrophobicContact CD2-CB 4.38Å; L602-I636 HydrophobicContact CD2-CD1 4.31Å; L602-I636 PolarHBondContact N-O 2.67Å; L602-I636 PolarHBondContact O-N 3.31Å; I604-I636 HydrophobicContact CD1-CD1 3.36Å; I604-I636 HydrophobicContact CD1-CG1 3.77Å; I636-N1075 HydrophobicContact CG2-CB 3.76Å
637	A	90.6	Very high	89.2	Confident	2 Å²	2	34.9 Å²	34.9	2%	0.017	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.7	172.6	175.6	0	0	0	0	0	110.2	E573 Y575 L601 V643	E573-A637 PolarHBondContact N-O 3.08Å; E573-A637 PolarHBondContact O-N 3.07Å; Y575-A637 HydrophobicContact CD2-CB 4.24Å; Y575-A637 HydrophobicContact CE2-CB 4.48Å; Y575-A637 WeakPolarHBondContact CE2-O 3.37Å; L601-A637 HydrophobicContact CD2-CB 3.68Å; A637-V643 HydrophobicContact CB-CG2 3.63Å
638	S	86.4	Confident	89.2	Confident	72 Å²	72	37.5 Å²	37.5	50%	0.503	19%	0.193	S	C	.	.	S	Bend	trans	-100.5	-1.6	-177.7	51.3	0	0	0	0	116.3	A571	A571-S638 VanDerWaalsContact O-CA 3.23Å; A571-S638 WeakPolarHBondContact O-CA 3.39Å; A571-S638 WeakPolarHBondContact O-CB 3.43Å
639	D	83.6	Confident	89.3	Confident	49 Å²	49	34.3 Å²	34.3	26%	0.262	18%	0.178	S	C	.	.			trans	-157.8	134.5	174.4	174.1	0.2	0	0	0	109	K641 E642	D639-K641 PolarHBondContact O-N 3.49Å; D639-K641 WeakPolarHBondContact OD1-CB 3.32Å; D639-K641 VanDerWaalsContact OD1-CG 3.29Å; D639-K641 WeakPolarHBondContact OD1-CG 3.25Å; D639-K641 PolarHBondContact OD1-N 3.27Å; D639-K641 IonicContact OD1-NZ 3.32Å; D639-K641 PolarHBondContact OD1-NZ 3.41Å; D639-K641 WeakPolarHBondContact OD2-CB 3.38Å; D639-K641 WeakPolarHBondContact OD2-CD 3.07Å; D639-K641 IonicContact OD2-NZ 2.69Å; D639-E642 HydrophobicContact CB-CG 3.89Å; D639-E642 VanDerWaalsContact O-CB 3.25Å; D639-E642 WeakPolarHBondContact O-CB 3.47Å; D639-E642 PolarHBondContact O-N 3Å
640	A	81.6	Confident	89.4	Confident	20 Å²	20	28.6 Å²	28.6	17%	0.165	15%	0.153	C	C	.	.	H	α-helix	trans	-49.1	-33.3	173.2	0	0	0	0	0	113.2	Y575 E642 V643 K644	Y575-A640 HydrophobicContact CD1-CB 4.16Å; Y575-A640 HydrophobicContact CE1-CB 3.67Å; Y575-A640 VanDerWaalsContact CZ-N 3.32Å; Y575-A640 PolarHBondContact OH-N 2.88Å; A640-E642 VanDerWaalsContact C-N 3.33Å; A640-E642 PolarHBondContact O-N 2.86Å; A640-V643 PolarHBondContact O-N 2.94Å; A640-K644 PolarHBondContact O-N 3.34Å
641	K	83.7	Confident	89.4	Confident	110 Å²	110	33.1 Å²	33.1	48%	0.478	16%	0.163	S	C	.	.	H	α-helix	trans	-70.3	-27.3	179.2	-56.9	161.8	-152.6	57.9	0	112.4	D407 D639	D407-K641 WeakPolarHBondContact OD1-CE 3.35Å; D407-K641 IonicContact OD1-NZ 3.9Å; D407-K641 PolarHBondContact OD1-NZ 3.32Å; D639-K641 PolarHBondContact O-N 3.49Å; D639-K641 WeakPolarHBondContact OD1-CB 3.32Å; D639-K641 VanDerWaalsContact OD1-CG 3.29Å; D639-K641 WeakPolarHBondContact OD1-CG 3.25Å; D639-K641 PolarHBondContact OD1-N 3.27Å; D639-K641 IonicContact OD1-NZ 3.32Å; D639-K641 PolarHBondContact OD1-NZ 3.41Å; D639-K641 WeakPolarHBondContact OD2-CB 3.38Å; D639-K641 WeakPolarHBondContact OD2-CD 3.07Å; D639-K641 IonicContact OD2-NZ 2.69Å
642	E	87.4	Confident	89.1	Confident	41 Å²	41	37.6 Å²	37.6	19%	0.192	20%	0.201	C	C	.	.	H	α-helix	trans	-66.4	-41.1	172.1	-62.2	-96.9	111	0	0	110	L601 D639 A640 K644 R645	L601-E642 HydrophobicContact CD2-CB 4.15Å; D639-E642 HydrophobicContact CB-CG 3.89Å; D639-E642 VanDerWaalsContact O-CB 3.25Å; D639-E642 WeakPolarHBondContact O-CB 3.47Å; D639-E642 PolarHBondContact O-N 3Å; A640-E642 VanDerWaalsContact C-N 3.33Å; A640-E642 PolarHBondContact O-N 2.86Å; E642-K644 PolarHBondContact O-N 2.93Å; E642-R645 VanDerWaalsContact CD-NH2 3.3Å; E642-R645 VanDerWaalsContact O-CB 3.26Å; E642-R645 WeakPolarHBondContact O-CB 3.18Å; E642-R645 WeakPolarHBondContact O-CG 3.27Å; E642-R645 PolarHBondContact O-N 3.29Å; E642-R645 PolarHBondContact O-NE 2.98Å; E642-R645 IonicContact OE1-CZ 3.15Å; E642-R645 IonicContact OE1-NH1 2.73Å; E642-R645 PolarHBondContact OE1-NH1 3.23Å; E642-R645 IonicContact OE1-NH2 3.7Å; E642-R645 IonicContact OE2-CZ 2.67Å; E642-R645 VanDerWaalsContact OE2-CZ 3.31Å; E642-R645 IonicContact OE2-NH1 2.8Å; E642-R645 PolarHBondContact OE2-NH1 2.98Å; E642-R645 VanDerWaalsContact OE2-NH1 3.11Å; E642-R645 IonicContact OE2-NH2 3.89Å; E642-R645 PolarHBondContact OE2-NH2 3.2Å
643	V	89.1	Confident	88.8	Confident	1 Å²	1	40 Å²	40	1%	0.006	22%	0.217	C	C	.	.	H	α-helix	trans	-68.8	-34	-175.2	-167.9	0	0	0	0	112.4	Y575 E577 L601 F635 A637 A640 R645 A646	Y575-V643 HydrophobicContact CD2-CG2 3.61Å; Y575-V643 HydrophobicContact CE2-CG2 4.36Å; Y575-V643 HydrophobicContact CG-CG2 3.84Å; E577-V643 HydrophobicContact CB-CG1 3.68Å; E577-V643 HydrophobicContact CG-CG1 4.34Å; L601-V643 HydrophobicContact CD2-CG2 4.27Å; F635-V643 HydrophobicContact CB-CG1 4.03Å; F635-V643 HydrophobicContact CD2-CG1 3.61Å; F635-V643 HydrophobicContact CE2-CG1 4.23Å; F635-V643 HydrophobicContact CG-CG1 3.9Å; A637-V643 HydrophobicContact CB-CG2 3.63Å; A640-V643 PolarHBondContact O-N 2.94Å; V643-R645 PolarHBondContact O-N 2.75Å; V643-A646 WeakPolarHBondContact O-CB 3.41Å; V643-A646 PolarHBondContact O-N 2.9Å
644	K	88.8	Confident	88.5	Confident	84 Å²	84	40.6 Å²	40.6	37%	0.365	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-21.7	174.3	-63	-76.6	164.1	-135.2	0	113.3	E577 A640 E642 A646 F647 F648	E577-K644 IonicContact OE1-NZ 3.64Å; E577-K644 PolarHBondContact OE1-NZ 3.33Å; E577-K644 WeakPolarHBondContact OE2-CD 3.33Å; E577-K644 VanDerWaalsContact OE2-CE 3.22Å; E577-K644 WeakPolarHBondContact OE2-CE 3.42Å; E577-K644 IonicContact OE2-NZ 3.53Å; E577-K644 PolarHBondContact OE2-NZ 3.19Å; A640-K644 PolarHBondContact O-N 3.34Å; E642-K644 PolarHBondContact O-N 2.93Å; K644-A646 VanDerWaalsContact C-N 3.25Å; K644-A646 PolarHBondContact O-N 3.41Å; K644-F647 PolarHBondContact O-N 2.96Å; K644-F648 HydrophobicContact CB-CD2 4.38Å; K644-F648 HydrophobicContact CB-CE2 3.99Å; K644-F648 VanDerWaalsContact O-CD2 3.25Å; K644-F648 WeakPolarHBondContact O-CD2 3.37Å; K644-F648 PolarHBondContact O-N 2.97Å
645	R	90.4	Very high	88	Confident	12 Å²	12	43.4 Å²	43.4	5%	0.045	24%	0.235	C	C	.	.	H	α-helix	trans	-58.5	-33.1	172.8	-64.5	-172.2	-65.7	-119.5	6.8	113	L599 E642 V643 F647 F648 Y649 P660 I663	L599-R645 HydrophobicContact CD2-CB 4.48Å; L599-R645 VanDerWaalsContact O-CZ 3.28Å; L599-R645 PolarHBondContact O-NE 3.35Å; L599-R645 PolarHBondContact O-NH2 2.72Å; E642-R645 VanDerWaalsContact CD-NH2 3.3Å; E642-R645 VanDerWaalsContact O-CB 3.26Å; E642-R645 WeakPolarHBondContact O-CB 3.18Å; E642-R645 WeakPolarHBondContact O-CG 3.27Å; E642-R645 PolarHBondContact O-N 3.29Å; E642-R645 PolarHBondContact O-NE 2.98Å; E642-R645 IonicContact OE1-CZ 3.15Å; E642-R645 IonicContact OE1-NH1 2.73Å; E642-R645 PolarHBondContact OE1-NH1 3.23Å; E642-R645 IonicContact OE1-NH2 3.7Å; E642-R645 IonicContact OE2-CZ 2.67Å; E642-R645 VanDerWaalsContact OE2-CZ 3.31Å; E642-R645 IonicContact OE2-NH1 2.8Å; E642-R645 PolarHBondContact OE2-NH1 2.98Å; E642-R645 VanDerWaalsContact OE2-NH1 3.11Å; E642-R645 IonicContact OE2-NH2 3.89Å; E642-R645 PolarHBondContact OE2-NH2 3.2Å; V643-R645 PolarHBondContact O-N 2.75Å; R645-F647 VanDerWaalsContact C-N 3.34Å; R645-F647 PolarHBondContact O-N 3.36Å; R645-F648 PolarHBondContact O-N 3.17Å; R645-Y649 PolarHBondContact O-N 3.5Å; R645-P660 WeakPolarHBondContact CD-O 3.3Å; R645-I663 HydrophobicContact CB-CG2 4.26Å; R645-I663 HydrophobicContact CG-CB 4.4Å; R645-I663 HydrophobicContact CG-CG2 4.48Å
646	A	91.3	Very high	87.6	Confident	0 Å²	0	51.1 Å²	51.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-64.4	-36.5	178.8	0	0	0	0	0	112.7	S580 L599 L601 F635 V643 K644	S580-A646 VanDerWaalsContact CB-O 3.27Å; S580-A646 WeakPolarHBondContact CB-O 3.36Å; S580-A646 PolarHBondContact N-O 2.87Å; S580-A646 VanDerWaalsContact N-O 3.16Å; L599-A646 HydrophobicContact CD1-CB 4.27Å; L601-A646 HydrophobicContact CD1-CB 4.06Å; F635-A646 HydrophobicContact CE1-CB 4.18Å; F635-A646 HydrophobicContact CE2-CB 4.17Å; F635-A646 HydrophobicContact CZ-CB 3.61Å; V643-A646 WeakPolarHBondContact O-CB 3.41Å; V643-A646 PolarHBondContact O-N 2.9Å; K644-A646 VanDerWaalsContact C-N 3.25Å; K644-A646 PolarHBondContact O-N 3.41Å
647	F	91.4	Very high	87.1	Confident	65 Å²	65	52.3 Å²	52.3	29%	0.285	28%	0.283	S	S	.	.	H	α-helix	trans	-76.3	-32.7	175.2	-176.1	-107	0	0	0	112.7	E577 Y578 K644 R645	E577-F647 HydrophobicContact CG-CB 4.13Å; Y578-F647 WeakPolarHBondContact O-CA 3.14Å; Y578-F647 WeakPolarHBondContact O-CB 3.31Å; Y578-F647 WeakPolarHBondContact O-CD2 3.44Å; K644-F647 PolarHBondContact O-N 2.96Å; R645-F647 VanDerWaalsContact C-N 3.34Å; R645-F647 PolarHBondContact O-N 3.36Å
648	F	90.1	Very high	86.5	Confident	61 Å²	61	57.4 Å²	57.4	27%	0.268	31%	0.314	S	S	.	.	H	α-helix	trans	-86.4	-8.6	-179.9	-61.1	-38.7	0	0	0	114.9	K644 R645 C650 H654 K665	K644-F648 HydrophobicContact CB-CD2 4.38Å; K644-F648 HydrophobicContact CB-CE2 3.99Å; K644-F648 VanDerWaalsContact O-CD2 3.25Å; K644-F648 WeakPolarHBondContact O-CD2 3.37Å; K644-F648 PolarHBondContact O-N 2.97Å; R645-F648 PolarHBondContact O-N 3.17Å; F648-C650 PolarHBondContact O-N 3.11Å; F648-H654 PolarHBondContact O-CE1 2.9Å; F648-H654 VanDerWaalsContact O-CE1 3.32Å; F648-K665 HydrophobicContact CD1-CB 3.71Å; F648-K665 HydrophobicContact CD1-CG 3.98Å; F648-K665 HydrophobicContact CE1-CB 3.79Å; F648-K665 HydrophobicContact CE1-CD 4.14Å; F648-K665 HydrophobicContact CE1-CG 4.01Å; F648-K665 HydrophobicContact CG-CB 4.15Å; F648-K665 HydrophobicContact CZ-CB 4.29Å
649	Y	90.1	Very high	86.4	Confident	9 Å²	9	57.5 Å²	57.5	4%	0.035	31%	0.309	C	S	.	.			trans	-59.2	136.5	-178.5	-169.9	-110.1	0	0	0	112	S580 A582 F583 L599 R645 H654 D655	S580-Y649 VanDerWaalsContact CB-O 3.28Å; S580-Y649 WeakPolarHBondContact CB-O 3.14Å; S580-Y649 PolarHBondContact OG-O 2.96Å; A582-Y649 HydrophobicContact CB-CD1 4.28Å; F583-Y649 AromaticContact CE1-CD1 3.71Å; F583-Y649 HydrophobicContact CE1-CD1 3.71Å; F583-Y649 HydrophobicContact CE1-CE1 4.12Å; F583-Y649 HydrophobicContact CE2-CD1 4.25Å; F583-Y649 AromaticContact CZ-CD1 3.48Å; F583-Y649 HydrophobicContact CZ-CD1 3.48Å; F583-Y649 VanDerWaalsContact CZ-CD1 3.48Å; F583-Y649 HydrophobicContact CZ-CE1 4.28Å; F583-Y649 AromaticContact CZ-CG 3.91Å; F583-Y649 HydrophobicContact CZ-CG 3.91Å; L599-Y649 HydrophobicContact CD2-CD2 3.72Å; L599-Y649 HydrophobicContact CD2-CE2 4.26Å; L599-Y649 HydrophobicContact CD2-CG 4.37Å; R645-Y649 PolarHBondContact O-N 3.5Å; Y649-H654 HydrophobicContact CD2-CB 4.01Å; Y649-H654 HydrophobicContact CE2-CB 3.76Å; Y649-D655 PolarHBondContact OH-OD1 3.25Å
650	C	89.3	Confident	86.3	Confident	22 Å²	22	56.1 Å²	56.1	15%	0.149	30%	0.302	C	S	.	.			trans	-148.1	114.5	179	-178.4	0	0	0	0	108.4	F648 A652 C653 H654 C666	F648-C650 PolarHBondContact O-N 3.11Å; C650-A652 VanDerWaalsContact C-N 3.29Å; C650-A652 PolarHBondContact O-N 3.42Å; C650-C653 HydrophobicContact CB-CB 4.31Å; C650-C653 PolarHBondContact O-N 2.87Å; C650-H654 PolarHBondContact N-ND1 3.33Å; C650-H654 WeakPolarHBondContact O-CB 2.99Å; C650-H654 PolarHBondContact O-N 2.91Å; C650-C666 HydrophobicContact CB-CB 4.46Å; C650-C666 VanDerWaalsContact CB-SG 3.51Å
651	K	85.6	Confident	86.5	Confident	130 Å²	130	63.1 Å²	63.1	57%	0.565	33%	0.329	S	S	*	.	H	α-helix	trans	-54.1	-45.5	-172.9	-165.8	171.6	-175.4	171.9	0	112.6	C653 D655	K651-C653 PolarHBondContact O-N 3.48Å; K651-C653 VanDerWaalsContact O-N 3.15Å; K651-D655 VanDerWaalsContact CE-CG 3.47Å; K651-D655 WeakPolarHBondContact CE-OD1 3.35Å; K651-D655 WeakPolarHBondContact CE-OD2 3.19Å; K651-D655 HydrophobicContact CG-CB 4.47Å; K651-D655 VanDerWaalsContact CG-CG 3.48Å; K651-D655 WeakPolarHBondContact CG-OD1 3.43Å; K651-D655 WeakPolarHBondContact CG-OD2 3.48Å; K651-D655 IonicContact NZ-OD2 2.82Å; K651-D655 WeakPolarHBondContact O-CB 3.44Å; K651-D655 PolarHBondContact O-N 2.95Å
652	A	84.9	Confident	86.5	Confident	98 Å²	98	65.4 Å²	65.4	81%	0.81	34%	0.335	S	S	*	.	H	α-helix	trans	-65.8	-14.7	-179.2	0	0	0	0	0	115.3	C650	C650-A652 VanDerWaalsContact C-N 3.29Å; C650-A652 PolarHBondContact O-N 3.42Å
653	C	84.8	Confident	86.3	Confident	59 Å²	59	63.9 Å²	63.9	40%	0.399	33%	0.328	S	S	.	.	H	α-helix	trans	-113.5	-26.3	-179.5	-65.5	0	0	0	0	113.3	C650 K651 C666 C668	C650-C653 HydrophobicContact CB-CB 4.31Å; C650-C653 PolarHBondContact O-N 2.87Å; K651-C653 PolarHBondContact O-N 3.48Å; K651-C653 VanDerWaalsContact O-N 3.15Å; C653-C666 HydrophobicContact CB-CB 4.28Å; C653-C668 PolarHBondContact SG-SG 3.35Å
654	H	87.6	Confident	86.1	Confident	14 Å²	14	70.8 Å²	70.8	7%	0.065	36%	0.358	C	S	.	.	H	α-helix	trans	-124.8	-2.2	-163.7	-53.3	154.1	0	0	0	114.5	F648 Y649 C650 D656 I657 K664	F648-H654 PolarHBondContact O-CE1 2.9Å; F648-H654 VanDerWaalsContact O-CE1 3.32Å; Y649-H654 HydrophobicContact CD2-CB 4.01Å; Y649-H654 HydrophobicContact CE2-CB 3.76Å; C650-H654 PolarHBondContact N-ND1 3.33Å; C650-H654 WeakPolarHBondContact O-CB 2.99Å; C650-H654 PolarHBondContact O-N 2.91Å; H654-D656 VanDerWaalsContact C-N 3.32Å; H654-D656 PolarHBondContact O-N 2.98Å; H654-I657 HydrophobicContact CB-CD1 4.17Å; H654-I657 PolarHBondContact O-N 3.06Å; H654-K664 PolarHBondContact CE1-O 3.03Å; H654-K664 VanDerWaalsContact CE1-O 3.23Å
655	D	83.9	Confident	85.7	Confident	60 Å²	60	74.7 Å²	74.7	32%	0.321	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	-44.5	177.8	-113.4	8.8	0	0	0	111.9	K598 Y649 K651 I657	K598-D655 PolarHBondContact NZ-O 3.32Å; Y649-D655 PolarHBondContact OH-OD1 3.25Å; K651-D655 VanDerWaalsContact CE-CG 3.47Å; K651-D655 WeakPolarHBondContact CE-OD1 3.35Å; K651-D655 WeakPolarHBondContact CE-OD2 3.19Å; K651-D655 HydrophobicContact CG-CB 4.47Å; K651-D655 VanDerWaalsContact CG-CG 3.48Å; K651-D655 WeakPolarHBondContact CG-OD1 3.43Å; K651-D655 WeakPolarHBondContact CG-OD2 3.48Å; K651-D655 IonicContact NZ-OD2 2.82Å; K651-D655 WeakPolarHBondContact O-CB 3.44Å; K651-D655 PolarHBondContact O-N 2.95Å; D655-I657 VanDerWaalsContact C-N 3.28Å; D655-I657 PolarHBondContact O-N 3.29Å
656	D	84.9	Confident	85.2	Confident	162 Å²	162	76 Å²	76	87%	0.866	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-1.3	-177.4	-60.8	-44.1	0	0	0	114.1	H654	H654-D656 VanDerWaalsContact C-N 3.32Å; H654-D656 PolarHBondContact O-N 2.98Å
657	I	83.9	Confident	84.3	Confident	28 Å²	28	80 Å²	80	14%	0.144	43%	0.427	C	S	.	.			trans	-80.4	132.3	-179.1	-62	-178.2	0	0	0	110.1	K598 H654 D655 D659 R662 I663	K598-I657 PolarHBondContact NZ-O 2.85Å; K598-I657 VanDerWaalsContact NZ-O 3.15Å; H654-I657 HydrophobicContact CB-CD1 4.17Å; H654-I657 PolarHBondContact O-N 3.06Å; D655-I657 VanDerWaalsContact C-N 3.28Å; D655-I657 PolarHBondContact O-N 3.29Å; I657-D659 VanDerWaalsContact CG2-O 3.26Å; I657-D659 WeakPolarHBondContact CG2-O 3.3Å; I657-R662 HydrophobicContact CG2-CB 4.07Å; I657-I663 HydrophobicContact CG2-CG1 4.19Å
658	T	78.4	Confident	83.7	Confident	109 Å²	109	79.9 Å²	79.9	67%	0.669	43%	0.433	S	S	*	.			trans	-93.6	-41.5	171.4	51.8	0	0	0	0	112.1	P660	T658-P660 VanDerWaalsContact O-CD 3.31Å; T658-P660 WeakPolarHBondContact O-CD 3.34Å
659	D	83.6	Confident	82.2	Confident	74 Å²	74	85.5 Å²	85.5	40%	0.396	46%	0.458	S	S	.	.			trans	-87.9	110.9	-173.4	-35.7	-51	0	0	0	110.5	I657 K661 R662	I657-D659 VanDerWaalsContact CG2-O 3.26Å; I657-D659 WeakPolarHBondContact CG2-O 3.3Å; D659-K661 PolarHBondContact O-N 3.11Å; D659-K661 VanDerWaalsContact O-N 3.11Å; D659-R662 HydrophobicContact CB-CG 4.13Å; D659-R662 WeakPolarHBondContact O-CB 3.3Å; D659-R662 PolarHBondContact O-N 3Å; D659-R662 WeakPolarHBondContact OD2-CD 3.38Å; D659-R662 IonicContact OD2-NH1 2.76Å; D659-R662 PolarHBondContact OD2-NH1 3Å
660	P	82.5	Confident	80.7	Confident	20 Å²	20	91.6 Å²	91.6	13%	0.13	48%	0.48	C	S	.	.	G	3₁₀ helix	trans	-62.3	-27.1	-176.1	24.3	-34.2	0	0	0	112.6	K600 R645 T658 R662 I663	K600-P660 HydrophobicContact CD-CG 4.32Å; K600-P660 HydrophobicContact CG-CG 4.33Å; R645-P660 WeakPolarHBondContact CD-O 3.3Å; T658-P660 VanDerWaalsContact O-CD 3.31Å; T658-P660 WeakPolarHBondContact O-CD 3.34Å; P660-R662 PolarHBondContact O-N 2.92Å; P660-R662 VanDerWaalsContact O-N 3.09Å; P660-I663 WeakPolarHBondContact O-CB 3.39Å; P660-I663 PolarHBondContact O-N 2.75Å
661	K	84	Confident	78.6	Confident	166 Å²	166	99.3 Å²	99.3	72%	0.722	52%	0.52	S	S	*	.	G	3₁₀ helix	trans	-64	-11.5	175.5	-61.7	-172.2	177.8	-175.5	0	114.1	D659	D659-K661 PolarHBondContact O-N 3.11Å; D659-K661 VanDerWaalsContact O-N 3.11Å
662	R	84.2	Confident	76.5	Confident	159 Å²	159	99.4 Å²	99.4	60%	0.6	52%	0.522	S	S	*	.	G	3₁₀ helix	trans	-90.8	-12.5	173.5	-66	170.9	66.6	-175.6	-2.5	113.4	I657 D659 P660 K664	I657-R662 HydrophobicContact CG2-CB 4.07Å; D659-R662 HydrophobicContact CB-CG 4.13Å; D659-R662 WeakPolarHBondContact O-CB 3.3Å; D659-R662 PolarHBondContact O-N 3Å; D659-R662 WeakPolarHBondContact OD2-CD 3.38Å; D659-R662 IonicContact OD2-NH1 2.76Å; D659-R662 PolarHBondContact OD2-NH1 3Å; P660-R662 PolarHBondContact O-N 2.92Å; P660-R662 VanDerWaalsContact O-N 3.09Å; R662-K664 PolarHBondContact O-N 3.36Å; R662-K664 VanDerWaalsContact O-N 3.16Å
663	I	84.3	Confident	74.2	Confident	9 Å²	9	102.6 Å²	102.6	5%	0.046	53%	0.525	C	S	.	.			trans	-75.2	103.6	178.9	-59.2	178.4	0	0	0	108.6	L599 R645 I657 P660	L599-I663 HydrophobicContact CD2-CD1 3.44Å; L599-I663 VanDerWaalsContact CD2-CD1 3.44Å; R645-I663 HydrophobicContact CB-CG2 4.26Å; R645-I663 HydrophobicContact CG-CB 4.4Å; R645-I663 HydrophobicContact CG-CG2 4.48Å; I657-I663 HydrophobicContact CG2-CG1 4.19Å; P660-I663 WeakPolarHBondContact O-CB 3.39Å; P660-I663 PolarHBondContact O-N 2.75Å
664	K	83.5	Confident	71.6	Confident	146 Å²	146	107.7 Å²	107.7	64%	0.635	54%	0.543	S	S	*	.			trans	-128.8	170.3	-178.8	-64.7	-171.2	178.2	-173.8	0	110.3	H654 R662 C666	H654-K664 PolarHBondContact CE1-O 3.03Å; H654-K664 VanDerWaalsContact CE1-O 3.23Å; R662-K664 PolarHBondContact O-N 3.36Å; R662-K664 VanDerWaalsContact O-N 3.16Å; K664-C666 PolarHBondContact O-N 3.39Å
665	K	81.7	Confident	68.9	Low	166 Å²	166	115.7 Å²	115.7	72%	0.722	58%	0.58	S	S	*	*			trans	-54.7	111.8	179.1	-173.6	178	-179.9	178.5	0	111.1	F648	F648-K665 HydrophobicContact CD1-CB 3.71Å; F648-K665 HydrophobicContact CD1-CG 3.98Å; F648-K665 HydrophobicContact CE1-CB 3.79Å; F648-K665 HydrophobicContact CE1-CD 4.14Å; F648-K665 HydrophobicContact CE1-CG 4.01Å; F648-K665 HydrophobicContact CG-CB 4.15Å; F648-K665 HydrophobicContact CZ-CB 4.29Å
666	C	79.6	Confident	66.5	Low	38 Å²	38	118.6 Å²	118.6	26%	0.257	60%	0.603	S	S	.	*			trans	-77.9	162.7	179.3	66	0	0	0	0	112.5	C650 C653 K664 C668	C650-C666 HydrophobicContact CB-CB 4.46Å; C650-C666 VanDerWaalsContact CB-SG 3.51Å; C653-C666 HydrophobicContact CB-CB 4.28Å; K664-C666 PolarHBondContact O-N 3.39Å; C666-C668 VanDerWaalsContact C-N 3.3Å; C666-C668 PolarHBondContact O-N 2.9Å
667	G	72.8	Confident	63.8	Low	86 Å²	86	116 Å²	116	89%	0.887	60%	0.597	S	S	*	*			trans	-84.4	6.3	177.4	0	0	0	0	0	115.1	K669	G667-K669 PolarHBondContact O-N 3.35Å
668	C	77.7	Confident	61.4	Low	62 Å²	62	121.1 Å²	121.1	42%	0.419	63%	0.63	S	S	.	*	P	Polyproline II helix	trans	-65.7	128.1	-179.8	-65.1	0	0	0	0	110.8	C653 C666 R670	C653-C668 PolarHBondContact SG-SG 3.35Å; C666-C668 VanDerWaalsContact C-N 3.3Å; C666-C668 PolarHBondContact O-N 2.9Å; C668-R670 PolarHBondContact O-N 3.41Å
669	K	59.6	Low	59	Low	178 Å²	178	124.4 Å²	124.4	77%	0.774	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-61.9	133.7	169	-75.3	-170.7	168.3	-164	0	109.7	G667 E672	G667-K669 PolarHBondContact O-N 3.35Å; K669-E672 IonicContact NZ-OE1 2.72Å
670	R	58.1	Low	56.5	Low	137 Å²	137	126 Å²	126	52%	0.517	66%	0.66	S	S	.	*	P	Polyproline II helix	trans	-66.4	153.1	156.6	-71.5	-176.1	172.1	173.8	-3.6	108.8	C668 E672	C668-R670 PolarHBondContact O-N 3.41Å; R670-E672 PolarHBondContact O-N 2.94Å
671	L	44.5	Very low	54.3	Low	185 Å²	185	131 Å²	131	97%	0.969	69%	0.692	S	S	*	*	S	Bend	trans	-78.1	72.5	178.1	-74.4	165.2	0	0	0	110.7
672	E	41.2	Very low	51.5	Low	131 Å²	131	133 Å²	133	61%	0.612	70%	0.701	S	S	*	*			trans	45.9	102.5	158.5	-73.9	168.3	175.3	0	0	119.5	K669 R670 E674	K669-E672 IonicContact NZ-OE1 2.72Å; R670-E672 PolarHBondContact O-N 2.94Å; E672-E674 VanDerWaalsContact C-N 3.25Å; E672-E674 HydrophobicContact CB-CG 4.5Å; E672-E674 PolarHBondContact O-N 3.42Å
673	D	37.7	Very low	49.2	Very low	165 Å²	165	135.5 Å²	135.5	88%	0.882	72%	0.716	S	S	*	*			trans	-61.2	80.9	147	-74.6	-72.5	0	0	0	110.9
674	E	30.8	Very low	46.5	Very low	166 Å²	166	144.5 Å²	144.5	78%	0.776	76%	0.755	S	S	*	*			trans	-96.2	77.9	163.7	-84.3	-134.1	130.9	0	0	111.4	E672 P676	E672-E674 VanDerWaalsContact C-N 3.25Å; E672-E674 HydrophobicContact CB-CG 4.5Å; E672-E674 PolarHBondContact O-N 3.42Å; E674-P676 WeakPolarHBondContact O-CD 3.27Å
675	H	30.2	Very low	43.9	Very low	182 Å²	182	145.5 Å²	145.5	84%	0.843	76%	0.761	S	S	*	*			trans	-101.1	97.7	161	-102.8	-47.3	0	0	0	110.2	S677	H675-S677 PolarHBondContact O-N 3.07Å
676	P	34.3	Very low	41.3	Very low	122 Å²	122	147.4 Å²	147.4	79%	0.792	76%	0.764	S	S	*	*			trans	-67.3	132.1	-178.3	25.8	-33.9	0	0	0	111.8	E674	E674-P676 WeakPolarHBondContact O-CD 3.27Å
677	S	27.6	Very low	38.8	Very low	108 Å²	108	152.5 Å²	152.5	76%	0.755	79%	0.789	S	S	*	*			trans	-85	131.9	-169.3	46.9	0	0	0	0	114.3	H675	H675-S677 PolarHBondContact O-N 3.07Å
678	T	33.2	Very low	36.5	Very low	134 Å²	134	152.3 Å²	152.3	82%	0.822	79%	0.787	S	S	*	*			trans	24.4	100.2	153.2	56.4	0	0	0	0	119
679	L	27.9	Very low	34	Very low	179 Å²	179	153.3 Å²	153.3	94%	0.937	81%	0.808	S	S	*	*			trans	-146	134.1	149.4	-111.1	161.5	0	0	0	109.9
680	S	31.8	Very low	32.5	Very low	108 Å²	108	153.1 Å²	153.1	76%	0.755	81%	0.812	S	S	*	*			trans	-118.2	147	-172.2	66.5	0	0	0	0	112.7
681	P	34.9	Very low	31.2	Very low	125 Å²	125	158.5 Å²	158.5	81%	0.812	83%	0.832	S	S	*	*			trans	-136.6	119.9	149.2	31.1	-14.1	0	0	0	115.4
682	K	26.6	Very low	30.3	Very low	208 Å²	208	156 Å²	156	90%	0.904	82%	0.82	S	S	*	*			trans	-0.2	140.9	149.5	-61.7	169.4	-178.8	172.7	0	120.8
683	K	35.3	Very low	29.7	Very low	210 Å²	210	155.1 Å²	155.1	91%	0.913	83%	0.828	S	S	*	*			trans	-33.7	136.3	164.1	-67.5	173.3	172.7	173.5	0	117.7
684	K	27.8	Very low	29.8	Very low	199 Å²	199	152.4 Å²	152.4	87%	0.865	82%	0.819	S	S	*	*			trans	-164.3	122.2	142.6	-119.4	175.4	176.3	-179.8	0	107
685	Q	27.6	Very low	29.5	Very low	166 Å²	166	152.1 Å²	152.1	78%	0.776	82%	0.823	S	S	*	*			cis	105.5	113.8	31.3	-168.5	-171.9	23.6	0	0	112.9
686	R	28.8	Very low	29.2	Very low	207 Å²	207	149.3 Å²	149.3	78%	0.781	82%	0.823	S	S	*	*			trans	79.7	119.3	157.4	-90.7	-170.8	158	171.6	-4.6	122.8
687	N	25.8	Very low	28.9	Very low	144 Å²	144	147.8 Å²	147.8	77%	0.77	82%	0.815	S	S	*	*				61.2	117.3	126.3	-65.5	21.5	0	0	0	122.6
688	G	25.4	Very low	29.1	Very low	83 Å²	83	148.8 Å²	148.8	86%	0.856	82%	0.819	S	S	*	*				123.1	126.2	90.4	0	0	0	0	0	118
689	G	25.1	Very low	28.8	Very low	83 Å²	83	151.8 Å²	151.8	86%	0.856	82%	0.82	S	S	*	*			trans	169.7	103.2	169.8	0	0	0	0	0	113.9
690	M	27.1	Very low	28.8	Very low	173 Å²	173	152.1 Å²	152.1	85%	0.852	82%	0.819	S	S	*	*			trans	-99.1	146.5	178.4	-80.3	142.8	71.7	0	0	112.7
691	R	30.8	Very low	28.5	Very low	251 Å²	251	155.8 Å²	155.8	95%	0.947	83%	0.827	S	S	*	*			trans	-166.8	167.9	131.2	-103.9	160.4	-172.8	-162.7	0.3	111.3
692	N	26.6	Very low	28.1	Very low	132 Å²	132	154.6 Å²	154.6	71%	0.706	82%	0.821	S	S	*	*			trans	-116.1	145	-147.9	-56.9	-9.4	0	0	0	114.6
693	S	28.6	Very low	28.3	Very low	112 Å²	112	155 Å²	155	78%	0.783	82%	0.817	S	S	*	*				30.7	147.4	119.3	-48.3	0	0	0	0	120.1
694	P	40.4	Very low	27.9	Very low	108 Å²	108	152.5 Å²	152.5	70%	0.701	81%	0.808	S	S	*	*			cis	-150.3	-178.5	49	43.1	-22.7	0	0	0	119.6
695	N	23.7	Very low	27.7	Very low	160 Å²	160	149.8 Å²	149.8	86%	0.856	80%	0.803	S	S	*	*			trans	72.8	134.1	174.1	-56.8	-15.3	0	0	0	115.3
696	C	22.9	Very low	28	Very low	124 Å²	124	147.8 Å²	147.8	84%	0.838	81%	0.805	S	S	*	*			cis	-137	170.1	13.5	-160.3	0	0	0	0	112.4
697	S	28.5	Very low	28.3	Very low	89 Å²	89	144.5 Å²	144.5	62%	0.622	80%	0.802	S	S	*	*			trans	-104.2	137.1	-171.2	59.9	0	0	0	0	114.7
698	P	32.8	Very low	28.4	Very low	129 Å²	129	146 Å²	146	84%	0.838	81%	0.809	S	S	*	*			trans	-81.7	136.7	156.1	33	-30.1	0	0	0	110.7
699	K	25.5	Very low	28.8	Very low	198 Å²	198	148 Å²	148	86%	0.861	80%	0.799	S	S	*	*			trans	-118.4	153.3	168.4	-85.4	-172.6	175.1	-178.6	0	110.3
700	M	29.1	Very low	29	Very low	185 Å²	185	150.4 Å²	150.4	91%	0.911	80%	0.799	S	S	*	*			trans	-65.6	147.2	-178.4	-56.5	167.8	68.1	0	0	113
701	M	25.5	Very low	29	Very low	186 Å²	186	145 Å²	145	92%	0.916	79%	0.789	S	S	*	*			trans	-161.5	130.6	140.3	-121.1	173.5	168.4	0	0	114.9
702	S	26.3	Very low	29	Very low	99 Å²	99	140.7 Å²	140.7	69%	0.692	78%	0.784	S	S	*	*			trans	43.7	114.6	135.6	-166.6	0	0	0	0	123
703	R	30.3	Very low	29	Very low	217 Å²	217	143.3 Å²	143.3	82%	0.819	79%	0.792	S	S	*	*			trans	39.8	136.4	131.3	-80.8	-178.1	159.4	174	-3.6	123
704	H	28.5	Very low	29.4	Very low	157 Å²	157	147.1 Å²	147.1	73%	0.727	80%	0.798	S	S	*	*			trans	47.3	121.9	144.2	-65.3	-74.6	0	0	0	120.8
705	D	22.6	Very low	29.1	Very low	143 Å²	143	149.3 Å²	149.3	77%	0.765	80%	0.802	S	S	*	*				-161.3	156.3	101.8	-105.5	-18.3	0	0	0	110.5
706	P	33.8	Very low	29.5	Very low	124 Å²	124	150.3 Å²	150.3	81%	0.805	80%	0.801	S	S	*	*				-143.1	122.2	120.1	34.7	-19.7	0	0	0	113.8
707	L	34.2	Very low	30	Very low	138 Å²	138	152 Å²	152	72%	0.723	80%	0.802	S	S	*	*			trans	-141.5	133.4	163.6	-80.2	177.9	0	0	0	110.6	I709	L707-I709 HydrophobicContact CD2-CD1 4.09Å
708	L	29.2	Very low	30.3	Very low	176 Å²	176	156.4 Å²	156.4	92%	0.921	82%	0.815	S	S	*	*			trans	-156.3	116.5	146.9	-112.6	172	0	0	0	108.9
709	I	33.1	Very low	30.8	Very low	124 Å²	124	154.5 Å²	154.5	64%	0.636	80%	0.798	S	S	*	*			trans	-120.5	142.7	-175.5	-63.1	167.3	0	0	0	108.6	L707	L707-I709 HydrophobicContact CD2-CD1 4.09Å
710	P	30.1	Very low	32	Very low	133 Å²	133	151.8 Å²	151.8	86%	0.864	79%	0.79	S	S	*	*			trans	-127.7	126.8	140.8	34.3	-23.1	0	0	0	110.5
711	G	25.7	Very low	33.5	Very low	61 Å²	61	149.6 Å²	149.6	63%	0.629	78%	0.782	S	S	*	*			cis	-164.7	171.6	-4.5	0	0	0	0	0	109.6	E713	G711-E713 PolarHBondContact O-N 3.03Å
712	N	32.1	Very low	35.9	Very low	159 Å²	159	144.2 Å²	144.2	85%	0.85	76%	0.759	S	S	*	*			trans	-58.5	130.5	-171.6	-67.7	11.2	0	0	0	114.6
713	E	26.6	Very low	38.5	Very low	187 Å²	187	143 Å²	143	87%	0.874	74%	0.742	S	S	*	*				-121.5	169	121.4	-70.2	-159.4	147.9	0	0	109.1	G711	G711-E713 PolarHBondContact O-N 3.03Å
714	Q	35.5	Very low	41.1	Very low	193 Å²	193	138.3 Å²	138.3	90%	0.902	72%	0.724	S	S	*	*			trans	-88.7	128.4	-155.5	-65.7	168.2	-21.7	0	0	113.4
715	I	35.9	Very low	44	Very low	153 Å²	153	132.4 Å²	132.4	79%	0.785	70%	0.695	S	S	*	*			trans	-115.8	135	166.6	-61.9	178.4	0	0	0	108.7	N717	I715-N717 PolarHBondContact O-N 2.69Å
716	E	30.4	Very low	47.3	Very low	182 Å²	182	125.7 Å²	125.7	85%	0.85	66%	0.659	S	S	*	*			trans	-80.3	103.1	-167.5	-61.3	-173.8	128.5	0	0	113.3	M718	E716-M718 VanDerWaalsContact C-N 3.28Å; E716-M718 PolarHBondContact O-N 3.11Å
717	N	34.4	Very low	49.9	Very low	160 Å²	160	122.1 Å²	122.1	86%	0.856	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.5	63.6	-179.4	-83	-41.5	0	0	0	113.9	I715	I715-N717 PolarHBondContact O-N 2.69Å
718	M	34.1	Very low	52.4	Low	181 Å²	181	116.1 Å²	116.1	89%	0.892	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.7	-15.6	169.6	-91.5	-163.2	162.5	0	0	116.1	E716	E716-M718 VanDerWaalsContact C-N 3.28Å; E716-M718 PolarHBondContact O-N 3.11Å
719	D	44.4	Very low	55.2	Low	89 Å²	89	107.7 Å²	107.7	48%	0.476	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-90.2	-9.7	-164	-144.5	27.7	0	0	0	115.3	N721 R724	D719-N721 VanDerWaalsContact C-N 3.35Å; D719-N721 PolarHBondContact O-N 2.7Å; D719-R724 IonicContact OD1-CZ 2.76Å; D719-R724 IonicContact OD1-NH2 2.87Å; D719-R724 PolarHBondContact OD1-NH2 2.83Å; D719-R724 IonicContact OD2-CZ 3.99Å; D719-R724 IonicContact OD2-NH1 2.65Å; D719-R724 PolarHBondContact OD2-NH1 3.11Å; D719-R724 IonicContact OD2-NH2 2.79Å; D719-R724 PolarHBondContact OD2-NH2 3.04Å
720	M	51	Low	57.9	Low	140 Å²	140	102.4 Å²	102.4	69%	0.69	54%	0.535	S	S	*	.	G	3₁₀ helix	trans	-70.7	-16.2	-172.5	-82.1	-119.8	65.5	0	0	116.3
721	N	60	Low	60.9	Low	140 Å²	140	96.1 Å²	96.1	75%	0.749	49%	0.494	S	S	*	.	G	3₁₀ helix	trans	-89.5	-3.3	-177.7	-87.5	-12.7	0	0	0	114.2	D719	D719-N721 VanDerWaalsContact C-N 3.35Å; D719-N721 PolarHBondContact O-N 2.7Å
722	V	75.3	Confident	64.1	Low	72 Å²	72	93.4 Å²	93.4	44%	0.436	47%	0.465	S	S	.	.			trans	-86.4	116.4	-177.7	-174.1	0	0	0	0	110.6	R724	V722-R724 HydrophobicContact CB-CG 4.46Å; V722-R724 HydrophobicContact CG1-CG 4Å; V722-R724 PolarHBondContact O-N 3.4Å; V722-R724 VanDerWaalsContact O-N 3.12Å
723	K	80.8	Confident	67.1	Low	75 Å²	75	87.9 Å²	87.9	33%	0.326	43%	0.432	S	S	.	.			trans	-67.6	105.2	170.2	-61.5	-168	164.3	-164.2	0	110.1	W733 G1000 G1001 Y1002	K723-W733 HydrophobicContact CB-CE3 3.93Å; K723-W733 HydrophobicContact CB-CZ3 3.69Å; K723-W733 HydrophobicContact CD-CZ3 4.35Å; K723-G1000 WeakPolarHBondContact CD-O 3.4Å; K723-G1000 WeakPolarHBondContact CE-O 3.49Å; K723-G1000 PolarHBondContact NZ-O 2.98Å; K723-G1001 WeakPolarHBondContact CB-O 3.33Å; K723-G1001 VanDerWaalsContact CG-O 3.26Å; K723-G1001 WeakPolarHBondContact CG-O 3.36Å; K723-Y1002 HydrophobicContact CG-CD1 4.27Å; K723-Y1002 HydrophobicContact CG-CE1 4.17Å
724	R	84.9	Confident	70.2	Confident	117 Å²	117	79.8 Å²	79.8	44%	0.442	40%	0.396	S	S	.	.			trans	-106.8	-14.8	179.9	-67.1	-179.6	175.4	164	3	114.1	D719 V722 W733	D719-R724 IonicContact OD1-CZ 2.76Å; D719-R724 IonicContact OD1-NH2 2.87Å; D719-R724 PolarHBondContact OD1-NH2 2.83Å; D719-R724 IonicContact OD2-CZ 3.99Å; D719-R724 IonicContact OD2-NH1 2.65Å; D719-R724 PolarHBondContact OD2-NH1 3.11Å; D719-R724 IonicContact OD2-NH2 2.79Å; D719-R724 PolarHBondContact OD2-NH2 3.04Å; V722-R724 HydrophobicContact CB-CG 4.46Å; V722-R724 HydrophobicContact CG1-CG 4Å; V722-R724 PolarHBondContact O-N 3.4Å; V722-R724 VanDerWaalsContact O-N 3.12Å; R724-W733 CarbonylContact C-O 3.57Å; R724-W733 PolarHBondContact O-N 3.17Å
725	Y	90.7	Very high	72.8	Confident	34 Å²	34	74.7 Å²	74.7	13%	0.133	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-128	164	-176.2	-60.6	-84.5	0	0	0	110.2	F731 H732 W733 G1001 L1008 R1011	Y725-F731 WeakPolarHBondContact CA-O 3.48Å; Y725-H732 AromaticContact CD1-CD2 3.63Å; Y725-H732 AromaticContact CE1-CD2 3.29Å; Y725-H732 WeakPolarHBondContact CE1-CD2 3.25Å; Y725-H732 AromaticContact CE1-NE2 3.36Å; Y725-H732 WeakPolarHBondContact CE1-NE2 3.38Å; Y725-W733 VanDerWaalsContact C-CB 3.4Å; Y725-G1001 PolarHBondContact O-N 3.16Å; Y725-L1008 HydrophobicContact CE2-CD2 4.05Å; Y725-R1011 PolarHBondContact OH-NE 3.37Å
726	D	90.4	Very high	75.3	Confident	1 Å²	1	70.9 Å²	70.9	1%	0.005	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-70.3	-179.6	170.5	79.8	-69.7	0	0	0	111.7	T728 G729 M730 F731 L998 R999 G1001	D726-T728 VanDerWaalsContact C-N 3.31Å; D726-T728 PolarHBondContact O-N 3.09Å; D726-T728 PolarHBondContact OD1-OG1 2.86Å; D726-T728 WeakPolarHBondContact OD2-CA 3.42Å; D726-T728 WeakPolarHBondContact OD2-CB 3.4Å; D726-T728 PolarHBondContact OD2-N 3.46Å; D726-T728 PolarHBondContact OD2-OG1 3.01Å; D726-G729 PolarHBondContact O-N 3.19Å; D726-G729 WeakPolarHBondContact OD1-CA 3.3Å; D726-G729 PolarHBondContact OD1-N 3.37Å; D726-M730 PolarHBondContact OD1-N 3.38Å; D726-F731 PolarHBondContact N-O 3.49Å; D726-F731 VanDerWaalsContact N-O 3.11Å; D726-F731 PolarHBondContact OD1-N 2.66Å; D726-L998 HydrophobicContact CB-CD2 4.21Å; D726-R999 CarbonylContact C-O 3.09Å; D726-R999 WeakPolarHBondContact CA-O 3.18Å; D726-G1001 VanDerWaalsContact C-N 3.29Å; D726-G1001 WeakPolarHBondContact O-CA 3.42Å; D726-G1001 PolarHBondContact O-N 3.21Å
727	S	88.3	Confident	78.2	Confident	49 Å²	49	65 Å²	65	34%	0.343	34%	0.338	S	S	.	.	S	Bend	trans	-66.3	-26.1	179.5	39.1	0	0	0	0	114.7	R999	S727-R999 PolarHBondContact N-O 3.29Å
728	T	87.6	Confident	81	Confident	12 Å²	12	63.3 Å²	63.3	7%	0.074	33%	0.325	C	S	.	.	S	Bend	trans	-89.4	-25.1	178.1	70.4	0	0	0	0	113.1	D726 M730 L988 L991 N1010	D726-T728 VanDerWaalsContact C-N 3.31Å; D726-T728 PolarHBondContact O-N 3.09Å; D726-T728 PolarHBondContact OD1-OG1 2.86Å; D726-T728 WeakPolarHBondContact OD2-CA 3.42Å; D726-T728 WeakPolarHBondContact OD2-CB 3.4Å; D726-T728 PolarHBondContact OD2-N 3.46Å; D726-T728 PolarHBondContact OD2-OG1 3.01Å; T728-M730 WeakPolarHBondContact OG1-CB 3.08Å; T728-M730 VanDerWaalsContact OG1-CG 3.23Å; T728-M730 WeakPolarHBondContact OG1-CG 3.42Å; T728-M730 PolarHBondContact OG1-N 3.32Å; T728-L988 HydrophobicContact CG2-CB 4.25Å; T728-L988 HydrophobicContact CG2-CD1 4.21Å; T728-L991 HydrophobicContact CG2-CD1 3.88Å; T728-N1010 PolarHBondContact O-ND2 3.01Å
729	G	88.1	Confident	83.9	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.289	C	S	.	.	S	Bend	trans	87.9	5.3	-175.1	0	0	0	0	0	114.3	D726 S783 T1007	D726-G729 PolarHBondContact O-N 3.19Å; D726-G729 WeakPolarHBondContact OD1-CA 3.3Å; D726-G729 PolarHBondContact OD1-N 3.37Å; G729-S783 WeakPolarHBondContact O-CB 3.23Å; G729-S783 PolarHBondContact O-OG 3.05Å; G729-T1007 VanDerWaalsContact CA-CG2 3.4Å
730	M	89.5	Confident	86.2	Confident	12 Å²	12	57.5 Å²	57.5	6%	0.059	29%	0.294	C	S	.	.	S	Bend	trans	-81.6	-20.4	-176.7	-60.5	-62	-85.5	0	0	113.2	D726 T728 S783 G983 T985 N1010 R1013	D726-M730 PolarHBondContact OD1-N 3.38Å; T728-M730 WeakPolarHBondContact OG1-CB 3.08Å; T728-M730 VanDerWaalsContact OG1-CG 3.23Å; T728-M730 WeakPolarHBondContact OG1-CG 3.42Å; T728-M730 PolarHBondContact OG1-N 3.32Å; M730-S783 VanDerWaalsContact C-OG 3.26Å; M730-S783 WeakPolarHBondContact CA-OG 3.31Å; M730-S783 WeakPolarHBondContact O-CB 3.5Å; M730-S783 PolarHBondContact O-N 2.91Å; M730-S783 PolarHBondContact O-OG 3.33Å; M730-S783 VanDerWaalsContact O-OG 3.07Å; M730-G983 WeakPolarHBondContact CE-O 3.45Å; M730-T985 HydrophobicContact CE-CG2 4.14Å; M730-N1010 HydrophobicContact SD-CB 3.92Å; M730-R1013 VanDerWaalsContact CE-CZ 3.41Å; M730-R1013 VanDerWaalsContact CE-NE 3.33Å; M730-R1013 PolarHBondContact O-NH2 2.76Å
731	F	93.5	Very high	88.1	Confident	1 Å²	1	57.9 Å²	57.9	0%	0.004	29%	0.292	C	S	.	.	B	Isolated β-bridge	trans	-137.6	152.1	-174	-62	-76.4	0	0	0	113.7	Y725 D726 M778 R781 A782 L988	Y725-F731 WeakPolarHBondContact CA-O 3.48Å; D726-F731 PolarHBondContact N-O 3.49Å; D726-F731 VanDerWaalsContact N-O 3.11Å; D726-F731 PolarHBondContact OD1-N 2.66Å; F731-M778 HydrophobicContact CD1-CG 3.59Å; F731-M778 WeakPolarHBondContact CD1-O 3.11Å; F731-M778 HydrophobicContact CD2-CG 4.23Å; F731-M778 HydrophobicContact CD2-SD 4.43Å; F731-M778 HydrophobicContact CE1-CG 3.4Å; F731-M778 VanDerWaalsContact CE1-CG 3.4Å; F731-M778 WeakPolarHBondContact CE1-O 3.27Å; F731-M778 HydrophobicContact CE1-SD 4.35Å; F731-M778 HydrophobicContact CE2-CG 4.05Å; F731-M778 HydrophobicContact CE2-SD 4.02Å; F731-M778 HydrophobicContact CG-CG 4.03Å; F731-M778 HydrophobicContact CZ-CG 3.65Å; F731-M778 HydrophobicContact CZ-SD 3.98Å; F731-R781 WeakPolarHBondContact CA-O 3.36Å; F731-A782 HydrophobicContact CD1-CB 4.22Å; F731-A782 HydrophobicContact CE1-CB 3.98Å; F731-L988 HydrophobicContact CD2-CD2 3.86Å; F731-L988 HydrophobicContact CE2-CD2 3.48Å; F731-L988 VanDerWaalsContact CE2-CD2 3.48Å
732	H	93.4	Very high	89.7	Confident	5 Å²	5	51.6 Å²	51.6	2%	0.023	26%	0.258	C	S	.	.	B	Isolated β-bridge	trans	-78.3	129.7	173.2	-73.7	-178.6	0	0	0	111.2	Y725 R781 F785 L790 P813	Y725-H732 AromaticContact CD1-CD2 3.63Å; Y725-H732 AromaticContact CE1-CD2 3.29Å; Y725-H732 WeakPolarHBondContact CE1-CD2 3.25Å; Y725-H732 AromaticContact CE1-NE2 3.36Å; Y725-H732 WeakPolarHBondContact CE1-NE2 3.38Å; H732-R781 PolarHBondContact N-O 2.95Å; H732-F785 PolarHBondContact CE1-O 3.21Å; H732-F785 PolarHBondContact NE2-O 2.82Å; H732-L790 HydrophobicContact CB-CD1 4.26Å; H732-L790 VanDerWaalsContact ND1-CD1 3.26Å; H732-L790 WeakPolarHBondContact ND1-CD1 3.15Å; H732-P813 HydrophobicContact CB-CG 4.01Å
733	W	94.1	Very high	90.7	Very high	42 Å²	42	49.8 Å²	49.8	16%	0.159	25%	0.246	C	C	.	.			trans	-125.8	146.7	-171.7	-176	93.3	0	0	0	111.5	K723 R724 Y725 P735 N811 L998 G1000	K723-W733 HydrophobicContact CB-CE3 3.93Å; K723-W733 HydrophobicContact CB-CZ3 3.69Å; K723-W733 HydrophobicContact CD-CZ3 4.35Å; R724-W733 CarbonylContact C-O 3.57Å; R724-W733 PolarHBondContact O-N 3.17Å; Y725-W733 VanDerWaalsContact C-CB 3.4Å; W733-P735 HydrophobicContact CH2-CB 4.39Å; W733-P735 HydrophobicContact CH2-CG 4.22Å; W733-P735 HydrophobicContact CZ3-CG 4.01Å; W733-N811 PolarHBondContact NE1-ND2 3.29Å; W733-L998 PolarHBondContact NE1-O 3.33Å; W733-G1000 VanDerWaalsContact CD2-CA 3.41Å
734	C	91.4	Very high	91.3	Very high	17 Å²	17	47.7 Å²	47.7	12%	0.115	24%	0.238	C	C	.	.			trans	-133.5	162	165.1	72.4	0	0	0	0	111.6	K737 N811 F812	C734-K737 WeakPolarHBondContact SG-CE 3.47Å; C734-K737 PolarHBondContact SG-NZ 3.05Å; C734-N811 PolarHBondContact N-O 3.41Å; C734-N811 WeakPolarHBondContact O-CA 3.15Å; C734-N811 PolarHBondContact O-ND2 3.3Å; C734-N811 VanDerWaalsContact SG-C 3.51Å; C734-N811 PolarHBondContact SG-O 2.9Å; C734-N811 VanDerWaalsContact SG-O 3.34Å; C734-F812 VanDerWaalsContact SG-C 3.6Å; C734-F812 PolarHBondContact SG-O 3.39Å
735	P	89.8	Confident	91.7	Very high	87 Å²	87	45.5 Å²	45.5	57%	0.565	24%	0.238	S	C	*	.			trans	-52.7	149.9	168	-25.1	35.2	0	0	0	111.7	W733	W733-P735 HydrophobicContact CH2-CB 4.39Å; W733-P735 HydrophobicContact CH2-CG 4.22Å; W733-P735 HydrophobicContact CZ3-CG 4.01Å
736	S	89.8	Confident	91.8	Very high	72 Å²	72	49.5 Å²	49.5	50%	0.503	25%	0.253	S	S	.	.			trans	-57.1	137.4	177.8	177.9	0	0	0	0	111.1	H810	S736-H810 PolarHBondContact OG-CD2 2.92Å; S736-H810 PolarHBondContact OG-CE1 3.44Å; S736-H810 PolarHBondContact OG-ND1 3.03Å; S736-H810 PolarHBondContact OG-NE2 3.5Å; S736-H810 VanDerWaalsContact OG-NE2 3.12Å
737	K	91.7	Very high	91.8	Very high	58 Å²	58	53.2 Å²	53.2	25%	0.252	28%	0.278	S	S	.	.			trans	-114.7	131.7	179.4	-63.6	168.1	-171.1	150.6	0	110.4	C734 V742 W806 H810 F812	C734-K737 WeakPolarHBondContact SG-CE 3.47Å; C734-K737 PolarHBondContact SG-NZ 3.05Å; K737-V742 HydrophobicContact CD-CG1 4.05Å; K737-W806 HydrophobicContact CB-CZ2 4.35Å; K737-W806 PolarHBondContact O-NE1 3.25Å; K737-H810 PolarHBondContact N-O 2.88Å; K737-F812 PolarHBondContact NZ-O 2.88Å
738	E	93	Very high	91.9	Very high	126 Å²	126	55 Å²	55	59%	0.589	28%	0.281	S	S	*	.			trans	-58.3	138.5	163.5	-63.9	153.2	161.8	0	0	109.7	E740 K741	E738-E740 PolarHBondContact O-N 2.89Å; E738-K741 HydrophobicContact CB-CD 4.41Å; E738-K741 WeakPolarHBondContact O-CB 3.43Å; E738-K741 PolarHBondContact O-N 3.33Å; E738-K741 WeakPolarHBondContact OE2-CE 3.28Å; E738-K741 IonicContact OE2-NZ 2.68Å; E738-K741 PolarHBondContact OE2-NZ 2.94Å
739	I	93.8	Very high	92	Very high	23 Å²	23	54.4 Å²	54.4	12%	0.118	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-59.8	-34.3	-172.8	-163	174.2	0	0	0	112.9	K741 V742 I743 L799 R803 W806 I817	I739-K741 PolarHBondContact O-N 2.91Å; I739-V742 HydrophobicContact CG1-CG2 4.31Å; I739-V742 WeakPolarHBondContact O-CG2 3.39Å; I739-V742 PolarHBondContact O-N 3.17Å; I739-I743 HydrophobicContact CG1-CD1 4.17Å; I739-I743 HydrophobicContact CG1-CG1 4.32Å; I739-I743 HydrophobicContact CG2-CD1 4.39Å; I739-I743 WeakPolarHBondContact O-CG1 3.26Å; I739-I743 PolarHBondContact O-N 2.89Å; I739-L799 HydrophobicContact CD1-CD1 4.16Å; I739-R803 HydrophobicContact CD1-CG 3.81Å; I739-W806 HydrophobicContact CB-CG 4.16Å; I739-W806 HydrophobicContact CD1-CB 4.06Å; I739-W806 HydrophobicContact CD1-CG 4.02Å; I739-W806 HydrophobicContact CG1-CD2 4.13Å; I739-W806 HydrophobicContact CG1-CG 3.97Å; I739-I817 HydrophobicContact CD1-CD1 4.01Å; I739-I817 HydrophobicContact CG1-CD1 3.89Å
740	E	92.8	Very high	91.9	Very high	124 Å²	124	57.3 Å²	57.3	58%	0.579	30%	0.298	S	S	*	.	G	3₁₀ helix	trans	-61.7	-13.5	177.4	-50.9	-58.3	149.1	0	0	113.6	E738	E738-E740 PolarHBondContact O-N 2.89Å
741	K	92	Very high	91.7	Very high	149 Å²	149	63.1 Å²	63.1	65%	0.648	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-90.9	-4	175.2	-68.8	170.1	172.6	160.1	0	114	E738 I739	E738-K741 HydrophobicContact CB-CD 4.41Å; E738-K741 WeakPolarHBondContact O-CB 3.43Å; E738-K741 PolarHBondContact O-N 3.33Å; E738-K741 WeakPolarHBondContact OE2-CE 3.28Å; E738-K741 IonicContact OE2-NZ 2.68Å; E738-K741 PolarHBondContact OE2-NZ 2.94Å; I739-K741 PolarHBondContact O-N 2.91Å
742	V	93.8	Very high	91.4	Very high	8 Å²	8	65.9 Å²	65.9	5%	0.048	34%	0.344	C	S	.	.	T	Hydrogen-bonded Turn	trans	-121.5	-12.9	176.6	-61.1	0	0	0	0	113.3	K737 I739 W806 V815 S816 I817	K737-V742 HydrophobicContact CD-CG1 4.05Å; I739-V742 HydrophobicContact CG1-CG2 4.31Å; I739-V742 WeakPolarHBondContact O-CG2 3.39Å; I739-V742 PolarHBondContact O-N 3.17Å; V742-W806 HydrophobicContact CB-CH2 4.15Å; V742-W806 HydrophobicContact CB-CZ2 4.34Å; V742-W806 HydrophobicContact CG1-CH2 3.85Å; V742-W806 HydrophobicContact CG1-CZ2 3.9Å; V742-W806 HydrophobicContact CG2-CH2 3.52Å; V742-W806 HydrophobicContact CG2-CZ2 3.55Å; V742-W806 HydrophobicContact CG2-CZ3 4.01Å; V742-V815 WeakPolarHBondContact CG1-O 3.06Å; V742-S816 CarbonylContact O-C 3.21Å; V742-S816 WeakPolarHBondContact O-CA 3.37Å; V742-I817 HydrophobicContact CG2-CD1 4Å; V742-I817 HydrophobicContact CG2-CG1 4.31Å; V742-I817 PolarHBondContact O-N 3.16Å
743	I	95.2	Very high	90.9	Very high	34 Å²	34	71 Å²	71	17%	0.174	38%	0.375	C	S	.	.	B	Isolated β-bridge	trans	-66.7	133.2	171.2	-69.3	167.8	0	0	0	109.4	I739 L799 I817 P819	I739-I743 HydrophobicContact CG1-CD1 4.17Å; I739-I743 HydrophobicContact CG1-CG1 4.32Å; I739-I743 HydrophobicContact CG2-CD1 4.39Å; I739-I743 WeakPolarHBondContact O-CG1 3.26Å; I739-I743 PolarHBondContact O-N 2.89Å; I743-L799 HydrophobicContact CD1-CD1 3.7Å; I743-L799 HydrophobicContact CD1-CD2 4.31Å; I743-L799 HydrophobicContact CG1-CD1 4.25Å; I743-I817 CarbonylContact C-O 2.98Å; I743-I817 WeakPolarHBondContact CA-O 3.25Å; I743-I817 HydrophobicContact CG1-CB 4.31Å; I743-I817 HydrophobicContact CG1-CG2 4.35Å; I743-P819 HydrophobicContact CG2-CG 4.16Å
744	L	93.3	Very high	90.4	Very high	31 Å²	31	69.9 Å²	69.9	16%	0.162	37%	0.372	C	S	.	.			trans	-119.5	134.4	173	-58.8	177.2	0	0	0	108.8	E748 A749 I817 L818 P819	L744-E748 HydrophobicContact CD2-CB 4.46Å; L744-A749 HydrophobicContact CB-CB 4.48Å; L744-I817 PolarHBondContact N-O 3.38Å; L744-L818 VanDerWaalsContact O-CD1 3.31Å; L744-L818 WeakPolarHBondContact O-CD1 3.39Å; L744-P819 WeakPolarHBondContact O-CD 3.46Å
745	T	93.4	Very high	90.4	Very high	71 Å²	71	72.6 Å²	72.6	44%	0.436	39%	0.392	S	S	.	.			trans	-71.2	160.4	162.7	64.1	0	0	0	0	110.5	S747 E748 A749	T745-S747 PolarHBondContact O-N 3.15Å; T745-S747 VanDerWaalsContact O-N 3.13Å; T745-E748 VanDerWaalsContact CB-OE2 3.25Å; T745-E748 WeakPolarHBondContact CB-OE2 3.16Å; T745-E748 VanDerWaalsContact CG2-OE2 3.29Å; T745-E748 WeakPolarHBondContact CG2-OE2 3.36Å; T745-E748 PolarHBondContact N-OE2 3.09Å; T745-E748 PolarHBondContact O-N 3.35Å; T745-E748 VanDerWaalsContact OG1-CD 3.28Å; T745-E748 WeakPolarHBondContact OG1-CG 3.04Å; T745-E748 PolarHBondContact OG1-N 2.98Å; T745-E748 PolarHBondContact OG1-OE2 2.57Å; T745-A749 PolarHBondContact O-N 3.46Å
746	R	92.4	Very high	90.4	Very high	118 Å²	118	69.7 Å²	69.7	45%	0.445	38%	0.377	S	S	.	.	H	α-helix	trans	-51.3	-36.8	174.5	-168.1	-176.2	-67.6	160	-1.4	112.6	S750 D827 A830	R746-S750 PolarHBondContact O-N 3.32Å; R746-S750 VanDerWaalsContact O-N 3.1Å; R746-S750 PolarHBondContact O-OG 2.97Å; R746-D827 IonicContact CZ-OD1 2.76Å; R746-D827 IonicContact CZ-OD2 3.75Å; R746-D827 IonicContact NE-OD1 2.61Å; R746-D827 PolarHBondContact NE-OD1 3.08Å; R746-D827 IonicContact NE-OD2 2.7Å; R746-D827 IonicContact NH2-OD1 2.73Å; R746-D827 PolarHBondContact NH2-OD1 2.75Å; R746-D827 IonicContact NH2-OD2 2.81Å; R746-D827 PolarHBondContact NH2-OD2 2.8Å; R746-A830 HydrophobicContact CB-CB 4.45Å; R746-A830 HydrophobicContact CG-CB 3.39Å
747	S	90.4	Very high	90.6	Very high	78 Å²	78	66.3 Å²	66.3	55%	0.545	35%	0.353	S	S	.	.	H	α-helix	trans	-66.9	-48.2	176.2	-54.9	0	0	0	0	112.1	T745 S750 M751	T745-S747 PolarHBondContact O-N 3.15Å; T745-S747 VanDerWaalsContact O-N 3.13Å; S747-S750 PolarHBondContact O-N 2.73Å; S747-S750 PolarHBondContact O-OG 2.79Å; S747-M751 WeakPolarHBondContact O-CG 3.42Å; S747-M751 PolarHBondContact O-N 3.46Å
748	E	91.1	Very high	90.9	Very high	86 Å²	86	63.5 Å²	63.5	40%	0.402	34%	0.341	S	S	.	.	H	α-helix	trans	-67.4	-36.1	179.8	-69	156.4	142	0	0	112.4	L744 T745 M751 T752	L744-E748 HydrophobicContact CD2-CB 4.46Å; T745-E748 VanDerWaalsContact CB-OE2 3.25Å; T745-E748 WeakPolarHBondContact CB-OE2 3.16Å; T745-E748 VanDerWaalsContact CG2-OE2 3.29Å; T745-E748 WeakPolarHBondContact CG2-OE2 3.36Å; T745-E748 PolarHBondContact N-OE2 3.09Å; T745-E748 PolarHBondContact O-N 3.35Å; T745-E748 VanDerWaalsContact OG1-CD 3.28Å; T745-E748 WeakPolarHBondContact OG1-CG 3.04Å; T745-E748 PolarHBondContact OG1-N 2.98Å; T745-E748 PolarHBondContact OG1-OE2 2.57Å; E748-M751 HydrophobicContact CB-CE 4.49Å; E748-M751 HydrophobicContact CG-CE 4Å; E748-M751 PolarHBondContact O-N 3.11Å; E748-T752 WeakPolarHBondContact O-CB 3.46Å; E748-T752 PolarHBondContact O-N 3.39Å; E748-T752 PolarHBondContact O-OG1 3.18Å
749	A	89.5	Confident	91.1	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-57.8	-49.8	169.2	0	0	0	0	0	110.8	L744 T745 M751 T752 A830	L744-A749 HydrophobicContact CB-CB 4.48Å; T745-A749 PolarHBondContact O-N 3.46Å; A749-M751 VanDerWaalsContact C-N 3.29Å; A749-M751 PolarHBondContact O-N 2.76Å; A749-T752 WeakPolarHBondContact O-CA 3.34Å; A749-T752 WeakPolarHBondContact O-CB 3.23Å; A749-T752 PolarHBondContact O-N 2.65Å; A749-A830 CarbonylContact C-O 3.54Å; A749-A830 HydrophobicContact CB-CB 4.38Å; A749-A830 WeakPolarHBondContact CB-O 3.42Å
750	S	86.6	Confident	91.3	Very high	60 Å²	60	56.4 Å²	56.4	42%	0.42	31%	0.308	S	S	.	.	H	α-helix	trans	-67.9	-21.7	178.6	72.5	0	0	0	0	115	R746 S747 A830	R746-S750 PolarHBondContact O-N 3.32Å; R746-S750 VanDerWaalsContact O-N 3.1Å; R746-S750 PolarHBondContact O-OG 2.97Å; S747-S750 PolarHBondContact O-N 2.73Å; S747-S750 PolarHBondContact O-OG 2.79Å; S750-A830 PolarHBondContact N-O 3.42Å
751	M	84.8	Confident	91.5	Very high	134 Å²	134	50.5 Å²	50.5	66%	0.66	28%	0.28	S	S	*	.	H	α-helix	trans	-81.7	-18.4	170.2	-69.2	-169.9	-61.1	0	0	112.8	S747 E748 A749	S747-M751 WeakPolarHBondContact O-CG 3.42Å; S747-M751 PolarHBondContact O-N 3.46Å; E748-M751 HydrophobicContact CB-CE 4.49Å; E748-M751 HydrophobicContact CG-CE 4Å; E748-M751 PolarHBondContact O-N 3.11Å; A749-M751 VanDerWaalsContact C-N 3.29Å; A749-M751 PolarHBondContact O-N 2.76Å
752	T	86.3	Confident	91.6	Very high	60 Å²	60	43.6 Å²	43.6	37%	0.368	25%	0.25	S	S	.	.	S	Bend	trans	-90.7	112.2	179	-54.1	0	0	0	0	108.7	E748 A749 L754	E748-T752 WeakPolarHBondContact O-CB 3.46Å; E748-T752 PolarHBondContact O-N 3.39Å; E748-T752 PolarHBondContact O-OG1 3.18Å; A749-T752 WeakPolarHBondContact O-CA 3.34Å; A749-T752 WeakPolarHBondContact O-CB 3.23Å; A749-T752 PolarHBondContact O-N 2.65Å; T752-L754 VanDerWaalsContact C-N 3.28Å; T752-L754 HydrophobicContact CG2-CD2 4.03Å; T752-L754 HydrophobicContact CG2-CG 3.99Å; T752-L754 PolarHBondContact O-N 3.23Å
753	V	83	Confident	91.6	Very high	113 Å²	113	43.9 Å²	43.9	69%	0.685	25%	0.251	S	S	*	.			trans	-72.2	85.2	178.7	-174.9	0	0	0	0	109.9
754	L	84.6	Confident	91.3	Very high	17 Å²	17	42.6 Å²	42.6	9%	0.089	25%	0.246	C	C	.	.			trans	-85.3	119.7	175.2	-66.5	167.7	0	0	0	110	T752 V794	T752-L754 VanDerWaalsContact C-N 3.28Å; T752-L754 HydrophobicContact CG2-CD2 4.03Å; T752-L754 HydrophobicContact CG2-CG 3.99Å; T752-L754 PolarHBondContact O-N 3.23Å; L754-V794 HydrophobicContact CD1-CG2 3.94Å; L754-V794 HydrophobicContact CD2-CG2 4.45Å
755	S	90.3	Very high	90.9	Very high	75 Å²	75	45 Å²	45	52%	0.524	26%	0.259	S	S	.	.			trans	-153.5	149.1	174.8	178.6	0	0	0	0	108	L835	S755-L835 WeakPolarHBondContact CA-O 3.39Å
756	G	89.8	Confident	90.6	Very high	26 Å²	26	46.3 Å²	46.3	27%	0.268	27%	0.266	S	S	.	.	S	Bend	trans	67.3	40.6	-174.8	0	0	0	0	0	112.7	P792 L835 D837	G756-P792 WeakPolarHBondContact O-CD 3.35Å; G756-L835 PolarHBondContact N-O 2.63Å; G756-D837 WeakPolarHBondContact CA-OD1 3.43Å
757	H	94.8	Very high	90.3	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	162.4	-165.7	79.4	-79.1	0	0	0	112.6	V759 P792 V831 L835 C836 D837	H757-V759 VanDerWaalsContact NE2-CG2 3.27Å; H757-V759 WeakPolarHBondContact NE2-CG2 3.48Å; H757-P792 HydrophobicContact CB-CB 4.07Å; H757-P792 HydrophobicContact CB-CG 4.19Å; H757-V831 PolarHBondContact CE1-O 2.9Å; H757-V831 PolarHBondContact NE2-O 2.98Å; H757-V831 VanDerWaalsContact NE2-O 3.17Å; H757-L835 PolarHBondContact ND1-O 2.71Å; H757-C836 CarbonylContact O-C 3.34Å; H757-C836 VanDerWaalsContact O-CA 3.27Å; H757-C836 WeakPolarHBondContact O-CA 3.33Å; H757-C836 VanDerWaalsContact O-CB 3.29Å; H757-C836 WeakPolarHBondContact O-CB 3.49Å; H757-D837 PolarHBondContact O-N 2.83Å
758	V	97.5	Very high	90.1	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	127.2	178.4	-177.5	0	0	0	0	109.4	C536 V760 K791 P792 I793 V794 M838 V840	C536-V758 HydrophobicContact CB-CG2 4.05Å; V758-V760 HydrophobicContact CG1-CG2 3.97Å; V758-K791 HydrophobicContact CG2-CB 4.2Å; V758-K791 HydrophobicContact CG2-CD 4.16Å; V758-P792 PolarHBondContact N-O 3Å; V758-I793 HydrophobicContact CB-CG1 4.36Å; V758-I793 WeakPolarHBondContact O-CA 3.41Å; V758-V794 PolarHBondContact O-N 3.18Å; V758-M838 WeakPolarHBondContact CA-O 3.4Å; V758-V840 HydrophobicContact CG1-CG2 4.06Å
759	V	97.4	Very high	89.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	125.5	171.8	-178.8	0	0	0	0	108	H757 V796 V831 C836 M838 C839 V840	H757-V759 VanDerWaalsContact NE2-CG2 3.27Å; H757-V759 WeakPolarHBondContact NE2-CG2 3.48Å; V759-V796 HydrophobicContact CG1-CG2 3.92Å; V759-V831 HydrophobicContact CG1-CG2 4.23Å; V759-V831 HydrophobicContact CG2-CB 4.5Å; V759-V831 HydrophobicContact CG2-CG2 3.92Å; V759-C836 HydrophobicContact CG2-CB 3.95Å; V759-M838 PolarHBondContact N-O 3.45Å; V759-C839 CarbonylContact O-C 3.41Å; V759-C839 WeakPolarHBondContact O-CA 3.34Å; V759-V840 PolarHBondContact O-N 2.99Å
760	V	97.6	Very high	89.7	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	103.6	178.8	-171.8	0	0	0	0	109	V758 I762 L776 I793 V794 F795 V796 V840 L842	V758-V760 HydrophobicContact CG1-CG2 3.97Å; V760-I762 HydrophobicContact CG1-CD1 4.13Å; V760-I762 HydrophobicContact CG1-CG1 4.03Å; V760-L776 HydrophobicContact CB-CD2 4.43Å; V760-L776 HydrophobicContact CG1-CD2 3.71Å; V760-L776 HydrophobicContact CG2-CD2 3.81Å; V760-I793 HydrophobicContact CG2-CG2 4Å; V760-V794 PolarHBondContact N-O 3.23Å; V760-F795 HydrophobicContact CB-CD1 3.65Å; V760-F795 HydrophobicContact CB-CE1 3.88Å; V760-F795 HydrophobicContact CG1-CD1 3.89Å; V760-F795 HydrophobicContact CG1-CE1 3.88Å; V760-F795 HydrophobicContact CG2-CD1 4.32Å; V760-F795 HydrophobicContact CG2-CE1 4.16Å; V760-F795 WeakPolarHBondContact O-CA 3.16Å; V760-V796 PolarHBondContact O-N 2.95Å; V760-V840 CarbonylContact C-O 3.59Å; V760-V840 WeakPolarHBondContact CA-O 3.49Å; V760-V840 HydrophobicContact CG1-CB 4.28Å; V760-V840 HydrophobicContact CG1-CG1 4.35Å; V760-V840 HydrophobicContact CG2-CB 4.33Å; V760-L842 HydrophobicContact CG1-CD1 4.09Å
761	C	97	Very high	89.7	Confident	0 Å²	0	40.2 Å²	40.2	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	120.9	177.6	-71.6	0	0	0	0	109.9	P822 V840 I841 L842	C761-P822 HydrophobicContact CB-CB 3.69Å; C761-P822 HydrophobicContact CB-CG 3.6Å; C761-V840 PolarHBondContact N-O 3.01Å; C761-I841 HydrophobicContact CB-CG1 4.22Å; C761-L842 PolarHBondContact O-N 3.02Å
762	I	95.3	Very high	89.9	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.015	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	124.4	-175	-64.5	164.6	0	0	0	110.5	V760 L773 F795 V796 Y801 L802	V760-I762 HydrophobicContact CG1-CD1 4.13Å; V760-I762 HydrophobicContact CG1-CG1 4.03Å; I762-L773 HydrophobicContact CD1-CD1 3.58Å; I762-L773 HydrophobicContact CD1-CD2 3.74Å; I762-L773 HydrophobicContact CD1-CG 4.32Å; I762-L773 HydrophobicContact CG1-CD2 4.49Å; I762-F795 HydrophobicContact CD1-CD1 3.52Å; I762-F795 HydrophobicContact CD1-CE1 4.03Å; I762-F795 HydrophobicContact CD1-CG 4.46Å; I762-V796 PolarHBondContact N-O 3.09Å; I762-Y801 HydrophobicContact CG2-CD1 3.9Å; I762-Y801 HydrophobicContact CG2-CE1 3.84Å; I762-L802 HydrophobicContact CD1-CD2 3.92Å
763	F	93	Very high	90.2	Very high	15 Å²	15	31.8 Å²	31.8	7%	0.066	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	106.1	167.1	-67.3	-78.8	0	0	0	109.5	P822 L823 I841 L842 A844 E858 A862	F763-P822 HydrophobicContact CE1-CB 4.35Å; F763-P822 HydrophobicContact CE1-CG 4.26Å; F763-P822 HydrophobicContact CE2-CB 4.05Å; F763-P822 HydrophobicContact CE2-CG 4.09Å; F763-P822 HydrophobicContact CZ-CB 3.69Å; F763-P822 HydrophobicContact CZ-CG 3.92Å; F763-L823 HydrophobicContact CE1-CD1 4.19Å; F763-L823 HydrophobicContact CE1-CD2 4.37Å; F763-L823 HydrophobicContact CE1-CG 3.91Å; F763-L823 HydrophobicContact CZ-CD2 3.98Å; F763-L823 HydrophobicContact CZ-CG 3.96Å; F763-I841 HydrophobicContact CE2-CG2 4.15Å; F763-L842 PolarHBondContact N-O 3.43Å; F763-A844 WeakPolarHBondContact O-CB 3.21Å; F763-A844 PolarHBondContact O-N 3.3Å; F763-E858 HydrophobicContact CD1-CB 3.85Å; F763-E858 WeakPolarHBondContact CD1-OE2 3.34Å; F763-E858 HydrophobicContact CD2-CB 4.08Å; F763-E858 HydrophobicContact CE1-CB 4.02Å; F763-E858 HydrophobicContact CE2-CB 4.22Å; F763-E858 WeakPolarHBondContact CE2-O 3.35Å; F763-E858 HydrophobicContact CG-CB 3.88Å; F763-E858 HydrophobicContact CZ-CB 4.19Å; F763-A862 HydrophobicContact CE2-CB 3.79Å; F763-A862 HydrophobicContact CZ-CB 3.87Å
764	G	88.9	Confident	90.7	Very high	6 Å²	6	27 Å²	27	6%	0.062	17%	0.171	C	C	.	.			trans	-165.4	136.1	-177.5	0	0	0	0	0	113.1	S798 Y801	G764-S798 VanDerWaalsContact O-CB 3.23Å; G764-S798 WeakPolarHBondContact O-CB 3.32Å; G764-Y801 WeakPolarHBondContact O-CB 3.49Å
765	D	85.4	Confident	91.2	Very high	83 Å²	83	26.8 Å²	26.8	44%	0.444	17%	0.17	S	C	.	.			trans	-109.8	171.7	-177.3	-71.6	-62.7	0	0	0	112.9	T767 S768 R804 N845	D765-T767 PolarHBondContact O-N 3.38Å; D765-T767 VanDerWaalsContact O-N 3.13Å; D765-S768 PolarHBondContact N-OG 2.93Å; D765-S768 WeakPolarHBondContact O-CB 3.36Å; D765-S768 PolarHBondContact O-N 2.94Å; D765-S768 PolarHBondContact O-OG 3.35Å; D765-R804 PolarHBondContact O-NH1 2.59Å; D765-N845 PolarHBondContact OD2-ND2 3.33Å
766	V	86.9	Confident	91.4	Very high	97 Å²	97	23.3 Å²	23.3	59%	0.588	15%	0.146	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-32.8	-178.8	-171	0	0	0	0	112.6	D800 R804	V766-D800 HydrophobicContact CG2-CB 3.88Å; V766-R804 PolarHBondContact O-NH1 3.43Å
767	T	85.7	Confident	91.7	Very high	123 Å²	123	22.1 Å²	22.1	76%	0.755	13%	0.133	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.8	-9.6	178.8	48.1	0	0	0	0	114.6	D765	D765-T767 PolarHBondContact O-N 3.38Å; D765-T767 VanDerWaalsContact O-N 3.13Å
768	S	86.2	Confident	91.6	Very high	3 Å²	3	22.6 Å²	22.6	2%	0.021	14%	0.135	C	C	.	.	S	Bend	trans	-73.6	158.7	-174.7	67.8	0	0	0	0	113	D765 Y801 R804 N845	D765-S768 PolarHBondContact N-OG 2.93Å; D765-S768 WeakPolarHBondContact O-CB 3.36Å; D765-S768 PolarHBondContact O-N 2.94Å; D765-S768 PolarHBondContact O-OG 3.35Å; S768-Y801 WeakPolarHBondContact OG-CD2 3.29Å; S768-Y801 WeakPolarHBondContact OG-CE2 3.46Å; S768-R804 VanDerWaalsContact O-CZ 3.29Å; S768-R804 PolarHBondContact O-NH1 3.41Å; S768-R804 PolarHBondContact O-NH2 3.49Å; S768-N845 VanDerWaalsContact CB-OD1 3.27Å; S768-N845 WeakPolarHBondContact CB-OD1 3.49Å
769	A	85.3	Confident	91.5	Very high	22 Å²	22	22.7 Å²	22.7	18%	0.182	14%	0.136	C	C	.	.	P	Polyproline II helix	trans	-68.3	153.5	178.6	0	0	0	0	0	111.7	P471 Y801	P471-A769 HydrophobicContact CG-CB 3.98Å; A769-Y801 VanDerWaalsContact O-CE2 3.31Å; A769-Y801 WeakPolarHBondContact O-CE2 3.47Å; A769-Y801 PolarHBondContact O-OH 3.47Å
770	L	87.9	Confident	91.4	Very high	54 Å²	54	23 Å²	23	28%	0.283	14%	0.137	S	C	.	.	P	Polyproline II helix	trans	-71.3	138.9	170.4	-62.8	-178.9	0	0	0	109.4	Q500 R804 E805	Q500-L770 PolarHBondContact NE2-O 2.85Å; L770-R804 HydrophobicContact CD2-CB 3.95Å; L770-E805 HydrophobicContact CD2-CG 4.16Å
771	V	86.1	Confident	91.3	Very high	13 Å²	13	23 Å²	23	8%	0.079	14%	0.137	C	C	.	.			trans	-92.5	-19.2	176	168.7	0	0	0	0	110.4	L773 Y801 E805 L842 A844	V771-L773 HydrophobicContact CB-CD2 4.46Å; V771-L773 HydrophobicContact CG1-CD2 4.24Å; V771-Y801 WeakPolarHBondContact CG2-OH 3.33Å; V771-Y801 PolarHBondContact N-OH 3.16Å; V771-E805 PolarHBondContact N-OE1 2.72Å; V771-L842 HydrophobicContact CG1-CD1 4.33Å; V771-A844 HydrophobicContact CG2-CB 3.75Å
772	G	89.1	Confident	91.1	Very high	15 Å²	15	23 Å²	23	16%	0.155	14%	0.138	C	C	.	.			trans	74.8	54.3	-178.3	0	0	0	0	0	110.9	R774 N775 E805	G772-R774 PolarHBondContact O-N 3.29Å; G772-N775 WeakPolarHBondContact O-CB 3.21Å; G772-N775 PolarHBondContact O-N 2.63Å; G772-E805 PolarHBondContact N-OE1 3.19Å
773	L	93.4	Very high	90.9	Very high	2 Å²	2	22.9 Å²	22.9	1%	0.01	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.4	-21	-176.5	-61.8	175.5	0	0	0	112.7	I762 V771 N775 L776 V777 F795 L802 E805 L809 L842	I762-L773 HydrophobicContact CD1-CD1 3.58Å; I762-L773 HydrophobicContact CD1-CD2 3.74Å; I762-L773 HydrophobicContact CD1-CG 4.32Å; I762-L773 HydrophobicContact CG1-CD2 4.49Å; V771-L773 HydrophobicContact CB-CD2 4.46Å; V771-L773 HydrophobicContact CG1-CD2 4.24Å; L773-N775 PolarHBondContact O-N 3.37Å; L773-L776 WeakPolarHBondContact O-CB 3.34Å; L773-L776 PolarHBondContact O-N 3.16Å; L773-V777 PolarHBondContact O-N 3.3Å; L773-F795 HydrophobicContact CB-CE1 4.47Å; L773-F795 HydrophobicContact CB-CZ 4.42Å; L773-F795 HydrophobicContact CD1-CD1 4.37Å; L773-F795 HydrophobicContact CD1-CE1 3.98Å; L773-F795 HydrophobicContact CD1-CZ 4.37Å; L773-F795 HydrophobicContact CD2-CE1 4.3Å; L773-F795 HydrophobicContact CG-CE1 4.49Å; L773-L802 HydrophobicContact CD1-CD2 3.85Å; L773-E805 WeakPolarHBondContact CB-OE2 3.26Å; L773-E805 HydrophobicContact CD1-CB 3.92Å; L773-E805 HydrophobicContact CD1-CG 3.74Å; L773-E805 HydrophobicContact CG-CB 4.49Å; L773-E805 HydrophobicContact CG-CG 4.03Å; L773-E805 PolarHBondContact N-OE2 3.45Å; L773-L809 HydrophobicContact CB-CD1 4.11Å; L773-L809 HydrophobicContact CB-CD2 4.24Å; L773-L809 HydrophobicContact CD1-CD1 4.3Å; L773-L842 HydrophobicContact CD2-CD1 4.06Å
774	R	93.3	Very high	90.7	Very high	13 Å²	13	22.6 Å²	22.6	5%	0.049	14%	0.136	C	C	.	.	H	α-helix	trans	-49.4	-37.2	168.9	-159.4	179.9	77.5	-165.3	0.4	112.4	G772 L776 V777 M778 L809 F812 N996	G772-R774 PolarHBondContact O-N 3.29Å; R774-L776 VanDerWaalsContact C-N 3.35Å; R774-V777 PolarHBondContact O-N 2.85Å; R774-M778 HydrophobicContact CG-CE 4Å; R774-M778 WeakPolarHBondContact O-CB 3.24Å; R774-M778 PolarHBondContact O-N 3.3Å; R774-L809 HydrophobicContact CB-CD2 4.46Å; R774-F812 HydrophobicContact CG-CE2 4.02Å; R774-F812 HydrophobicContact CG-CZ 4.29Å; R774-N996 PolarHBondContact NH1-O 3.4Å; R774-N996 PolarHBondContact NH1-OD1 3.43Å
775	N	93.9	Very high	90.8	Very high	12 Å²	12	23.5 Å²	23.5	6%	0.064	14%	0.138	C	C	.	.	H	α-helix	trans	-74.3	-23.6	-178.3	-58.8	-18.7	0	0	0	112.9	A525 A529 G772 L773 P779	A525-N775 PolarHBondContact O-ND2 3.45Å; A529-N775 HydrophobicContact CB-CB 3.71Å; G772-N775 WeakPolarHBondContact O-CB 3.21Å; G772-N775 PolarHBondContact O-N 2.63Å; L773-N775 PolarHBondContact O-N 3.37Å; N775-P779 WeakPolarHBondContact O-CD 3.36Å; N775-P779 WeakPolarHBondContact O-CG 3.42Å
776	L	95.8	Very high	91.1	Very high	3 Å²	3	20.6 Å²	20.6	2%	0.016	12%	0.122	C	C	.	.	H	α-helix	trans	-80.8	-40.7	172	-176.1	73.6	0	0	0	111	A529 I532 A533 V760 L773 R774 L842	A529-L776 HydrophobicContact CB-CB 4.17Å; A529-L776 WeakPolarHBondContact O-CD1 3.49Å; I532-L776 HydrophobicContact CB-CD1 4.2Å; I532-L776 HydrophobicContact CG2-CD1 3.73Å; A533-L776 HydrophobicContact CB-CD1 4.11Å; A533-L776 WeakPolarHBondContact CB-O 3.13Å; V760-L776 HydrophobicContact CB-CD2 4.43Å; V760-L776 HydrophobicContact CG1-CD2 3.71Å; V760-L776 HydrophobicContact CG2-CD2 3.81Å; L773-L776 WeakPolarHBondContact O-CB 3.34Å; L773-L776 PolarHBondContact O-N 3.16Å; R774-L776 VanDerWaalsContact C-N 3.35Å; L776-L842 HydrophobicContact CD2-CD1 4.29Å
777	V	95.9	Very high	91.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-78.3	-36.2	-175.9	179.1	0	0	0	0	112.3	L773 R774 L780 R781 I793 F795 L809 F812 V815	L773-V777 PolarHBondContact O-N 3.3Å; R774-V777 PolarHBondContact O-N 2.85Å; V777-L780 CarbonylContact O-C 3.58Å; V777-L780 PolarHBondContact O-N 3.08Å; V777-R781 HydrophobicContact CG1-CG 3.9Å; V777-R781 VanDerWaalsContact O-CG 3.27Å; V777-R781 WeakPolarHBondContact O-CG 3.42Å; V777-R781 PolarHBondContact O-N 2.83Å; V777-R781 VanDerWaalsContact O-N 3.15Å; V777-I793 HydrophobicContact CB-CD1 4.44Å; V777-I793 HydrophobicContact CG1-CD1 4.11Å; V777-I793 HydrophobicContact CG2-CD1 4.12Å; V777-F795 HydrophobicContact CG2-CE2 4.29Å; V777-F795 HydrophobicContact CG2-CZ 3.7Å; V777-L809 HydrophobicContact CB-CD2 4.22Å; V777-L809 HydrophobicContact CG2-CD2 3.91Å; V777-F812 HydrophobicContact CB-CD2 4.2Å; V777-F812 HydrophobicContact CB-CE2 4.25Å; V777-F812 HydrophobicContact CG1-CB 3.89Å; V777-F812 HydrophobicContact CG1-CD1 4.06Å; V777-F812 HydrophobicContact CG1-CD2 3.46Å; V777-F812 VanDerWaalsContact CG1-CD2 3.46Å; V777-F812 HydrophobicContact CG1-CE1 4.45Å; V777-F812 HydrophobicContact CG1-CE2 3.92Å; V777-F812 HydrophobicContact CG1-CG 3.53Å; V777-F812 HydrophobicContact CG1-CZ 4.39Å; V777-V815 HydrophobicContact CG1-CG2 4.34Å
778	M	93.1	Very high	91.4	Very high	10 Å²	10	22.2 Å²	22.2	5%	0.049	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.3	-49.1	-175.2	-175.3	-178.9	-51.6	0	0	113.1	F731 R774 L780 R781 A782 F812 L998	F731-M778 HydrophobicContact CD1-CG 3.59Å; F731-M778 WeakPolarHBondContact CD1-O 3.11Å; F731-M778 HydrophobicContact CD2-CG 4.23Å; F731-M778 HydrophobicContact CD2-SD 4.43Å; F731-M778 HydrophobicContact CE1-CG 3.4Å; F731-M778 VanDerWaalsContact CE1-CG 3.4Å; F731-M778 WeakPolarHBondContact CE1-O 3.27Å; F731-M778 HydrophobicContact CE1-SD 4.35Å; F731-M778 HydrophobicContact CE2-CG 4.05Å; F731-M778 HydrophobicContact CE2-SD 4.02Å; F731-M778 HydrophobicContact CG-CG 4.03Å; F731-M778 HydrophobicContact CZ-CG 3.65Å; F731-M778 HydrophobicContact CZ-SD 3.98Å; R774-M778 HydrophobicContact CG-CE 4Å; R774-M778 WeakPolarHBondContact O-CB 3.24Å; R774-M778 PolarHBondContact O-N 3.3Å; M778-L780 VanDerWaalsContact C-N 3.33Å; M778-L780 PolarHBondContact O-N 3.41Å; M778-R781 CarbonylContact O-C 3.5Å; M778-R781 WeakPolarHBondContact O-CA 3.44Å; M778-R781 PolarHBondContact O-N 3.06Å; M778-A782 PolarHBondContact O-N 2.92Å; M778-F812 HydrophobicContact CB-CZ 4.1Å; M778-L998 HydrophobicContact CE-CD1 4.26Å
779	P	94.6	Very high	91.6	Very high	3 Å²	3	25.1 Å²	25.1	2%	0.019	12%	0.123	C	C	.	.	G	3₁₀ helix	trans	-64.3	-38	177.6	-18	31.3	0	0	0	112.3	A533 N775 R781 A782	A533-P779 HydrophobicContact CB-CB 3.96Å; A533-P779 HydrophobicContact CB-CG 3.93Å; N775-P779 WeakPolarHBondContact O-CD 3.36Å; N775-P779 WeakPolarHBondContact O-CG 3.42Å; P779-R781 PolarHBondContact O-N 2.91Å; P779-R781 VanDerWaalsContact O-N 3.08Å; P779-A782 WeakPolarHBondContact O-CB 3.4Å; P779-A782 PolarHBondContact O-N 2.87Å
780	L	94.9	Very high	92	Very high	5 Å²	5	24.2 Å²	24.2	3%	0.026	12%	0.115	C	C	.	.	G	3₁₀ helix	trans	-67.7	-1.9	173.2	-67.7	177.9	0	0	0	113.8	A533 C536 L537 V777 M778 I793	A533-L780 HydrophobicContact CB-CG 4.16Å; A533-L780 WeakPolarHBondContact O-CD2 3.4Å; C536-L780 HydrophobicContact CB-CD1 4.45Å; C536-L780 HydrophobicContact CB-CD2 4.1Å; L537-L780 HydrophobicContact CD1-CD2 4.29Å; L537-L780 HydrophobicContact CD2-CD2 3.75Å; L537-L780 HydrophobicContact CG-CD2 3.8Å; V777-L780 CarbonylContact O-C 3.58Å; V777-L780 PolarHBondContact O-N 3.08Å; M778-L780 VanDerWaalsContact C-N 3.33Å; M778-L780 PolarHBondContact O-N 3.41Å; L780-I793 HydrophobicContact CB-CD1 4.04Å; L780-I793 HydrophobicContact CD1-CD1 3.77Å; L780-I793 HydrophobicContact CD1-CG1 4.31Å
781	R	94.9	Very high	92.3	Very high	1 Å²	1	23.6 Å²	23.6	0%	0.004	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-126.4	17.3	177.1	-62.1	-65.1	176.8	-99.1	5	112.4	F731 H732 V777 M778 P779 K791 F812 P813 K814	F731-R781 WeakPolarHBondContact CA-O 3.36Å; H732-R781 PolarHBondContact N-O 2.95Å; V777-R781 HydrophobicContact CG1-CG 3.9Å; V777-R781 VanDerWaalsContact O-CG 3.27Å; V777-R781 WeakPolarHBondContact O-CG 3.42Å; V777-R781 PolarHBondContact O-N 2.83Å; V777-R781 VanDerWaalsContact O-N 3.15Å; M778-R781 CarbonylContact O-C 3.5Å; M778-R781 WeakPolarHBondContact O-CA 3.44Å; M778-R781 PolarHBondContact O-N 3.06Å; P779-R781 PolarHBondContact O-N 2.91Å; P779-R781 VanDerWaalsContact O-N 3.08Å; R781-K791 VanDerWaalsContact CZ-O 3.29Å; R781-K791 PolarHBondContact NH1-O 2.83Å; R781-K791 PolarHBondContact NH2-O 2.71Å; R781-F812 HydrophobicContact CB-CD1 3.83Å; R781-F812 HydrophobicContact CB-CE1 4.11Å; R781-F812 HydrophobicContact CG-CB 4.41Å; R781-F812 HydrophobicContact CG-CD1 3.79Å; R781-F812 HydrophobicContact CG-CE1 4.43Å; R781-F812 HydrophobicContact CG-CG 4.33Å; R781-P813 PolarHBondContact NE-O 2.8Å; R781-P813 PolarHBondContact NH2-O 3.23Å; R781-K814 PolarHBondContact NH2-O 2.75Å
782	A	93	Very high	92.8	Very high	1 Å²	1	24.7 Å²	24.7	1%	0.008	12%	0.117	C	C	.	.	B	Isolated β-bridge	trans	-60.2	146.6	173.6	0	0	0	0	0	112.4	F731 M778 P779 N784 F785	F731-A782 HydrophobicContact CD1-CB 4.22Å; F731-A782 HydrophobicContact CE1-CB 3.98Å; M778-A782 PolarHBondContact O-N 2.92Å; P779-A782 WeakPolarHBondContact O-CB 3.4Å; P779-A782 PolarHBondContact O-N 2.87Å; A782-N784 VanDerWaalsContact C-N 3.27Å; A782-N784 WeakPolarHBondContact CB-OD1 3.35Å; A782-N784 PolarHBondContact O-N 3.02Å; A782-F785 PolarHBondContact O-N 2.81Å
783	S	91.4	Very high	93.2	Very high	0 Å²	0	24.1 Å²	24.1	0%	0	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-4	-170.3	63.2	0	0	0	0	115.4	G729 M730 F785 R1011 R1013	G729-S783 WeakPolarHBondContact O-CB 3.23Å; G729-S783 PolarHBondContact O-OG 3.05Å; M730-S783 VanDerWaalsContact C-OG 3.26Å; M730-S783 WeakPolarHBondContact CA-OG 3.31Å; M730-S783 WeakPolarHBondContact O-CB 3.5Å; M730-S783 PolarHBondContact O-N 2.91Å; M730-S783 PolarHBondContact O-OG 3.33Å; M730-S783 VanDerWaalsContact O-OG 3.07Å; S783-F785 PolarHBondContact O-N 3.06Å; S783-R1011 VanDerWaalsContact O-CZ 3.24Å; S783-R1011 PolarHBondContact O-NE 2.81Å; S783-R1011 PolarHBondContact O-NH2 3.33Å; S783-R1013 PolarHBondContact OG-NH2 2.81Å
784	N	89.6	Confident	93.4	Very high	8 Å²	8	24.1 Å²	24.1	4%	0.043	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	1.4	169.7	60.5	-12.3	0	0	0	113.4	A782 R1013 C1014 R1015 F1094	A782-N784 VanDerWaalsContact C-N 3.27Å; A782-N784 WeakPolarHBondContact CB-OD1 3.35Å; A782-N784 PolarHBondContact O-N 3.02Å; N784-R1013 WeakPolarHBondContact CB-O 3.46Å; N784-C1014 PolarHBondContact ND2-O 2.95Å; N784-R1015 PolarHBondContact O-NH1 3Å; N784-F1094 WeakPolarHBondContact O-CD2 3.29Å
785	F	90.8	Very high	93.6	Very high	25 Å²	25	23.5 Å²	23.5	11%	0.11	11%	0.108	C	C	.	.	S	Bend	trans	-104.7	147.9	164.8	-66.7	-79.4	0	0	0	110.8	L537 H732 A782 S783 E789 L790 R1015	L537-F785 HydrophobicContact CD1-CE2 3.97Å; L537-F785 HydrophobicContact CD1-CZ 3.79Å; L537-F785 HydrophobicContact CD2-CE1 4.35Å; L537-F785 HydrophobicContact CD2-CE2 4.36Å; L537-F785 HydrophobicContact CD2-CZ 3.86Å; L537-F785 HydrophobicContact CG-CZ 4.4Å; H732-F785 PolarHBondContact CE1-O 3.21Å; H732-F785 PolarHBondContact NE2-O 2.82Å; A782-F785 PolarHBondContact O-N 2.81Å; S783-F785 PolarHBondContact O-N 3.06Å; F785-E789 HydrophobicContact CD1-CB 4.45Å; F785-L790 HydrophobicContact CB-CD2 3.9Å; F785-R1015 HydrophobicContact CE1-CB 4.42Å; F785-R1015 HydrophobicContact CZ-CB 4.04Å
786	H	90.8	Very high	93.7	Very high	23 Å²	23	22.9 Å²	22.9	11%	0.106	11%	0.105	C	C	.	.			trans	-74.2	152.9	167	-65.6	86.8	0	0	0	110.6	H788 E789 L790 F1094 D1095	H786-H788 AromaticContact CG-CE1 3.98Å; H786-H788 PolarHBondContact O-N 3.3Å; H786-H788 VanDerWaalsContact O-N 3.1Å; H786-E789 HydrophobicContact CB-CB 4.45Å; H786-E789 HydrophobicContact CB-CG 4.04Å; H786-E789 WeakPolarHBondContact CB-OE2 3.21Å; H786-E789 IonicContact CG-OE2 2.85Å; H786-E789 PolarHBondContact N-OE2 3.38Å; H786-E789 IonicContact ND1-OE2 2.66Å; H786-E789 PolarHBondContact ND1-OE2 3.32Å; H786-E789 PolarHBondContact O-N 2.68Å; H786-L790 PolarHBondContact O-N 2.68Å; H786-F1094 AromaticContact CE1-CE2 3.33Å; H786-F1094 WeakPolarHBondContact CE1-CE2 3.25Å; H786-F1094 AromaticContact CE1-CZ 3.54Å; H786-F1094 AromaticContact ND1-CE2 3.81Å; H786-F1094 AromaticContact NE2-CE2 3.68Å; H786-F1094 AromaticContact NE2-CZ 3.42Å; H786-F1094 WeakPolarHBondContact NE2-CZ 3.46Å; H786-D1095 PolarHBondContact CE1-O 2.74Å; H786-D1095 VanDerWaalsContact CE1-O 3.3Å; H786-D1095 PolarHBondContact NE2-O 3.06Å
787	Y	90.4	Very high	93.7	Very high	139 Å²	139	22.8 Å²	22.8	55%	0.545	11%	0.105	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-30.2	-179.6	-169.8	-92.1	0	0	0	113.3	L790 P813 K814	Y787-L790 HydrophobicContact CD2-CD1 4.36Å; Y787-P813 HydrophobicContact CE2-CB 3.61Å; Y787-P813 HydrophobicContact CE2-CG 4.01Å; Y787-K814 WeakPolarHBondContact O-CE 3.41Å; Y787-K814 PolarHBondContact O-NZ 3.04Å
788	H	89.3	Confident	93.6	Very high	115 Å²	115	24.6 Å²	24.6	53%	0.532	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-73.8	-40.2	174.7	65.1	-100.4	0	0	0	112.4	H786 L790 K814	H786-H788 AromaticContact CG-CE1 3.98Å; H786-H788 PolarHBondContact O-N 3.3Å; H786-H788 VanDerWaalsContact O-N 3.1Å; H788-L790 VanDerWaalsContact C-N 3.26Å; H788-L790 PolarHBondContact O-N 3.13Å; H788-K814 PolarHBondContact O-NZ 3.4Å
789	E	90.6	Very high	93.7	Very high	63 Å²	63	25.9 Å²	25.9	29%	0.294	12%	0.124	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-21.7	177.2	-62.9	176	121.4	0	0	113.8	F785 H786 K791 R1015	F785-E789 HydrophobicContact CD1-CB 4.45Å; H786-E789 HydrophobicContact CB-CB 4.45Å; H786-E789 HydrophobicContact CB-CG 4.04Å; H786-E789 WeakPolarHBondContact CB-OE2 3.21Å; H786-E789 IonicContact CG-OE2 2.85Å; H786-E789 PolarHBondContact N-OE2 3.38Å; H786-E789 IonicContact ND1-OE2 2.66Å; H786-E789 PolarHBondContact ND1-OE2 3.32Å; H786-E789 PolarHBondContact O-N 2.68Å; E789-K791 PolarHBondContact O-N 2.92Å; E789-R1015 IonicContact OE1-CZ 3.78Å; E789-R1015 VanDerWaalsContact OE1-CZ 3.29Å; E789-R1015 IonicContact OE1-NH1 3.97Å; E789-R1015 PolarHBondContact OE1-NH1 3.39Å; E789-R1015 IonicContact OE1-NH2 3.41Å; E789-R1015 PolarHBondContact OE1-NH2 3.42Å; E789-R1015 IonicContact OE2-CZ 2.78Å; E789-R1015 IonicContact OE2-NH1 2.7Å; E789-R1015 PolarHBondContact OE2-NH1 3Å; E789-R1015 IonicContact OE2-NH2 3.98Å
790	L	93.5	Very high	93.6	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	14%	0.142	C	C	.	.			trans	-56.7	111.5	177.3	-72.5	-170	0	0	0	112.3	H732 F785 H786 Y787 H788 P813 K814	H732-L790 HydrophobicContact CB-CD1 4.26Å; H732-L790 VanDerWaalsContact ND1-CD1 3.26Å; H732-L790 WeakPolarHBondContact ND1-CD1 3.15Å; F785-L790 HydrophobicContact CB-CD2 3.9Å; H786-L790 PolarHBondContact O-N 2.68Å; Y787-L790 HydrophobicContact CD2-CD1 4.36Å; H788-L790 VanDerWaalsContact C-N 3.26Å; H788-L790 PolarHBondContact O-N 3.13Å; L790-P813 HydrophobicContact CD1-CG 3.9Å; L790-K814 HydrophobicContact CB-CD 3.92Å; L790-K814 WeakPolarHBondContact O-CD 3.17Å; L790-K814 PolarHBondContact O-NZ 2.82Å
791	K	94.1	Very high	93.6	Very high	41 Å²	41	29 Å²	29	18%	0.178	14%	0.141	C	C	.	.			trans	-58.1	124.7	172.3	-54.4	-170.9	-177.6	-159.2	0	110.5	C536 V758 R781 E789 D837	C536-K791 WeakPolarHBondContact O-CE 3.34Å; C536-K791 PolarHBondContact O-NZ 2.98Å; V758-K791 HydrophobicContact CG2-CB 4.2Å; V758-K791 HydrophobicContact CG2-CD 4.16Å; R781-K791 VanDerWaalsContact CZ-O 3.29Å; R781-K791 PolarHBondContact NH1-O 2.83Å; R781-K791 PolarHBondContact NH2-O 2.71Å; E789-K791 PolarHBondContact O-N 2.92Å; K791-D837 HydrophobicContact CD-CB 4.2Å; K791-D837 VanDerWaalsContact CD-OD2 3.25Å; K791-D837 WeakPolarHBondContact CD-OD2 3.46Å; K791-D837 WeakPolarHBondContact CE-OD2 3.33Å; K791-D837 IonicContact NZ-OD2 3.08Å; K791-D837 PolarHBondContact NZ-OD2 2.91Å
792	P	96.4	Very high	93.5	Very high	36 Å²	36	29.1 Å²	29.1	23%	0.234	14%	0.141	C	C	.	.			trans	-58.8	146.3	171.6	-20.3	31.9	0	0	0	111.1	G756 H757 V758	G756-P792 WeakPolarHBondContact O-CD 3.35Å; H757-P792 HydrophobicContact CB-CB 4.07Å; H757-P792 HydrophobicContact CB-CG 4.19Å; V758-P792 PolarHBondContact N-O 3Å
793	I	97.7	Very high	93.6	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	126.3	177	-64.4	167.5	0	0	0	108.5	V758 V760 V777 L780 F795 K814 V815 S816	V758-I793 HydrophobicContact CB-CG1 4.36Å; V758-I793 WeakPolarHBondContact O-CA 3.41Å; V760-I793 HydrophobicContact CG2-CG2 4Å; V777-I793 HydrophobicContact CB-CD1 4.44Å; V777-I793 HydrophobicContact CG1-CD1 4.11Å; V777-I793 HydrophobicContact CG2-CD1 4.12Å; L780-I793 HydrophobicContact CB-CD1 4.04Å; L780-I793 HydrophobicContact CD1-CD1 3.77Å; L780-I793 HydrophobicContact CD1-CG1 4.31Å; I793-F795 HydrophobicContact CG2-CD2 4.37Å; I793-F795 HydrophobicContact CG2-CE1 4.4Å; I793-F795 HydrophobicContact CG2-CE2 3.99Å; I793-F795 HydrophobicContact CG2-CZ 4.01Å; I793-K814 PolarHBondContact N-O 3.19Å; I793-V815 WeakPolarHBondContact O-CA 3.06Å; I793-S816 PolarHBondContact O-N 2.84Å
794	V	97	Very high	93.6	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.012	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	114.7	175.7	-172.7	0	0	0	0	109.4	L754 V758 V760 V796 S816 L818 V831	L754-V794 HydrophobicContact CD1-CG2 3.94Å; L754-V794 HydrophobicContact CD2-CG2 4.45Å; V758-V794 PolarHBondContact O-N 3.18Å; V760-V794 PolarHBondContact N-O 3.23Å; V794-V796 HydrophobicContact CG1-CG2 4.49Å; V794-S816 WeakPolarHBondContact CA-O 3.27Å; V794-L818 HydrophobicContact CG1-CB 4.43Å; V794-V831 HydrophobicContact CG1-CG1 3.89Å
795	F	97.4	Very high	93.8	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	131.1	172.9	-67.3	-72.2	0	0	0	110.5	V760 I762 L773 V777 I793 L802 L809 V815 S816 I817 L818	V760-F795 HydrophobicContact CB-CD1 3.65Å; V760-F795 HydrophobicContact CB-CE1 3.88Å; V760-F795 HydrophobicContact CG1-CD1 3.89Å; V760-F795 HydrophobicContact CG1-CE1 3.88Å; V760-F795 HydrophobicContact CG2-CD1 4.32Å; V760-F795 HydrophobicContact CG2-CE1 4.16Å; V760-F795 WeakPolarHBondContact O-CA 3.16Å; I762-F795 HydrophobicContact CD1-CD1 3.52Å; I762-F795 HydrophobicContact CD1-CE1 4.03Å; I762-F795 HydrophobicContact CD1-CG 4.46Å; L773-F795 HydrophobicContact CB-CE1 4.47Å; L773-F795 HydrophobicContact CB-CZ 4.42Å; L773-F795 HydrophobicContact CD1-CD1 4.37Å; L773-F795 HydrophobicContact CD1-CE1 3.98Å; L773-F795 HydrophobicContact CD1-CZ 4.37Å; L773-F795 HydrophobicContact CD2-CE1 4.3Å; L773-F795 HydrophobicContact CG-CE1 4.49Å; V777-F795 HydrophobicContact CG2-CE2 4.29Å; V777-F795 HydrophobicContact CG2-CZ 3.7Å; I793-F795 HydrophobicContact CG2-CD2 4.37Å; I793-F795 HydrophobicContact CG2-CE1 4.4Å; I793-F795 HydrophobicContact CG2-CE2 3.99Å; I793-F795 HydrophobicContact CG2-CZ 4.01Å; F795-L802 HydrophobicContact CB-CD1 3.97Å; F795-L802 HydrophobicContact CB-CD2 4.15Å; F795-L802 HydrophobicContact CD1-CD2 4.47Å; F795-L802 HydrophobicContact CG-CD2 4.27Å; F795-L809 HydrophobicContact CE2-CD1 3.94Å; F795-L809 HydrophobicContact CZ-CD1 4.11Å; F795-V815 HydrophobicContact CD2-CG1 3.92Å; F795-V815 HydrophobicContact CE2-CG1 3.64Å; F795-S816 PolarHBondContact N-O 3.49Å; F795-I817 HydrophobicContact CB-CG1 4.35Å; F795-I817 HydrophobicContact CD2-CG1 4.44Å; F795-L818 PolarHBondContact O-N 3.11Å
796	V	96.8	Very high	93.9	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	112.5	176.5	-176.5	0	0	0	0	108.5	V759 V760 I762 V794 L818 V831	V759-V796 HydrophobicContact CG1-CG2 3.92Å; V760-V796 PolarHBondContact O-N 2.95Å; I762-V796 PolarHBondContact N-O 3.09Å; V794-V796 HydrophobicContact CG1-CG2 4.49Å; V796-L818 HydrophobicContact CG2-CB 4.4Å; V796-V831 HydrophobicContact CG2-CG1 4.27Å
797	G	94.9	Very high	93.9	Very high	1 Å²	1	44 Å²	44	1%	0.01	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-166.5	-176.5	0	0	0	0	0	113.8	L799 G820	G797-L799 PolarHBondContact O-N 3.25Å; G797-G820 CarbonylContact C-O 3.49Å; G797-G820 WeakPolarHBondContact CA-O 3.3Å; G797-G820 PolarHBondContact O-N 3.19Å; G797-G820 VanDerWaalsContact O-O 3.12Å
798	S	94.8	Very high	93.9	Very high	38 Å²	38	39.5 Å²	39.5	27%	0.266	19%	0.189	S	C	.	.			trans	-65.9	128.9	-178.6	-176.1	0	0	0	0	112.2	G764 D800 Y801 L802	G764-S798 VanDerWaalsContact O-CB 3.23Å; G764-S798 WeakPolarHBondContact O-CB 3.32Å; S798-D800 VanDerWaalsContact C-N 3.32Å; S798-D800 PolarHBondContact O-N 2.89Å; S798-Y801 PolarHBondContact O-N 2.95Å; S798-L802 WeakPolarHBondContact O-CG 3.48Å; S798-L802 PolarHBondContact O-N 2.82Å; S798-L802 VanDerWaalsContact O-N 3.11Å
799	L	94.1	Very high	94.2	Very high	36 Å²	36	34 Å²	34	19%	0.188	16%	0.164	C	C	.	.	H	α-helix	trans	-65.2	-35.8	178.8	-176.9	56.5	0	0	0	112.1	I739 I743 G797 Y801 L802 R803 P819	I739-L799 HydrophobicContact CD1-CD1 4.16Å; I743-L799 HydrophobicContact CD1-CD1 3.7Å; I743-L799 HydrophobicContact CD1-CD2 4.31Å; I743-L799 HydrophobicContact CG1-CD1 4.25Å; G797-L799 PolarHBondContact O-N 3.25Å; L799-Y801 VanDerWaalsContact C-N 3.33Å; L799-L802 PolarHBondContact O-N 3.48Å; L799-R803 HydrophobicContact CD1-CG 4.4Å; L799-R803 HydrophobicContact CG-CG 4.43Å; L799-R803 WeakPolarHBondContact O-CB 3.2Å; L799-R803 VanDerWaalsContact O-CG 3.23Å; L799-R803 WeakPolarHBondContact O-CG 3.34Å; L799-R803 PolarHBondContact O-N 2.93Å; L799-P819 HydrophobicContact CB-CB 4.03Å
800	D	93.2	Very high	94.3	Very high	75 Å²	75	33.1 Å²	33.1	40%	0.401	16%	0.159	S	C	.	.	H	α-helix	trans	-76.7	-22.6	-176.6	-62.6	-45.2	0	0	0	112.8	V766 S798 R803	V766-D800 HydrophobicContact CG2-CB 3.88Å; S798-D800 VanDerWaalsContact C-N 3.32Å; S798-D800 PolarHBondContact O-N 2.89Å; D800-R803 IonicContact OD1-CZ 3.32Å; D800-R803 IonicContact OD1-NH1 2.73Å; D800-R803 PolarHBondContact OD1-NH1 3.38Å
801	Y	94.1	Very high	94.3	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-71	-54.1	164.1	-175.2	-97.7	0	0	0	111.1	I762 G764 S768 A769 V771 S798 L799 R803 R804 E805 A844	I762-Y801 HydrophobicContact CG2-CD1 3.9Å; I762-Y801 HydrophobicContact CG2-CE1 3.84Å; G764-Y801 WeakPolarHBondContact O-CB 3.49Å; S768-Y801 WeakPolarHBondContact OG-CD2 3.29Å; S768-Y801 WeakPolarHBondContact OG-CE2 3.46Å; A769-Y801 VanDerWaalsContact O-CE2 3.31Å; A769-Y801 WeakPolarHBondContact O-CE2 3.47Å; A769-Y801 PolarHBondContact O-OH 3.47Å; V771-Y801 WeakPolarHBondContact CG2-OH 3.33Å; V771-Y801 PolarHBondContact N-OH 3.16Å; S798-Y801 PolarHBondContact O-N 2.95Å; L799-Y801 VanDerWaalsContact C-N 3.33Å; Y801-R803 PolarHBondContact O-N 2.99Å; Y801-R804 WeakPolarHBondContact O-CB 3.39Å; Y801-R804 PolarHBondContact O-N 3.14Å; Y801-E805 HydrophobicContact CE1-CG 3.94Å; Y801-E805 PolarHBondContact O-N 2.76Å; Y801-A844 HydrophobicContact CE2-CB 3.75Å; Y801-A844 WeakPolarHBondContact OH-CB 3.42Å
802	L	94.4	Very high	94.4	Very high	2 Å²	2	31.8 Å²	31.8	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-62.3	-28.5	-176.6	-70.4	171.6	0	0	0	113.1	I762 L773 F795 S798 L799 R804 E805 W806 I817	I762-L802 HydrophobicContact CD1-CD2 3.92Å; L773-L802 HydrophobicContact CD1-CD2 3.85Å; F795-L802 HydrophobicContact CB-CD1 3.97Å; F795-L802 HydrophobicContact CB-CD2 4.15Å; F795-L802 HydrophobicContact CD1-CD2 4.47Å; F795-L802 HydrophobicContact CG-CD2 4.27Å; S798-L802 WeakPolarHBondContact O-CG 3.48Å; S798-L802 PolarHBondContact O-N 2.82Å; S798-L802 VanDerWaalsContact O-N 3.11Å; L799-L802 PolarHBondContact O-N 3.48Å; L802-R804 VanDerWaalsContact C-N 3.26Å; L802-R804 PolarHBondContact O-N 3.28Å; L802-E805 PolarHBondContact O-N 3.46Å; L802-W806 WeakPolarHBondContact O-CB 3.37Å; L802-W806 PolarHBondContact O-N 3.2Å; L802-I817 HydrophobicContact CB-CD1 4.36Å; L802-I817 HydrophobicContact CD1-CG1 4.38Å; L802-I817 HydrophobicContact CD1-CG2 3.66Å
803	R	94.4	Very high	94.3	Very high	112 Å²	112	30.2 Å²	30.2	42%	0.423	14%	0.144	S	C	.	.	H	α-helix	trans	-57.3	-34.6	170.7	-83.7	167.7	170	157.5	-1.5	113.4	I739 L799 D800 Y801	I739-R803 HydrophobicContact CD1-CG 3.81Å; L799-R803 HydrophobicContact CD1-CG 4.4Å; L799-R803 HydrophobicContact CG-CG 4.43Å; L799-R803 WeakPolarHBondContact O-CB 3.2Å; L799-R803 VanDerWaalsContact O-CG 3.23Å; L799-R803 WeakPolarHBondContact O-CG 3.34Å; L799-R803 PolarHBondContact O-N 2.93Å; D800-R803 IonicContact OD1-CZ 3.32Å; D800-R803 IonicContact OD1-NH1 2.73Å; D800-R803 PolarHBondContact OD1-NH1 3.38Å; Y801-R803 PolarHBondContact O-N 2.99Å
804	R	91.9	Very high	94.1	Very high	88 Å²	88	33 Å²	33	33%	0.332	16%	0.155	S	C	.	.	H	α-helix	trans	-75.3	-44.1	177.9	-63.6	162.6	56.8	-154.7	-5.5	111.6	D765 V766 S768 L770 Y801 L802 W806	D765-R804 PolarHBondContact O-NH1 2.59Å; V766-R804 PolarHBondContact O-NH1 3.43Å; S768-R804 VanDerWaalsContact O-CZ 3.29Å; S768-R804 PolarHBondContact O-NH1 3.41Å; S768-R804 PolarHBondContact O-NH2 3.49Å; L770-R804 HydrophobicContact CD2-CB 3.95Å; Y801-R804 WeakPolarHBondContact O-CB 3.39Å; Y801-R804 PolarHBondContact O-N 3.14Å; L802-R804 VanDerWaalsContact C-N 3.26Å; L802-R804 PolarHBondContact O-N 3.28Å; R804-W806 VanDerWaalsContact C-N 3.32Å; R804-W806 PolarHBondContact O-N 2.93Å
805	E	92.3	Very high	94.1	Very high	4 Å²	4	33.1 Å²	33.1	2%	0.019	16%	0.156	C	C	.	.	H	α-helix	trans	-68.9	-27.6	177.1	-74	-83.5	168.7	0	0	112.8	L770 V771 G772 L773 Y801 L802 E807 T808 L809	L770-E805 HydrophobicContact CD2-CG 4.16Å; V771-E805 PolarHBondContact N-OE1 2.72Å; G772-E805 PolarHBondContact N-OE1 3.19Å; L773-E805 WeakPolarHBondContact CB-OE2 3.26Å; L773-E805 HydrophobicContact CD1-CB 3.92Å; L773-E805 HydrophobicContact CD1-CG 3.74Å; L773-E805 HydrophobicContact CG-CB 4.49Å; L773-E805 HydrophobicContact CG-CG 4.03Å; L773-E805 PolarHBondContact N-OE2 3.45Å; Y801-E805 HydrophobicContact CE1-CG 3.94Å; Y801-E805 PolarHBondContact O-N 2.76Å; L802-E805 PolarHBondContact O-N 3.46Å; E805-E807 VanDerWaalsContact C-N 3.28Å; E805-E807 PolarHBondContact O-N 2.75Å; E805-E807 VanDerWaalsContact O-N 3.16Å; E805-T808 PolarHBondContact O-N 2.75Å; E805-T808 PolarHBondContact O-OG1 2.97Å; E805-L809 HydrophobicContact CB-CD1 4.39Å
806	W	94.5	Very high	94	Very high	15 Å²	15	34.6 Å²	34.6	6%	0.057	17%	0.167	C	C	.	.	H	α-helix	trans	-59.8	-30.4	-170.3	-169.4	-110.4	0	0	0	114.9	K737 I739 V742 L802 R804 T808 L809 H810 V815 I817	K737-W806 HydrophobicContact CB-CZ2 4.35Å; K737-W806 PolarHBondContact O-NE1 3.25Å; I739-W806 HydrophobicContact CB-CG 4.16Å; I739-W806 HydrophobicContact CD1-CB 4.06Å; I739-W806 HydrophobicContact CD1-CG 4.02Å; I739-W806 HydrophobicContact CG1-CD2 4.13Å; I739-W806 HydrophobicContact CG1-CG 3.97Å; V742-W806 HydrophobicContact CB-CH2 4.15Å; V742-W806 HydrophobicContact CB-CZ2 4.34Å; V742-W806 HydrophobicContact CG1-CH2 3.85Å; V742-W806 HydrophobicContact CG1-CZ2 3.9Å; V742-W806 HydrophobicContact CG2-CH2 3.52Å; V742-W806 HydrophobicContact CG2-CZ2 3.55Å; V742-W806 HydrophobicContact CG2-CZ3 4.01Å; L802-W806 WeakPolarHBondContact O-CB 3.37Å; L802-W806 PolarHBondContact O-N 3.2Å; R804-W806 VanDerWaalsContact C-N 3.32Å; R804-W806 PolarHBondContact O-N 2.93Å; W806-T808 PolarHBondContact O-N 2.81Å; W806-T808 VanDerWaalsContact O-N 3.14Å; W806-L809 HydrophobicContact CD2-CB 4.45Å; W806-L809 HydrophobicContact CE3-CB 3.74Å; W806-L809 HydrophobicContact CE3-CD1 4.21Å; W806-L809 HydrophobicContact CZ3-CB 3.84Å; W806-L809 HydrophobicContact CZ3-CD1 4.49Å; W806-L809 PolarHBondContact O-N 3.24Å; W806-H810 HydrophobicContact CD2-CB 4.47Å; W806-H810 HydrophobicContact CZ2-CB 4.05Å; W806-H810 PolarHBondContact O-N 3.49Å; W806-V815 HydrophobicContact CH2-CB 4.49Å; W806-V815 HydrophobicContact CH2-CG1 4.17Å; W806-V815 HydrophobicContact CZ3-CG1 3.85Å; W806-I817 HydrophobicContact CE3-CD1 3.89Å; W806-I817 HydrophobicContact CZ3-CD1 4.16Å
807	E	90.2	Very high	94	Very high	152 Å²	152	34.6 Å²	34.6	71%	0.71	17%	0.167	S	C	*	.	H	α-helix	trans	-56.8	-28.9	175.2	-60.1	-167.2	161.9	0	0	112.2	E805	E805-E807 VanDerWaalsContact C-N 3.28Å; E805-E807 PolarHBondContact O-N 2.75Å; E805-E807 VanDerWaalsContact O-N 3.16Å
808	T	91.1	Very high	94.1	Very high	43 Å²	43	34.7 Å²	34.7	26%	0.264	17%	0.167	S	C	.	.	H	α-helix	trans	-89.4	-16.2	177.6	76.5	0	0	0	0	114	E805 W806	E805-T808 PolarHBondContact O-N 2.75Å; E805-T808 PolarHBondContact O-OG1 2.97Å; W806-T808 PolarHBondContact O-N 2.81Å; W806-T808 VanDerWaalsContact O-N 3.14Å
809	L	94.1	Very high	94.1	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	17%	0.169	C	C	.	.	H	α-helix	trans	-105.9	-20.5	-170.4	-64.2	179.6	0	0	0	114.1	L773 R774 V777 F795 E805 W806 N811 F812	L773-L809 HydrophobicContact CB-CD1 4.11Å; L773-L809 HydrophobicContact CB-CD2 4.24Å; L773-L809 HydrophobicContact CD1-CD1 4.3Å; R774-L809 HydrophobicContact CB-CD2 4.46Å; V777-L809 HydrophobicContact CB-CD2 4.22Å; V777-L809 HydrophobicContact CG2-CD2 3.91Å; F795-L809 HydrophobicContact CE2-CD1 3.94Å; F795-L809 HydrophobicContact CZ-CD1 4.11Å; E805-L809 HydrophobicContact CB-CD1 4.39Å; W806-L809 HydrophobicContact CD2-CB 4.45Å; W806-L809 HydrophobicContact CE3-CB 3.74Å; W806-L809 HydrophobicContact CE3-CD1 4.21Å; W806-L809 HydrophobicContact CZ3-CB 3.84Å; W806-L809 HydrophobicContact CZ3-CD1 4.49Å; W806-L809 PolarHBondContact O-N 3.24Å; L809-N811 PolarHBondContact O-N 2.86Å; L809-F812 HydrophobicContact CD2-CD2 4.37Å; L809-F812 HydrophobicContact CD2-CE2 4.4Å; L809-F812 WeakPolarHBondContact O-CD2 3.22Å; L809-F812 PolarHBondContact O-N 3.14Å
810	H	93.6	Very high	93.9	Very high	43 Å²	43	35 Å²	35	20%	0.199	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-9.5	-167.1	65.9	25.2	0	0	0	116.2	S736 K737 W806	S736-H810 PolarHBondContact OG-CD2 2.92Å; S736-H810 PolarHBondContact OG-CE1 3.44Å; S736-H810 PolarHBondContact OG-ND1 3.03Å; S736-H810 PolarHBondContact OG-NE2 3.5Å; S736-H810 VanDerWaalsContact OG-NE2 3.12Å; K737-H810 PolarHBondContact N-O 2.88Å; W806-H810 HydrophobicContact CD2-CB 4.47Å; W806-H810 HydrophobicContact CZ2-CB 4.05Å; W806-H810 PolarHBondContact O-N 3.49Å
811	N	93.9	Very high	94	Very high	16 Å²	16	34.4 Å²	34.4	9%	0.086	18%	0.175	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	0.4	176.2	-72.1	108.7	0	0	0	114.9	W733 C734 L809	W733-N811 PolarHBondContact NE1-ND2 3.29Å; C734-N811 PolarHBondContact N-O 3.41Å; C734-N811 WeakPolarHBondContact O-CA 3.15Å; C734-N811 PolarHBondContact O-ND2 3.3Å; C734-N811 VanDerWaalsContact SG-C 3.51Å; C734-N811 PolarHBondContact SG-O 2.9Å; C734-N811 VanDerWaalsContact SG-O 3.34Å; L809-N811 PolarHBondContact O-N 2.86Å
812	F	95.1	Very high	94	Very high	2 Å²	2	34.5 Å²	34.5	1%	0.009	18%	0.176	C	C	.	.			trans	-93.2	142.7	-178.9	-65.8	-67.2	0	0	0	113.9	C734 K737 R774 V777 M778 R781 L809 V815 L998	C734-F812 VanDerWaalsContact SG-C 3.6Å; C734-F812 PolarHBondContact SG-O 3.39Å; K737-F812 PolarHBondContact NZ-O 2.88Å; R774-F812 HydrophobicContact CG-CE2 4.02Å; R774-F812 HydrophobicContact CG-CZ 4.29Å; V777-F812 HydrophobicContact CB-CD2 4.2Å; V777-F812 HydrophobicContact CB-CE2 4.25Å; V777-F812 HydrophobicContact CG1-CB 3.89Å; V777-F812 HydrophobicContact CG1-CD1 4.06Å; V777-F812 HydrophobicContact CG1-CD2 3.46Å; V777-F812 VanDerWaalsContact CG1-CD2 3.46Å; V777-F812 HydrophobicContact CG1-CE1 4.45Å; V777-F812 HydrophobicContact CG1-CE2 3.92Å; V777-F812 HydrophobicContact CG1-CG 3.53Å; V777-F812 HydrophobicContact CG1-CZ 4.39Å; M778-F812 HydrophobicContact CB-CZ 4.1Å; R781-F812 HydrophobicContact CB-CD1 3.83Å; R781-F812 HydrophobicContact CB-CE1 4.11Å; R781-F812 HydrophobicContact CG-CB 4.41Å; R781-F812 HydrophobicContact CG-CD1 3.79Å; R781-F812 HydrophobicContact CG-CE1 4.43Å; R781-F812 HydrophobicContact CG-CG 4.33Å; L809-F812 HydrophobicContact CD2-CD2 4.37Å; L809-F812 HydrophobicContact CD2-CE2 4.4Å; L809-F812 WeakPolarHBondContact O-CD2 3.22Å; L809-F812 PolarHBondContact O-N 3.14Å; F812-V815 HydrophobicContact CB-CG2 3.9Å; F812-L998 HydrophobicContact CE1-CD1 3.68Å; F812-L998 HydrophobicContact CE2-CD1 4.39Å; F812-L998 HydrophobicContact CZ-CD1 3.47Å; F812-L998 VanDerWaalsContact CZ-CD1 3.47Å
813	P	94.1	Very high	94	Very high	2 Å²	2	38 Å²	38	1%	0.013	19%	0.194	C	C	.	.	S	Bend	trans	-78.9	158.4	171.4	32.7	-34.4	0	0	0	112.2	H732 R781 Y787 L790 V815	H732-P813 HydrophobicContact CB-CG 4.01Å; R781-P813 PolarHBondContact NE-O 2.8Å; R781-P813 PolarHBondContact NH2-O 3.23Å; Y787-P813 HydrophobicContact CE2-CB 3.61Å; Y787-P813 HydrophobicContact CE2-CG 4.01Å; L790-P813 HydrophobicContact CD1-CG 3.9Å; P813-V815 PolarHBondContact O-N 3.03Å
814	K	94.3	Very high	94.1	Very high	60 Å²	60	34 Å²	34	26%	0.261	18%	0.183	S	C	.	.	S	Bend	trans	49.3	53.6	178.2	-62.3	176.5	167	176.2	0	113.7	R781 Y787 H788 L790 I793	R781-K814 PolarHBondContact NH2-O 2.75Å; Y787-K814 WeakPolarHBondContact O-CE 3.41Å; Y787-K814 PolarHBondContact O-NZ 3.04Å; H788-K814 PolarHBondContact O-NZ 3.4Å; L790-K814 HydrophobicContact CB-CD 3.92Å; L790-K814 WeakPolarHBondContact O-CD 3.17Å; L790-K814 PolarHBondContact O-NZ 2.82Å; I793-K814 PolarHBondContact N-O 3.19Å
815	V	96.1	Very high	94.2	Very high	5 Å²	5	34.5 Å²	34.5	3%	0.03	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	134.9	173.1	-179.3	0	0	0	0	108.5	V742 V777 I793 F795 W806 F812 P813	V742-V815 WeakPolarHBondContact CG1-O 3.06Å; V777-V815 HydrophobicContact CG1-CG2 4.34Å; I793-V815 WeakPolarHBondContact O-CA 3.06Å; F795-V815 HydrophobicContact CD2-CG1 3.92Å; F795-V815 HydrophobicContact CE2-CG1 3.64Å; W806-V815 HydrophobicContact CH2-CB 4.49Å; W806-V815 HydrophobicContact CH2-CG1 4.17Å; W806-V815 HydrophobicContact CZ3-CG1 3.85Å; F812-V815 HydrophobicContact CB-CG2 3.9Å; P813-V815 PolarHBondContact O-N 3.03Å
816	S	95.8	Very high	94.3	Very high	31 Å²	31	36.4 Å²	36.4	22%	0.217	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.7	157.6	179.2	-66.1	0	0	0	0	111.2	V742 I793 V794 F795	V742-S816 CarbonylContact O-C 3.21Å; V742-S816 WeakPolarHBondContact O-CA 3.37Å; I793-S816 PolarHBondContact O-N 2.84Å; V794-S816 WeakPolarHBondContact CA-O 3.27Å; F795-S816 PolarHBondContact N-O 3.49Å
817	I	96.9	Very high	94.3	Very high	1 Å²	1	36 Å²	36	1%	0.005	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	125.6	180	-65.8	172	0	0	0	108.9	I739 V742 I743 L744 F795 L802 W806	I739-I817 HydrophobicContact CD1-CD1 4.01Å; I739-I817 HydrophobicContact CG1-CD1 3.89Å; V742-I817 HydrophobicContact CG2-CD1 4Å; V742-I817 HydrophobicContact CG2-CG1 4.31Å; V742-I817 PolarHBondContact O-N 3.16Å; I743-I817 CarbonylContact C-O 2.98Å; I743-I817 WeakPolarHBondContact CA-O 3.25Å; I743-I817 HydrophobicContact CG1-CB 4.31Å; I743-I817 HydrophobicContact CG1-CG2 4.35Å; L744-I817 PolarHBondContact N-O 3.38Å; F795-I817 HydrophobicContact CB-CG1 4.35Å; F795-I817 HydrophobicContact CD2-CG1 4.44Å; L802-I817 HydrophobicContact CB-CD1 4.36Å; L802-I817 HydrophobicContact CD1-CG1 4.38Å; L802-I817 HydrophobicContact CD1-CG2 3.66Å; W806-I817 HydrophobicContact CE3-CD1 3.89Å; W806-I817 HydrophobicContact CZ3-CD1 4.16Å
818	L	96.4	Very high	94.5	Very high	2 Å²	2	28.8 Å²	28.8	1%	0.01	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106	103.4	165.9	176.9	59.9	0	0	0	108.3	L744 V794 F795 V796 G820 D827 V831	L744-L818 VanDerWaalsContact O-CD1 3.31Å; L744-L818 WeakPolarHBondContact O-CD1 3.39Å; V794-L818 HydrophobicContact CG1-CB 4.43Å; F795-L818 PolarHBondContact O-N 3.11Å; V796-L818 HydrophobicContact CG2-CB 4.4Å; L818-G820 PolarHBondContact O-N 3.39Å; L818-D827 HydrophobicContact CD2-CB 3.89Å; L818-V831 HydrophobicContact CD2-CG1 3.55Å
819	P	94.8	Very high	94.6	Very high	49 Å²	49	32 Å²	32	32%	0.318	17%	0.174	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.9	121	178.6	29	-34.2	0	0	0	110.1	I743 L744 L799	I743-P819 HydrophobicContact CG2-CG 4.16Å; L744-P819 WeakPolarHBondContact O-CD 3.46Å; L799-P819 HydrophobicContact CB-CB 4.03Å
820	G	91.6	Very high	94.5	Very high	32 Å²	32	32.3 Å²	32.3	33%	0.33	18%	0.177	S	C	.	.	S	Bend	trans	174.6	-152.2	-172.4	0	0	0	0	0	112.7	G797 L818	G797-G820 CarbonylContact C-O 3.49Å; G797-G820 WeakPolarHBondContact CA-O 3.3Å; G797-G820 PolarHBondContact O-N 3.19Å; G797-G820 VanDerWaalsContact O-O 3.12Å; L818-G820 PolarHBondContact O-N 3.39Å
821	T	93.8	Very high	94.5	Very high	62 Å²	62	30.3 Å²	30.3	38%	0.38	17%	0.168	S	C	.	.			trans	-134.2	137	174.2	173.1	0	0	0	0	110.7	L823 S824	T821-L823 PolarHBondContact O-N 3.32Å; T821-L823 VanDerWaalsContact O-N 3.12Å; T821-L823 PolarHBondContact OG1-N 3.27Å; T821-S824 VanDerWaalsContact O-CB 3.28Å; T821-S824 WeakPolarHBondContact O-CB 3.38Å; T821-S824 PolarHBondContact O-N 2.76Å
822	P	94.4	Very high	94.4	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.013	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-22.9	175.2	-27.6	36.3	0	0	0	115.1	C761 F763 S824 L828	C761-P822 HydrophobicContact CB-CB 3.69Å; C761-P822 HydrophobicContact CB-CG 3.6Å; F763-P822 HydrophobicContact CE1-CB 4.35Å; F763-P822 HydrophobicContact CE1-CG 4.26Å; F763-P822 HydrophobicContact CE2-CB 4.05Å; F763-P822 HydrophobicContact CE2-CG 4.09Å; F763-P822 HydrophobicContact CZ-CB 3.69Å; F763-P822 HydrophobicContact CZ-CG 3.92Å; P822-S824 PolarHBondContact O-N 2.83Å; P822-L828 VanDerWaalsContact O-CD1 3.29Å; P822-L828 WeakPolarHBondContact O-CD1 3.46Å
823	L	95.4	Very high	94.3	Very high	75 Å²	75	31.3 Å²	31.3	39%	0.393	17%	0.173	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.5	177.3	-59	176	0	0	0	112.3	F763 T821 R825 L861 A862 N865	F763-L823 HydrophobicContact CE1-CD1 4.19Å; F763-L823 HydrophobicContact CE1-CD2 4.37Å; F763-L823 HydrophobicContact CE1-CG 3.91Å; F763-L823 HydrophobicContact CZ-CD2 3.98Å; F763-L823 HydrophobicContact CZ-CG 3.96Å; T821-L823 PolarHBondContact O-N 3.32Å; T821-L823 VanDerWaalsContact O-N 3.12Å; T821-L823 PolarHBondContact OG1-N 3.27Å; L823-R825 PolarHBondContact O-N 3.07Å; L823-R825 VanDerWaalsContact O-N 3.16Å; L823-L861 HydrophobicContact CD2-CB 4.24Å; L823-A862 HydrophobicContact CD2-CB 4.21Å; L823-N865 PolarHBondContact O-ND2 3.26Å
824	S	96.3	Very high	94.2	Very high	28 Å²	28	34.1 Å²	34.1	20%	0.196	19%	0.188	C	C	.	.			trans	-76.8	100.5	179	175.1	0	0	0	0	111.5	T821 P822 A826 D827 L828	T821-S824 VanDerWaalsContact O-CB 3.28Å; T821-S824 WeakPolarHBondContact O-CB 3.38Å; T821-S824 PolarHBondContact O-N 2.76Å; P822-S824 PolarHBondContact O-N 2.83Å; S824-A826 PolarHBondContact O-N 3.34Å; S824-D827 WeakPolarHBondContact CB-OD2 3.33Å; S824-D827 PolarHBondContact O-N 3.04Å; S824-D827 PolarHBondContact OG-OD2 3.15Å; S824-L828 PolarHBondContact O-N 3.42Å; S824-L828 VanDerWaalsContact O-N 3.15Å
825	R	94.6	Very high	94	Very high	100 Å²	100	35.1 Å²	35.1	38%	0.377	20%	0.196	S	C	.	.	H	α-helix	trans	-52.4	-25.6	172.5	-65.9	-175.2	-177.1	-138.2	-16.3	113.2	L823 R829 N865 S868 M869	L823-R825 PolarHBondContact O-N 3.07Å; L823-R825 VanDerWaalsContact O-N 3.16Å; R825-R829 WeakPolarHBondContact O-CB 3.36Å; R825-R829 VanDerWaalsContact O-CG 3.28Å; R825-R829 WeakPolarHBondContact O-CG 3.33Å; R825-R829 PolarHBondContact O-N 2.75Å; R825-N865 VanDerWaalsContact CZ-OD1 3.26Å; R825-N865 PolarHBondContact NE-OD1 3.47Å; R825-N865 PolarHBondContact NH2-O 3.1Å; R825-N865 PolarHBondContact NH2-OD1 2.92Å; R825-S868 PolarHBondContact NH1-O 3.37Å; R825-S868 PolarHBondContact NH2-OG 3.24Å; R825-M869 HydrophobicContact CB-CE 4.33Å; R825-M869 HydrophobicContact CG-CG 4.4Å; R825-M869 HydrophobicContact CG-SD 4.38Å
826	A	93.3	Very high	93.9	Very high	44 Å²	44	35.4 Å²	35.4	36%	0.364	20%	0.198	S	C	.	.	H	α-helix	trans	-72.1	-33.3	177.6	0	0	0	0	0	113	S824 A830	S824-A826 PolarHBondContact O-N 3.34Å; A826-A830 WeakPolarHBondContact O-CB 3.38Å; A826-A830 PolarHBondContact O-N 3.49Å
827	D	95	Very high	93.8	Very high	7 Å²	7	36.9 Å²	36.9	4%	0.037	20%	0.203	C	C	.	.	H	α-helix	trans	-79.3	-41.4	176	-63.3	-57.7	0	0	0	110.7	R746 L818 S824 R829 A830 V831	R746-D827 IonicContact CZ-OD1 2.76Å; R746-D827 IonicContact CZ-OD2 3.75Å; R746-D827 IonicContact NE-OD1 2.61Å; R746-D827 PolarHBondContact NE-OD1 3.08Å; R746-D827 IonicContact NE-OD2 2.7Å; R746-D827 IonicContact NH2-OD1 2.73Å; R746-D827 PolarHBondContact NH2-OD1 2.75Å; R746-D827 IonicContact NH2-OD2 2.81Å; R746-D827 PolarHBondContact NH2-OD2 2.8Å; L818-D827 HydrophobicContact CD2-CB 3.89Å; S824-D827 WeakPolarHBondContact CB-OD2 3.33Å; S824-D827 PolarHBondContact O-N 3.04Å; S824-D827 PolarHBondContact OG-OD2 3.15Å; D827-R829 VanDerWaalsContact C-N 3.34Å; D827-R829 PolarHBondContact O-N 3.44Å; D827-A830 PolarHBondContact O-N 3.34Å; D827-A830 VanDerWaalsContact O-N 3.07Å; D827-V831 PolarHBondContact O-N 2.8Å
828	L	94.6	Very high	93.7	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-59.7	-39.7	173	-60.2	-179	0	0	0	112.8	P822 S824 V831 I833 I866 M869	P822-L828 VanDerWaalsContact O-CD1 3.29Å; P822-L828 WeakPolarHBondContact O-CD1 3.46Å; S824-L828 PolarHBondContact O-N 3.42Å; S824-L828 VanDerWaalsContact O-N 3.15Å; L828-V831 VanDerWaalsContact O-CG2 3.31Å; L828-V831 WeakPolarHBondContact O-CG2 3.41Å; L828-I833 HydrophobicContact CB-CD1 4.49Å; L828-I833 HydrophobicContact CB-CG2 4.13Å; L828-I833 HydrophobicContact CD2-CD1 3.95Å; L828-I833 WeakPolarHBondContact O-CB 3.43Å; L828-I833 WeakPolarHBondContact O-CG2 3.48Å; L828-I833 PolarHBondContact O-N 3.4Å; L828-I866 HydrophobicContact CD1-CG1 3.75Å; L828-M869 HydrophobicContact CB-CE 4.11Å; L828-M869 HydrophobicContact CB-SD 4.13Å; L828-M869 HydrophobicContact CD1-SD 3.85Å
829	R	92.8	Very high	93.7	Very high	110 Å²	110	36.8 Å²	36.8	42%	0.415	20%	0.203	S	C	.	.	H	α-helix	trans	-66.2	-37.9	172.2	-77.3	-173.7	-171.3	-73.4	6.6	112.3	R825 D827 V831 N832 M869 Q870 F871	R825-R829 WeakPolarHBondContact O-CB 3.36Å; R825-R829 VanDerWaalsContact O-CG 3.28Å; R825-R829 WeakPolarHBondContact O-CG 3.33Å; R825-R829 PolarHBondContact O-N 2.75Å; D827-R829 VanDerWaalsContact C-N 3.34Å; D827-R829 PolarHBondContact O-N 3.44Å; R829-V831 VanDerWaalsContact C-N 3.31Å; R829-V831 PolarHBondContact O-N 3.23Å; R829-N832 PolarHBondContact O-N 2.94Å; R829-N832 VanDerWaalsContact O-N 3.07Å; R829-M869 HydrophobicContact CG-CE 3.57Å; R829-Q870 VanDerWaalsContact CZ-O 3.24Å; R829-Q870 PolarHBondContact NH1-O 3.48Å; R829-Q870 PolarHBondContact NH2-O 3.15Å; R829-F871 HydrophobicContact CG-CE1 4.42Å
830	A	92.1	Very high	93.9	Very high	8 Å²	8	34.5 Å²	34.5	7%	0.066	19%	0.188	C	C	.	.	H	α-helix	trans	-71	-22.9	-176.4	0	0	0	0	0	114.2	R746 A749 S750 A826 D827 N832	R746-A830 HydrophobicContact CB-CB 4.45Å; R746-A830 HydrophobicContact CG-CB 3.39Å; A749-A830 CarbonylContact C-O 3.54Å; A749-A830 HydrophobicContact CB-CB 4.38Å; A749-A830 WeakPolarHBondContact CB-O 3.42Å; S750-A830 PolarHBondContact N-O 3.42Å; A826-A830 WeakPolarHBondContact O-CB 3.38Å; A826-A830 PolarHBondContact O-N 3.49Å; D827-A830 PolarHBondContact O-N 3.34Å; D827-A830 VanDerWaalsContact O-N 3.07Å; A830-N832 VanDerWaalsContact C-N 3.35Å
831	V	93.1	Very high	94.1	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.9	-1.5	170.1	-58	0	0	0	0	113.5	H757 V759 V794 V796 L818 D827 L828 R829 I833	H757-V831 PolarHBondContact CE1-O 2.9Å; H757-V831 PolarHBondContact NE2-O 2.98Å; H757-V831 VanDerWaalsContact NE2-O 3.17Å; V759-V831 HydrophobicContact CG1-CG2 4.23Å; V759-V831 HydrophobicContact CG2-CB 4.5Å; V759-V831 HydrophobicContact CG2-CG2 3.92Å; V794-V831 HydrophobicContact CG1-CG1 3.89Å; V796-V831 HydrophobicContact CG2-CG1 4.27Å; L818-V831 HydrophobicContact CD2-CG1 3.55Å; D827-V831 PolarHBondContact O-N 2.8Å; L828-V831 VanDerWaalsContact O-CG2 3.31Å; L828-V831 WeakPolarHBondContact O-CG2 3.41Å; R829-V831 VanDerWaalsContact C-N 3.31Å; R829-V831 PolarHBondContact O-N 3.23Å; V831-I833 HydrophobicContact CG2-CB 4.39Å
832	N	92.1	Very high	94.1	Very high	39 Å²	39	30.4 Å²	30.4	21%	0.209	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	57	54.1	-172.4	-46.8	-63.2	0	0	0	112.8	R829 A830 N834 L835	R829-N832 PolarHBondContact O-N 2.94Å; R829-N832 VanDerWaalsContact O-N 3.07Å; A830-N832 VanDerWaalsContact C-N 3.35Å; N832-N834 PolarHBondContact O-N 2.73Å; N832-L835 HydrophobicContact CB-CB 4.42Å; N832-L835 HydrophobicContact CB-CD1 4.34Å; N832-L835 WeakPolarHBondContact O-CA 3.42Å; N832-L835 PolarHBondContact O-N 2.94Å
833	I	93.6	Very high	93.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.156	C	C	.	.	G	3₁₀ helix	trans	-57.1	-21.4	-178.5	-167.4	161.8	0	0	0	114.4	L828 V831 L835 C836 C839 I866 M869 F871 I915	L828-I833 HydrophobicContact CB-CD1 4.49Å; L828-I833 HydrophobicContact CB-CG2 4.13Å; L828-I833 HydrophobicContact CD2-CD1 3.95Å; L828-I833 WeakPolarHBondContact O-CB 3.43Å; L828-I833 WeakPolarHBondContact O-CG2 3.48Å; L828-I833 PolarHBondContact O-N 3.4Å; V831-I833 HydrophobicContact CG2-CB 4.39Å; I833-L835 PolarHBondContact O-N 3.23Å; I833-C836 PolarHBondContact O-N 3.44Å; I833-C836 PolarHBondContact O-SG 2.77Å; I833-C839 HydrophobicContact CD1-CB 4.17Å; I833-I866 HydrophobicContact CD1-CD1 3.94Å; I833-I866 HydrophobicContact CD1-CG1 3.99Å; I833-I866 HydrophobicContact CD1-CG2 4.05Å; I833-M869 HydrophobicContact CG2-CE 4.38Å; I833-M869 HydrophobicContact CG2-SD 4.44Å; I833-F871 HydrophobicContact CG2-CE1 4.08Å; I833-F871 HydrophobicContact CG2-CZ 3.73Å; I833-I915 HydrophobicContact CG1-CD1 4.47Å; I833-I915 HydrophobicContact CG1-CG2 4.25Å; I833-I915 HydrophobicContact CG2-CD1 4.21Å
834	N	90.4	Very high	93.2	Very high	61 Å²	61	27 Å²	27	33%	0.326	14%	0.139	S	C	.	.	G	3₁₀ helix	trans	-73.1	-5.1	172.2	62.7	-51.7	0	0	0	114.3	N832 F871	N832-N834 PolarHBondContact O-N 2.73Å; N834-F871 HydrophobicContact CB-CD1 3.69Å; N834-F871 HydrophobicContact CB-CD2 3.92Å; N834-F871 HydrophobicContact CB-CE1 3.77Å; N834-F871 HydrophobicContact CB-CE2 4.01Å; N834-F871 HydrophobicContact CB-CG 3.78Å; N834-F871 HydrophobicContact CB-CZ 3.94Å; N834-F871 VanDerWaalsContact CG-CD1 3.49Å
835	L	91.3	Very high	92.2	Very high	81 Å²	81	26.6 Å²	26.6	42%	0.424	13%	0.134	S	C	.	.	G	3₁₀ helix	trans	-124.2	20.3	177.7	-56.5	177.4	0	0	0	111.8	S755 G756 H757 N832 I833	S755-L835 WeakPolarHBondContact CA-O 3.39Å; G756-L835 PolarHBondContact N-O 2.63Å; H757-L835 PolarHBondContact ND1-O 2.71Å; N832-L835 HydrophobicContact CB-CB 4.42Å; N832-L835 HydrophobicContact CB-CD1 4.34Å; N832-L835 WeakPolarHBondContact O-CA 3.42Å; N832-L835 PolarHBondContact O-N 2.94Å; I833-L835 PolarHBondContact O-N 3.23Å
836	C	93.8	Very high	90.8	Very high	11 Å²	11	23.4 Å²	23.4	7%	0.074	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	150.9	170.3	78.5	0	0	0	0	111.2	H757 V759 I833 M838	H757-C836 CarbonylContact O-C 3.34Å; H757-C836 VanDerWaalsContact O-CA 3.27Å; H757-C836 WeakPolarHBondContact O-CA 3.33Å; H757-C836 VanDerWaalsContact O-CB 3.29Å; H757-C836 WeakPolarHBondContact O-CB 3.49Å; V759-C836 HydrophobicContact CG2-CB 3.95Å; I833-C836 PolarHBondContact O-N 3.44Å; I833-C836 PolarHBondContact O-SG 2.77Å; C836-M838 VanDerWaalsContact SG-C 3.56Å
837	D	92.8	Very high	89.3	Confident	62 Å²	62	23 Å²	23	33%	0.332	12%	0.116	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-23.8	172	-75.8	3.3	0	0	0	111.7	G756 H757 K791 P916	G756-D837 WeakPolarHBondContact CA-OD1 3.43Å; H757-D837 PolarHBondContact O-N 2.83Å; K791-D837 HydrophobicContact CD-CB 4.2Å; K791-D837 VanDerWaalsContact CD-OD2 3.25Å; K791-D837 WeakPolarHBondContact CD-OD2 3.46Å; K791-D837 WeakPolarHBondContact CE-OD2 3.33Å; K791-D837 IonicContact NZ-OD2 3.08Å; K791-D837 PolarHBondContact NZ-OD2 2.91Å; D837-P916 WeakPolarHBondContact O-CG 3.39Å
838	M	95.6	Very high	87.4	Confident	2 Å²	2	27.9 Å²	27.9	1%	0.01	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-161.5	136.3	175.3	-167.8	55.8	61.6	0	0	110.2	C536 Q539 V758 V759 C836 V840 P916 I918	C536-M838 HydrophobicContact CB-CB 4.07Å; C536-M838 HydrophobicContact CB-CG 4.33Å; C536-M838 VanDerWaalsContact SG-CG 3.6Å; Q539-M838 HydrophobicContact CB-CE 3.95Å; Q539-M838 HydrophobicContact CG-CE 3.76Å; V758-M838 WeakPolarHBondContact CA-O 3.4Å; V759-M838 PolarHBondContact N-O 3.45Å; C836-M838 VanDerWaalsContact SG-C 3.56Å; M838-V840 HydrophobicContact CG-CG2 4.04Å; M838-P916 HydrophobicContact CE-CB 3.85Å; M838-P916 HydrophobicContact SD-CB 4.02Å; M838-I918 HydrophobicContact CG-CG2 3.79Å; M838-I918 HydrophobicContact SD-CB 4.05Å; M838-I918 HydrophobicContact SD-CG2 3.77Å
839	C	97	Very high	85.9	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	15%	0.152	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	118.5	160	-174.9	0	0	0	0	109.1	V759 I833 P916 I917 I918	V759-C839 CarbonylContact O-C 3.41Å; V759-C839 WeakPolarHBondContact O-CA 3.34Å; I833-C839 HydrophobicContact CD1-CB 4.17Å; C839-P916 PolarHBondContact N-O 2.83Å; C839-I917 HydrophobicContact CB-CG1 4.25Å; C839-I917 CarbonylContact O-C 3.37Å; C839-I917 VanDerWaalsContact O-CA 3.32Å; C839-I917 WeakPolarHBondContact O-CA 3.41Å; C839-I918 PolarHBondContact O-N 3.48Å
840	V	97.6	Very high	84.4	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	128.6	176.4	-179.5	0	0	0	0	108.6	I532 C536 V758 V759 V760 C761 M838 L842 I918	I532-V840 HydrophobicContact CG2-CB 4.35Å; I532-V840 HydrophobicContact CG2-CG1 3.45Å; I532-V840 VanDerWaalsContact CG2-CG1 3.45Å; I532-V840 HydrophobicContact CG2-CG2 3.93Å; C536-V840 WeakPolarHBondContact SG-CG2 3.44Å; V758-V840 HydrophobicContact CG1-CG2 4.06Å; V759-V840 PolarHBondContact O-N 2.99Å; V760-V840 CarbonylContact C-O 3.59Å; V760-V840 WeakPolarHBondContact CA-O 3.49Å; V760-V840 HydrophobicContact CG1-CB 4.28Å; V760-V840 HydrophobicContact CG1-CG1 4.35Å; V760-V840 HydrophobicContact CG2-CB 4.33Å; C761-V840 PolarHBondContact N-O 3.01Å; M838-V840 HydrophobicContact CG-CG2 4.04Å; V840-L842 HydrophobicContact CG1-CD1 4.32Å; V840-L842 HydrophobicContact CG1-CD2 3.7Å; V840-L842 HydrophobicContact CG1-CG 3.86Å; V840-I918 WeakPolarHBondContact CA-O 3.47Å; V840-I918 HydrophobicContact CB-CG2 4.36Å; V840-I918 HydrophobicContact CG1-CG2 4.45Å; V840-I918 HydrophobicContact CG2-CG2 3.89Å
841	I	96.7	Very high	83.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	116.1	179.5	-53.7	179.3	0	0	0	109.5	C761 F763 C859 A862 I866 I917 I918 T919 E920	C761-I841 HydrophobicContact CB-CG1 4.22Å; F763-I841 HydrophobicContact CE2-CG2 4.15Å; I841-C859 HydrophobicContact CG2-CB 4.12Å; I841-A862 HydrophobicContact CD1-CB 4.02Å; I841-A862 HydrophobicContact CG2-CB 4.13Å; I841-I866 HydrophobicContact CD1-CD1 3.87Å; I841-I917 HydrophobicContact CD1-CG2 3.61Å; I841-I917 HydrophobicContact CG1-CG2 4.1Å; I841-I918 PolarHBondContact N-O 3Å; I841-T919 HydrophobicContact CB-CG2 4.31Å; I841-T919 HydrophobicContact CG2-CG2 4.47Å; I841-E920 PolarHBondContact O-N 3.36Å
842	L	93.5	Very high	82.7	Confident	8 Å²	8	40.7 Å²	40.7	4%	0.042	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	145.7	-176.9	-51.2	177.6	0	0	0	111.4	I532 V760 C761 F763 V771 L773 L776 V840 E920	I532-L842 HydrophobicContact CD1-CD2 3.99Å; V760-L842 HydrophobicContact CG1-CD1 4.09Å; C761-L842 PolarHBondContact O-N 3.02Å; F763-L842 PolarHBondContact N-O 3.43Å; V771-L842 HydrophobicContact CG1-CD1 4.33Å; L773-L842 HydrophobicContact CD2-CD1 4.06Å; L776-L842 HydrophobicContact CD2-CD1 4.29Å; V840-L842 HydrophobicContact CG1-CD1 4.32Å; V840-L842 HydrophobicContact CG1-CD2 3.7Å; V840-L842 HydrophobicContact CG1-CG 3.86Å; L842-E920 HydrophobicContact CD2-CB 4.07Å
843	S	87.9	Confident	82.1	Confident	3 Å²	3	41.4 Å²	41.4	2%	0.021	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	133.2	169	-177.8	0	0	0	0	110.9	N845 Q846	S843-N845 PolarHBondContact OG-N 3.05Å; S843-Q846 VanDerWaalsContact O-CD 3.29Å; S843-Q846 PolarHBondContact O-NE2 2.95Å
844	A	82.9	Confident	81.7	Confident	3 Å²	3	45.7 Å²	45.7	3%	0.025	25%	0.248	C	C	.	.	S	Bend	trans	-101	-10	164.8	0	0	0	0	0	111.9	F763 V771 Y801 Q846	F763-A844 WeakPolarHBondContact O-CB 3.21Å; F763-A844 PolarHBondContact O-N 3.3Å; V771-A844 HydrophobicContact CG2-CB 3.75Å; Y801-A844 HydrophobicContact CE2-CB 3.75Å; Y801-A844 WeakPolarHBondContact OH-CB 3.42Å; A844-Q846 PolarHBondContact O-N 2.9Å
845	N	75.7	Confident	81.4	Confident	19 Å²	19	44.2 Å²	44.2	10%	0.102	24%	0.239	C	C	.	.			trans	-86.5	12.3	-176.2	-81.7	-6.7	0	0	0	113.5	D765 S768 S843 N847 N848	D765-N845 PolarHBondContact OD2-ND2 3.33Å; S768-N845 VanDerWaalsContact CB-OD1 3.27Å; S768-N845 WeakPolarHBondContact CB-OD1 3.49Å; S843-N845 PolarHBondContact OG-N 3.05Å; N845-N847 PolarHBondContact O-N 3.48Å; N845-N848 PolarHBondContact O-N 3.32Å
846	Q	64.8	Low	81.3	Confident	34 Å²	34	40.4 Å²	40.4	16%	0.159	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-24	-175.1	-58.7	178.4	-40.7	0	0	113.8	S843 A844 E920 V922	S843-Q846 VanDerWaalsContact O-CD 3.29Å; S843-Q846 PolarHBondContact O-NE2 2.95Å; A844-Q846 PolarHBondContact O-N 2.9Å; Q846-E920 PolarHBondContact NE2-OE1 3.47Å; Q846-V922 HydrophobicContact CB-CG2 4.09Å; Q846-V922 HydrophobicContact CG-CG2 3.64Å; Q846-V922 VanDerWaalsContact NE2-CG2 3.27Å
847	N	61.2	Low	81.1	Confident	35 Å²	35	44 Å²	44	19%	0.187	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-94.7	-5.3	-165.9	-64.9	9.2	0	0	0	115.3	C468 A469 N845	C468-N847 PolarHBondContact O-ND2 3.03Å; A469-N847 PolarHBondContact O-ND2 3.11Å; N845-N847 PolarHBondContact O-N 3.48Å
848	N	56.3	Low	81.1	Confident	110 Å²	110	43.6 Å²	43.6	59%	0.588	23%	0.23	S	C	*	.	S	Bend	trans	-112.9	13	-163.6	-72.3	-34.6	0	0	0	115	N845	N845-N848 PolarHBondContact O-N 3.32Å
849	I	62.5	Low	81	Confident	42 Å²	42	43.5 Å²	43.5	22%	0.215	23%	0.23	C	C	.	.			trans	-127.7	121.9	-174	-58.5	174.3	0	0	0	109.6	D851 L854 Q855 K857	I849-D851 VanDerWaalsContact C-N 3.29Å; I849-D851 WeakPolarHBondContact CG2-O 3.42Å; I849-D851 PolarHBondContact O-N 3.18Å; I849-L854 HydrophobicContact CG2-CB 4.02Å; I849-Q855 HydrophobicContact CB-CG 4.24Å; I849-Q855 PolarHBondContact O-NE2 2.9Å; I849-K857 HydrophobicContact CD1-CD 4.44Å
850	E	61.8	Low	80.8	Confident	211 Å²	211	44.4 Å²	44.4	99%	0.986	23%	0.234	S	C	*	.	S	Bend	trans	-69.3	-23	-176.2	-61.2	-177.1	154.5	0	0	113.7
851	D	76.3	Confident	80.7	Confident	79 Å²	79	49.2 Å²	49.2	42%	0.422	26%	0.259	S	S	.	.			trans	-98.4	115.5	177.2	-173.9	-26.2	0	0	0	110.6	I849 S853 L854	I849-D851 VanDerWaalsContact C-N 3.29Å; I849-D851 WeakPolarHBondContact CG2-O 3.42Å; I849-D851 PolarHBondContact O-N 3.18Å; D851-S853 VanDerWaalsContact CG-OG 3.29Å; D851-S853 PolarHBondContact O-N 3.37Å; D851-S853 WeakPolarHBondContact OD1-CB 3.32Å; D851-S853 PolarHBondContact OD1-N 2.95Å; D851-S853 PolarHBondContact OD1-OG 2.95Å; D851-S853 PolarHBondContact OD2-OG 3.43Å; D851-L854 HydrophobicContact CB-CB 4.35Å; D851-L854 HydrophobicContact CB-CD1 4.16Å; D851-L854 HydrophobicContact CB-CG 4.28Å; D851-L854 PolarHBondContact O-N 3.06Å; D851-L854 VanDerWaalsContact O-N 3.16Å
852	A	72.9	Confident	80.6	Confident	54 Å²	54	49.2 Å²	49.2	45%	0.446	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-22	-179.2	0	0	0	0	0	114.1	N923	A852-N923 PolarHBondContact O-ND2 3.01Å
853	S	79.3	Confident	80.7	Confident	55 Å²	55	48.9 Å²	48.9	39%	0.385	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-33.8	174.3	70.7	0	0	0	0	111.9	D851 Q855 N926	D851-S853 VanDerWaalsContact CG-OG 3.29Å; D851-S853 PolarHBondContact O-N 3.37Å; D851-S853 WeakPolarHBondContact OD1-CB 3.32Å; D851-S853 PolarHBondContact OD1-N 2.95Å; D851-S853 PolarHBondContact OD1-OG 2.95Å; D851-S853 PolarHBondContact OD2-OG 3.43Å; S853-Q855 PolarHBondContact O-N 3.03Å; S853-N926 PolarHBondContact O-ND2 3.33Å; S853-N926 PolarHBondContact O-OD1 2.96Å
854	L	85.3	Confident	81	Confident	90 Å²	90	51 Å²	51	47%	0.471	27%	0.269	S	S	.	.	S	Bend	trans	-88.3	2.8	-172.9	-64.5	179.1	0	0	0	114.5	I849 D851 K857	I849-L854 HydrophobicContact CG2-CB 4.02Å; D851-L854 HydrophobicContact CB-CB 4.35Å; D851-L854 HydrophobicContact CB-CD1 4.16Å; D851-L854 HydrophobicContact CB-CG 4.28Å; D851-L854 PolarHBondContact O-N 3.06Å; D851-L854 VanDerWaalsContact O-N 3.16Å; L854-K857 WeakPolarHBondContact O-CD 3.48Å; L854-K857 WeakPolarHBondContact O-CG 3.34Å
855	Q	83.7	Confident	81.6	Confident	30 Å²	30	52 Å²	52	14%	0.14	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-40.4	-178.1	-70.1	178.8	-2.7	0	0	112.7	I849 S853 K857 V922	I849-Q855 HydrophobicContact CB-CG 4.24Å; I849-Q855 PolarHBondContact O-NE2 2.9Å; S853-Q855 PolarHBondContact O-N 3.03Å; Q855-K857 VanDerWaalsContact C-N 3.34Å; Q855-K857 PolarHBondContact O-N 3.45Å; Q855-V922 VanDerWaalsContact OE1-CG1 3.32Å
856	D	89.7	Confident	82.4	Confident	1 Å²	1	51.2 Å²	51.2	1%	0.005	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	1.1	-175.7	-60.8	-57.7	0	0	0	114.7	E858 C859 I860 L921 V922 N923 N926	D856-E858 PolarHBondContact O-N 3.48Å; D856-C859 WeakPolarHBondContact O-CB 3.4Å; D856-C859 PolarHBondContact O-N 3.18Å; D856-I860 HydrophobicContact CB-CD1 3.88Å; D856-I860 HydrophobicContact CB-CG1 4.25Å; D856-I860 WeakPolarHBondContact O-CG1 3.41Å; D856-I860 PolarHBondContact O-N 3.28Å; D856-L921 HydrophobicContact CB-CD2 3.99Å; D856-L921 WeakPolarHBondContact OD1-CA 3.44Å; D856-V922 PolarHBondContact OD1-N 3.01Å; D856-V922 PolarHBondContact OD2-N 3.06Å; D856-N923 PolarHBondContact OD2-N 3.15Å; D856-N923 VanDerWaalsContact OD2-N 3.09Å; D856-N926 HydrophobicContact CB-CB 4.3Å; D856-N926 PolarHBondContact OD2-ND2 3.31Å
857	K	90.8	Very high	83.7	Confident	87 Å²	87	51.9 Å²	51.9	38%	0.378	27%	0.272	S	S	.	.	H	α-helix	trans	-50	-38.2	-171.4	73.4	-169.2	176	-166.8	0	113.8	I849 L854 Q855 L861	I849-K857 HydrophobicContact CD1-CD 4.44Å; L854-K857 WeakPolarHBondContact O-CD 3.48Å; L854-K857 WeakPolarHBondContact O-CG 3.34Å; Q855-K857 VanDerWaalsContact C-N 3.34Å; Q855-K857 PolarHBondContact O-N 3.45Å; K857-L861 VanDerWaalsContact O-CB 3.25Å; K857-L861 WeakPolarHBondContact O-CB 3.47Å; K857-L861 WeakPolarHBondContact O-CD1 3.45Å; K857-L861 WeakPolarHBondContact O-CG 3.45Å; K857-L861 PolarHBondContact O-N 2.73Å
858	E	91.3	Very high	85.2	Confident	52 Å²	52	53.4 Å²	53.4	24%	0.243	29%	0.285	C	S	.	.	H	α-helix	trans	-76.6	-37.2	-175.8	-56.8	-173.6	168.4	0	0	111.2	F763 D856 A862	F763-E858 HydrophobicContact CD1-CB 3.85Å; F763-E858 WeakPolarHBondContact CD1-OE2 3.34Å; F763-E858 HydrophobicContact CD2-CB 4.08Å; F763-E858 HydrophobicContact CE1-CB 4.02Å; F763-E858 HydrophobicContact CE2-CB 4.22Å; F763-E858 WeakPolarHBondContact CE2-O 3.35Å; F763-E858 HydrophobicContact CG-CB 3.88Å; F763-E858 HydrophobicContact CZ-CB 4.19Å; D856-E858 PolarHBondContact O-N 3.48Å; E858-A862 VanDerWaalsContact O-CB 3.28Å; E858-A862 WeakPolarHBondContact O-CB 3.17Å; E858-A862 PolarHBondContact O-N 3.4Å
859	C	93.4	Very high	86.9	Confident	1 Å²	1	48.2 Å²	48.2	1%	0.007	26%	0.257	C	S	.	.	H	α-helix	trans	-67.4	-44	175	-71.4	0	0	0	0	112.1	I841 D856 A862 S863 T919	I841-C859 HydrophobicContact CG2-CB 4.12Å; D856-C859 WeakPolarHBondContact O-CB 3.4Å; D856-C859 PolarHBondContact O-N 3.18Å; C859-A862 PolarHBondContact O-N 2.94Å; C859-S863 WeakPolarHBondContact O-CB 3.4Å; C859-S863 PolarHBondContact O-N 3.22Å; C859-S863 PolarHBondContact O-OG 3.26Å; C859-T919 HydrophobicContact CB-CG2 3.71Å
860	I	94.3	Very high	88.2	Confident	18 Å²	18	51.9 Å²	51.9	9%	0.092	27%	0.274	C	S	.	.	H	α-helix	trans	-65.5	-49.7	176.2	-60.7	161.7	0	0	0	110.2	D856 A862 S863 L864 N926 F929 L930	D856-I860 HydrophobicContact CB-CD1 3.88Å; D856-I860 HydrophobicContact CB-CG1 4.25Å; D856-I860 WeakPolarHBondContact O-CG1 3.41Å; D856-I860 PolarHBondContact O-N 3.28Å; I860-A862 VanDerWaalsContact C-N 3.3Å; I860-A862 PolarHBondContact O-N 2.76Å; I860-S863 WeakPolarHBondContact O-CB 3.36Å; I860-S863 PolarHBondContact O-N 3.33Å; I860-S863 VanDerWaalsContact O-N 3.11Å; I860-L864 HydrophobicContact CG2-CD1 3.95Å; I860-L864 HydrophobicContact CG2-CG 4.41Å; I860-L864 WeakPolarHBondContact O-CG 3.24Å; I860-L864 PolarHBondContact O-N 3.01Å; I860-N926 HydrophobicContact CD1-CB 4.16Å; I860-F929 HydrophobicContact CD1-CB 4.31Å; I860-F929 HydrophobicContact CD1-CD2 4.16Å; I860-F929 HydrophobicContact CG2-CB 3.87Å; I860-L930 HydrophobicContact CG1-CD2 4.27Å
861	L	94.6	Very high	89.3	Confident	102 Å²	102	42.3 Å²	42.3	53%	0.534	23%	0.229	S	C	.	.	H	α-helix	trans	-60.1	-38.3	178.1	-74.9	170.8	0	0	0	112.2	L823 K857 N865	L823-L861 HydrophobicContact CD2-CB 4.24Å; K857-L861 VanDerWaalsContact O-CB 3.25Å; K857-L861 WeakPolarHBondContact O-CB 3.47Å; K857-L861 WeakPolarHBondContact O-CD1 3.45Å; K857-L861 WeakPolarHBondContact O-CG 3.45Å; K857-L861 PolarHBondContact O-N 2.73Å; L861-N865 WeakPolarHBondContact O-CB 3.43Å; L861-N865 PolarHBondContact O-N 2.85Å
862	A	95.2	Very high	89.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-64.3	-44.6	173.3	0	0	0	0	0	112.5	F763 L823 I841 E858 C859 I860 N865 I866	F763-A862 HydrophobicContact CE2-CB 3.79Å; F763-A862 HydrophobicContact CZ-CB 3.87Å; L823-A862 HydrophobicContact CD2-CB 4.21Å; I841-A862 HydrophobicContact CD1-CB 4.02Å; I841-A862 HydrophobicContact CG2-CB 4.13Å; E858-A862 VanDerWaalsContact O-CB 3.28Å; E858-A862 WeakPolarHBondContact O-CB 3.17Å; E858-A862 PolarHBondContact O-N 3.4Å; C859-A862 PolarHBondContact O-N 2.94Å; I860-A862 VanDerWaalsContact C-N 3.3Å; I860-A862 PolarHBondContact O-N 2.76Å; A862-N865 WeakPolarHBondContact O-CB 3.44Å; A862-N865 PolarHBondContact O-N 3.21Å; A862-I866 WeakPolarHBondContact O-CD1 3.25Å; A862-I866 WeakPolarHBondContact O-CG1 3.35Å; A862-I866 PolarHBondContact O-N 3.31Å
863	S	94.9	Very high	89	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.007	23%	0.231	C	C	.	.	H	α-helix	trans	-58.3	-51.6	178.3	-56	0	0	0	0	111.4	C859 I860 N865 I866 K867 T919	C859-S863 WeakPolarHBondContact O-CB 3.4Å; C859-S863 PolarHBondContact O-N 3.22Å; C859-S863 PolarHBondContact O-OG 3.26Å; I860-S863 WeakPolarHBondContact O-CB 3.36Å; I860-S863 PolarHBondContact O-N 3.33Å; I860-S863 VanDerWaalsContact O-N 3.11Å; S863-N865 VanDerWaalsContact C-N 3.34Å; S863-N865 PolarHBondContact O-N 3.39Å; S863-I866 PolarHBondContact O-N 3.12Å; S863-K867 WeakPolarHBondContact O-CG 3.1Å; S863-K867 PolarHBondContact O-N 3.49Å; S863-T919 PolarHBondContact OG-OG1 3.18Å
864	L	94.1	Very high	87.7	Confident	47 Å²	47	45 Å²	45	25%	0.246	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-34.1	177.7	-63.6	175.7	0	0	0	112.3	I860 S868	I860-L864 HydrophobicContact CG2-CD1 3.95Å; I860-L864 HydrophobicContact CG2-CG 4.41Å; I860-L864 WeakPolarHBondContact O-CG 3.24Å; I860-L864 PolarHBondContact O-N 3.01Å; L864-S868 WeakPolarHBondContact O-CB 3.43Å; L864-S868 PolarHBondContact O-N 3.37Å; L864-S868 PolarHBondContact O-OG 3.32Å
865	N	95.1	Very high	86	Confident	25 Å²	25	46 Å²	46	13%	0.134	24%	0.242	C	C	.	.	H	α-helix	trans	-62.8	-42.2	175.3	-174.9	43.3	0	0	0	111.7	L823 R825 L861 A862 S863 S868 M869	L823-N865 PolarHBondContact O-ND2 3.26Å; R825-N865 VanDerWaalsContact CZ-OD1 3.26Å; R825-N865 PolarHBondContact NE-OD1 3.47Å; R825-N865 PolarHBondContact NH2-O 3.1Å; R825-N865 PolarHBondContact NH2-OD1 2.92Å; L861-N865 WeakPolarHBondContact O-CB 3.43Å; L861-N865 PolarHBondContact O-N 2.85Å; A862-N865 WeakPolarHBondContact O-CB 3.44Å; A862-N865 PolarHBondContact O-N 3.21Å; S863-N865 VanDerWaalsContact C-N 3.34Å; S863-N865 PolarHBondContact O-N 3.39Å; N865-S868 PolarHBondContact O-OG 3.33Å; N865-M869 WeakPolarHBondContact O-CG 3.46Å
866	I	93.9	Very high	84.3	Confident	2 Å²	2	47 Å²	47	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-70.2	-49.1	177	-63.2	157.2	0	0	0	110.8	L828 I833 I841 A862 S863 S868 M869 I915 I917	L828-I866 HydrophobicContact CD1-CG1 3.75Å; I833-I866 HydrophobicContact CD1-CD1 3.94Å; I833-I866 HydrophobicContact CD1-CG1 3.99Å; I833-I866 HydrophobicContact CD1-CG2 4.05Å; I841-I866 HydrophobicContact CD1-CD1 3.87Å; A862-I866 WeakPolarHBondContact O-CD1 3.25Å; A862-I866 WeakPolarHBondContact O-CG1 3.35Å; A862-I866 PolarHBondContact O-N 3.31Å; S863-I866 PolarHBondContact O-N 3.12Å; I866-S868 PolarHBondContact O-N 2.94Å; I866-S868 VanDerWaalsContact O-N 3.15Å; I866-M869 WeakPolarHBondContact O-CB 3.48Å; I866-M869 PolarHBondContact O-N 3.04Å; I866-I915 HydrophobicContact CG2-CB 4.24Å; I866-I915 HydrophobicContact CG2-CD1 3.77Å; I866-I915 HydrophobicContact CG2-CG2 4.1Å; I866-I917 HydrophobicContact CB-CD1 3.86Å; I866-I917 HydrophobicContact CD1-CD1 4.36Å; I866-I917 HydrophobicContact CG2-CD1 3.69Å; I866-I917 HydrophobicContact CG2-CG1 4.28Å
867	K	91.6	Very high	82	Confident	47 Å²	47	51.4 Å²	51.4	20%	0.204	29%	0.287	C	S	.	.	H	α-helix	trans	-55.7	-33.5	178.4	-73.2	-178.8	179.1	179.4	0	112.4	S863 G912 S913 I917 L930 D931	S863-K867 WeakPolarHBondContact O-CG 3.1Å; S863-K867 PolarHBondContact O-N 3.49Å; K867-G912 CarbonylContact O-C 3.51Å; K867-S913 PolarHBondContact O-N 2.9Å; K867-S913 VanDerWaalsContact O-N 3.13Å; K867-I917 HydrophobicContact CG-CD1 4Å; K867-L930 PolarHBondContact NZ-O 2.95Å; K867-D931 IonicContact NZ-OD1 2.65Å; K867-D931 PolarHBondContact NZ-OD1 3.22Å
868	S	91.6	Very high	79.5	Confident	67 Å²	67	53.7 Å²	53.7	47%	0.469	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.8	16.1	176.9	63.1	0	0	0	0	115.5	R825 L864 N865 I866	R825-S868 PolarHBondContact NH1-O 3.37Å; R825-S868 PolarHBondContact NH2-OG 3.24Å; L864-S868 WeakPolarHBondContact O-CB 3.43Å; L864-S868 PolarHBondContact O-N 3.37Å; L864-S868 PolarHBondContact O-OG 3.32Å; N865-S868 PolarHBondContact O-OG 3.33Å; I866-S868 PolarHBondContact O-N 2.94Å; I866-S868 VanDerWaalsContact O-N 3.15Å
869	M	92.1	Very high	77.2	Confident	1 Å²	1	56 Å²	56	1%	0.005	31%	0.313	C	S	.	.			trans	-81	158.5	168	-69.4	178.2	70.8	0	0	111.7	R825 L828 R829 I833 N865 I866 F871 G912	R825-M869 HydrophobicContact CB-CE 4.33Å; R825-M869 HydrophobicContact CG-CG 4.4Å; R825-M869 HydrophobicContact CG-SD 4.38Å; L828-M869 HydrophobicContact CB-CE 4.11Å; L828-M869 HydrophobicContact CB-SD 4.13Å; L828-M869 HydrophobicContact CD1-SD 3.85Å; R829-M869 HydrophobicContact CG-CE 3.57Å; I833-M869 HydrophobicContact CG2-CE 4.38Å; I833-M869 HydrophobicContact CG2-SD 4.44Å; N865-M869 WeakPolarHBondContact O-CG 3.46Å; I866-M869 WeakPolarHBondContact O-CB 3.48Å; I866-M869 PolarHBondContact O-N 3.04Å; M869-F871 HydrophobicContact CB-CD2 4.48Å; M869-F871 HydrophobicContact CB-CE2 3.55Å; M869-F871 HydrophobicContact CB-CZ 3.73Å; M869-F871 HydrophobicContact CE-CE1 3.93Å; M869-F871 HydrophobicContact CE-CZ 3.63Å; M869-F871 HydrophobicContact SD-CZ 4.16Å; M869-G912 PolarHBondContact O-N 2.98Å
870	Q	89.7	Confident	74.5	Confident	120 Å²	120	59.7 Å²	59.7	56%	0.561	34%	0.344	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.2	139.4	176.4	-76.7	179.2	-7.9	0	0	108.9	R829 V909	R829-Q870 VanDerWaalsContact CZ-O 3.24Å; R829-Q870 PolarHBondContact NH1-O 3.48Å; R829-Q870 PolarHBondContact NH2-O 3.15Å; Q870-V909 HydrophobicContact CB-CG1 3.66Å; Q870-V909 HydrophobicContact CG-CG1 3.91Å
871	F	86.4	Confident	71.6	Confident	10 Å²	10	65.1 Å²	65.1	4%	0.044	37%	0.373	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	143	-174.5	-58.2	-94.5	0	0	0	111.1	R829 I833 N834 M869 T910 I915	R829-F871 HydrophobicContact CG-CE1 4.42Å; I833-F871 HydrophobicContact CG2-CE1 4.08Å; I833-F871 HydrophobicContact CG2-CZ 3.73Å; N834-F871 HydrophobicContact CB-CD1 3.69Å; N834-F871 HydrophobicContact CB-CD2 3.92Å; N834-F871 HydrophobicContact CB-CE1 3.77Å; N834-F871 HydrophobicContact CB-CE2 4.01Å; N834-F871 HydrophobicContact CB-CG 3.78Å; N834-F871 HydrophobicContact CB-CZ 3.94Å; N834-F871 VanDerWaalsContact CG-CD1 3.49Å; M869-F871 HydrophobicContact CB-CD2 4.48Å; M869-F871 HydrophobicContact CB-CE2 3.55Å; M869-F871 HydrophobicContact CB-CZ 3.73Å; M869-F871 HydrophobicContact CE-CE1 3.93Å; M869-F871 HydrophobicContact CE-CZ 3.63Å; M869-F871 HydrophobicContact SD-CZ 4.16Å; F871-T910 PolarHBondContact N-O 3.22Å; F871-T910 PolarHBondContact O-N 2.96Å; F871-T910 PolarHBondContact O-OG1 2.95Å; F871-I915 HydrophobicContact CE2-CD1 3.81Å; F871-I915 HydrophobicContact CZ-CD1 4.02Å
872	D	79.4	Confident	68.9	Low	98 Å²	98	64.6 Å²	64.6	52%	0.524	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	110	179	-61.3	-58.2	0	0	0	109.5	S874 I875	D872-S874 PolarHBondContact O-N 2.89Å; D872-I875 PolarHBondContact O-N 3.2Å
873	D	61.9	Low	66.2	Low	72 Å²	72	73.1 Å²	73.1	39%	0.385	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-12.6	-178.5	-61.4	-12.1	0	0	0	113.6	I875 S908 T910	D873-I875 VanDerWaalsContact C-N 3.27Å; D873-I875 PolarHBondContact O-N 3.49Å; D873-S908 PolarHBondContact OD2-OG 2.8Å; D873-T910 VanDerWaalsContact OD1-CG2 3.28Å; D873-T910 WeakPolarHBondContact OD1-CG2 3.32Å; D873-T910 PolarHBondContact OD1-OG1 2.86Å
874	S	52.5	Low	63.1	Low	73 Å²	73	76.6 Å²	76.6	51%	0.51	45%	0.453	S	S	.	.	H	α-helix	trans	-60.7	-29.2	179.3	63.3	0	0	0	0	114.1	D872 L878	D872-S874 PolarHBondContact O-N 2.89Å; S874-L878 WeakPolarHBondContact O-CD1 3.49Å; S874-L878 WeakPolarHBondContact O-CG 3.25Å
875	I	50.7	Low	60	Low	113 Å²	113	83.5 Å²	83.5	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-72.2	-44.5	-176.7	-66.6	176.1	0	0	0	111.3	D872 D873 V877 L878 Q879	D872-I875 PolarHBondContact O-N 3.2Å; D873-I875 VanDerWaalsContact C-N 3.27Å; D873-I875 PolarHBondContact O-N 3.49Å; I875-V877 PolarHBondContact O-N 3.16Å; I875-L878 PolarHBondContact O-N 3.42Å; I875-Q879 PolarHBondContact O-N 3.22Å
876	G	47.3	Very low	56.9	Low	51 Å²	51	88.2 Å²	88.2	53%	0.526	51%	0.512	S	S	.	.	H	α-helix	trans	-64.3	-39.3	-176.6	0	0	0	0	0	113.5	A880	G876-A880 PolarHBondContact O-N 3.36Å
877	V	41.6	Very low	53.9	Low	93 Å²	93	93.6 Å²	93.6	56%	0.564	55%	0.547	S	S	*	.	H	α-helix	trans	-73	-31.1	-178.5	-177.6	0	0	0	0	112.3	I875 N881	I875-V877 PolarHBondContact O-N 3.16Å; V877-N881 PolarHBondContact O-ND2 2.85Å
878	L	37.7	Very low	50.9	Low	134 Å²	134	97.5 Å²	97.5	70%	0.702	58%	0.577	S	S	*	*	H	α-helix	trans	-76.1	-34.5	179.6	-71.5	173.9	0	0	0	112.6	S874 I875	S874-L878 WeakPolarHBondContact O-CD1 3.49Å; S874-L878 WeakPolarHBondContact O-CG 3.25Å; I875-L878 PolarHBondContact O-N 3.42Å
879	Q	44.1	Very low	48.5	Very low	101 Å²	101	97.9 Å²	97.9	47%	0.472	59%	0.592	S	S	.	*	H	α-helix	trans	-73.4	-38.3	178.7	-128.7	173.3	2.8	0	0	112.3	I875 N881 S882	I875-Q879 PolarHBondContact O-N 3.22Å; Q879-N881 VanDerWaalsContact C-N 3.27Å; Q879-N881 PolarHBondContact O-N 3.46Å; Q879-S882 WeakPolarHBondContact O-CB 3.21Å; Q879-S882 PolarHBondContact O-N 3.26Å; Q879-S882 PolarHBondContact O-OG 3.48Å
880	A	36.5	Very low	45.6	Very low	79 Å²	79	107 Å²	107	65%	0.653	64%	0.636	S	S	*	*	H	α-helix	trans	-61.5	-30.4	178.9	0	0	0	0	0	113.9	G876 S882	G876-A880 PolarHBondContact O-N 3.36Å; A880-S882 PolarHBondContact O-N 3.08Å
881	N	33.6	Very low	42.6	Very low	132 Å²	132	109 Å²	109	71%	0.706	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.4	5.6	179.7	-77.2	-56.5	0	0	0	114.4	V877 Q879	V877-N881 PolarHBondContact O-ND2 2.85Å; Q879-N881 VanDerWaalsContact C-N 3.27Å; Q879-N881 PolarHBondContact O-N 3.46Å
882	S	37.6	Very low	40.1	Very low	90 Å²	90	120.8 Å²	120.8	63%	0.629	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	-6.3	-175.4	66.6	0	0	0	0	115.5	Q879 A880	Q879-S882 WeakPolarHBondContact O-CB 3.21Å; Q879-S882 PolarHBondContact O-N 3.26Å; Q879-S882 PolarHBondContact O-OG 3.48Å; A880-S882 PolarHBondContact O-N 3.08Å
883	Q	37.1	Very low	37.7	Very low	180 Å²	180	121.4 Å²	121.4	84%	0.841	71%	0.707	S	S	*	*	S	Bend	trans	-138.8	104.3	174.5	-62.3	-171.6	15.5	0	0	111.3
884	G	31.4	Very low	36.1	Very low	73 Å²	73	123.1 Å²	123.1	75%	0.753	72%	0.724	S	S	*	*			trans	161.6	69	177.3	0	0	0	0	0	116.9	T886	G884-T886 PolarHBondContact O-N 2.86Å
885	F	29.1	Very low	35.4	Very low	193 Å²	193	125 Å²	125	85%	0.846	74%	0.735	S	S	*	*			trans	-13	109.8	161.6	-157.1	-88.2	0	0	0	116.7	P887	F885-P887 WeakPolarHBondContact O-CD 3.47Å
886	T	30.1	Very low	34.4	Very low	124 Å²	124	126.8 Å²	126.8	76%	0.761	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-80.2	123.6	172.3	41.7	0	0	0	0	111.7	G884	G884-T886 PolarHBondContact O-N 2.86Å
887	P	30.1	Very low	33.5	Very low	115 Å²	115	130.3 Å²	130.3	75%	0.747	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-72.7	131.8	172	-15.8	31.2	0	0	0	111	F885	F885-P887 WeakPolarHBondContact O-CD 3.47Å
888	P	29.1	Very low	32.8	Very low	128 Å²	128	130.9 Å²	130.9	83%	0.831	77%	0.77	S	S	*	*	S	Bend	trans	-80.2	125.9	175.7	30.9	-32.7	0	0	0	111.6
889	G	39.7	Very low	32.6	Very low	76 Å²	76	131 Å²	131	78%	0.784	78%	0.779	S	S	*	*			trans	120.7	72.1	165.3	0	0	0	0	0	116
890	M	31.9	Very low	32.1	Very low	192 Å²	192	131.9 Å²	131.9	95%	0.946	79%	0.791	S	S	*	*			trans	-153	113.3	155.1	-137.4	167.5	-171.5	0	0	110.5
891	D	27.6	Very low	31.8	Very low	162 Å²	162	137.7 Å²	137.7	87%	0.866	81%	0.805	S	S	*	*			trans	-80.1	150.8	-173.6	-71.2	-61.3	0	0	0	113.3	S893	D891-S893 PolarHBondContact O-N 2.87Å
892	R	33.8	Very low	31.5	Very low	258 Å²	258	134.8 Å²	134.8	97%	0.974	81%	0.806	S	S	*	*			trans	-82.9	109.7	-178.8	-77.9	-178.5	168.3	-177	-4.2	112.8
893	S	28.5	Very low	31.1	Very low	111 Å²	111	140.1 Å²	140.1	78%	0.776	82%	0.818	S	S	*	*			trans	-152.6	139.5	151	55	0	0	0	0	107.3	D891	D891-S893 PolarHBondContact O-N 2.87Å
894	S	28.8	Very low	30.6	Very low	107 Å²	107	138 Å²	138	75%	0.748	82%	0.817	S	S	*	*			cis	-140.3	166.2	15.4	-59.6	0	0	0	0	111.1
895	P	37.1	Very low	30.7	Very low	112 Å²	112	146.2 Å²	146.2	73%	0.727	83%	0.825	S	S	*	*			trans	-75.1	179.1	165.5	34.2	-36.3	0	0	0	112.5
896	D	30.2	Very low	30.6	Very low	152 Å²	152	145.2 Å²	145.2	81%	0.813	82%	0.823	S	S	*	*			trans	71.2	75.7	165.6	-54.2	-23.4	0	0	0	118.7
897	S	28.2	Very low	30.6	Very low	125 Å²	125	144.1 Å²	144.1	87%	0.874	83%	0.827	S	S	*	*			trans	-179.4	73.7	130.9	43.1	0	0	0	0	114.3
898	S	27.3	Very low	31	Very low	104 Å²	104	142.3 Å²	142.3	73%	0.727	82%	0.817	S	S	*	*			trans	-154.9	127.8	163.6	54.3	0	0	0	0	112.6	V900	S898-V900 VanDerWaalsContact C-N 3.33Å; S898-V900 PolarHBondContact O-N 2.75Å
899	P	33	Very low	32	Very low	137 Å²	137	139.7 Å²	139.7	89%	0.89	80%	0.798	S	S	*	*			trans	-88.4	59.2	-172.1	36.5	-37.2	0	0	0	112.8
900	V	34.3	Very low	33.2	Very low	120 Å²	120	138.5 Å²	138.5	73%	0.727	78%	0.776	S	S	*	*			trans	-136.7	67.2	177.1	-166.9	0	0	0	0	111.9	S898	S898-V900 VanDerWaalsContact C-N 3.33Å; S898-V900 PolarHBondContact O-N 2.75Å
901	H	29.6	Very low	35.3	Very low	201 Å²	201	132.6 Å²	132.6	93%	0.931	75%	0.75	S	S	*	*			trans	-151.9	111.4	157.2	-105.1	25.5	0	0	0	110.5
902	G	27.8	Very low	37.8	Very low	71 Å²	71	124.9 Å²	124.9	73%	0.732	71%	0.709	S	S	*	*			trans	-150.9	7.2	-177.2	0	0	0	0	0	114.8
903	F	27.9	Very low	40.2	Very low	202 Å²	202	115.5 Å²	115.5	89%	0.886	68%	0.683	S	S	*	*			trans	-134.8	125.3	172.4	-93.2	-82.4	0	0	0	110.6	R905	F903-R905 PolarHBondContact O-N 2.77Å
904	V	26.6	Very low	42.9	Very low	134 Å²	134	114.4 Å²	114.4	81%	0.812	67%	0.669	S	S	*	*			trans	-70.9	115.1	170.8	175.7	0	0	0	0	107.8	Q906	V904-Q906 VanDerWaalsContact C-N 3.3Å; V904-Q906 PolarHBondContact O-N 3.42Å
905	R	33.5	Very low	45.9	Very low	247 Å²	247	110.1 Å²	110.1	93%	0.932	64%	0.637	S	S	*	*			trans	-69.9	85.6	174.3	-77	-174.2	172.3	-177.4	-3.6	110.9	F903	F903-R905 PolarHBondContact O-N 2.77Å
906	Q	26.9	Very low	48.6	Very low	172 Å²	172	106.1 Å²	106.1	80%	0.804	61%	0.611	S	S	*	*			trans	-60.6	151.6	146.6	-69.2	176.4	-42.1	0	0	108.5	V904 S908	V904-Q906 VanDerWaalsContact C-N 3.3Å; V904-Q906 PolarHBondContact O-N 3.42Å; Q906-S908 PolarHBondContact O-N 2.85Å; Q906-S908 VanDerWaalsContact O-N 3.08Å
907	A	30.2	Very low	51.7	Low	101 Å²	101	99.1 Å²	99.1	84%	0.835	57%	0.574	S	S	*	*			trans	-71.1	104	173.4	0	0	0	0	0	108.9	V909	A907-V909 PolarHBondContact O-N 3.34Å
908	S	39	Very low	54.9	Low	77 Å²	77	93.2 Å²	93.2	54%	0.538	53%	0.532	S	S	.	.			trans	-70.3	112.8	174.9	43.3	0	0	0	0	110	D873 Q906 T910	D873-S908 PolarHBondContact OD2-OG 2.8Å; Q906-S908 PolarHBondContact O-N 2.85Å; Q906-S908 VanDerWaalsContact O-N 3.08Å; S908-T910 PolarHBondContact O-N 2.63Å
909	V	49.4	Very low	58.2	Low	72 Å²	72	88.3 Å²	88.3	44%	0.436	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	116.1	163.1	175.9	0	0	0	0	106.9	Q870 A907	Q870-V909 HydrophobicContact CB-CG1 3.66Å; Q870-V909 HydrophobicContact CG-CG1 3.91Å; A907-V909 PolarHBondContact O-N 3.34Å
910	T	66.7	Low	61.1	Low	52 Å²	52	81.9 Å²	81.9	32%	0.319	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	127.7	179	41.5	0	0	0	0	109.8	F871 D873 S908	F871-T910 PolarHBondContact N-O 3.22Å; F871-T910 PolarHBondContact O-N 2.96Å; F871-T910 PolarHBondContact O-OG1 2.95Å; D873-T910 VanDerWaalsContact OD1-CG2 3.28Å; D873-T910 WeakPolarHBondContact OD1-CG2 3.32Å; D873-T910 PolarHBondContact OD1-OG1 2.86Å; S908-T910 PolarHBondContact O-N 2.63Å
911	T	76	Confident	63.8	Low	67 Å²	67	76.2 Å²	76.2	41%	0.411	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	142.3	-175.8	48.6	0	0	0	0	111.9	S913 N914	T911-S913 WeakPolarHBondContact CB-OG 3.43Å; T911-S913 PolarHBondContact O-N 3.15Å; T911-S913 VanDerWaalsContact O-N 3.15Å; T911-S913 PolarHBondContact OG1-OG 3.48Å; T911-N914 PolarHBondContact O-N 2.82Å
912	G	79.6	Confident	66.4	Low	0 Å²	0	66.9 Å²	66.9	0%	0	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-66	-10.8	177.2	0	0	0	0	0	114.6	K867 M869 N914 I915	K867-G912 CarbonylContact O-C 3.51Å; M869-G912 PolarHBondContact O-N 2.98Å; G912-N914 PolarHBondContact O-N 3.15Å; G912-N914 VanDerWaalsContact O-N 3.15Å; G912-I915 WeakPolarHBondContact O-CB 3.46Å; G912-I915 WeakPolarHBondContact O-CG1 3.46Å; G912-I915 PolarHBondContact O-N 3.13Å; G912-I915 VanDerWaalsContact O-N 3.15Å
913	S	83.1	Confident	69.1	Low	61 Å²	61	65.5 Å²	65.5	43%	0.427	36%	0.355	S	S	.	.	G	3₁₀ helix	trans	-52.7	-29.2	173.3	55.1	0	0	0	0	114	K867 T911	K867-S913 PolarHBondContact O-N 2.9Å; K867-S913 VanDerWaalsContact O-N 3.13Å; T911-S913 WeakPolarHBondContact CB-OG 3.43Å; T911-S913 PolarHBondContact O-N 3.15Å; T911-S913 VanDerWaalsContact O-N 3.15Å; T911-S913 PolarHBondContact OG1-OG 3.48Å
914	N	85.9	Confident	72	Confident	88 Å²	88	58.3 Å²	58.3	47%	0.471	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-95.6	2.5	-173.5	-57.2	8.6	0	0	0	112.4	T911 G912	T911-N914 PolarHBondContact O-N 2.82Å; G912-N914 PolarHBondContact O-N 3.15Å; G912-N914 VanDerWaalsContact O-N 3.15Å
915	I	91.7	Very high	74.8	Confident	17 Å²	17	55 Å²	55	9%	0.087	31%	0.308	C	S	.	.	S	Bend	trans	-73.1	128.5	176.4	-64.7	173.3	0	0	0	108.6	I833 I866 F871 G912 I917	I833-I915 HydrophobicContact CG1-CD1 4.47Å; I833-I915 HydrophobicContact CG1-CG2 4.25Å; I833-I915 HydrophobicContact CG2-CD1 4.21Å; I866-I915 HydrophobicContact CG2-CB 4.24Å; I866-I915 HydrophobicContact CG2-CD1 3.77Å; I866-I915 HydrophobicContact CG2-CG2 4.1Å; F871-I915 HydrophobicContact CE2-CD1 3.81Å; F871-I915 HydrophobicContact CZ-CD1 4.02Å; G912-I915 WeakPolarHBondContact O-CB 3.46Å; G912-I915 WeakPolarHBondContact O-CG1 3.46Å; G912-I915 PolarHBondContact O-N 3.13Å; G912-I915 VanDerWaalsContact O-N 3.15Å; I915-I917 HydrophobicContact CG2-CG1 4.15Å; I915-I917 PolarHBondContact O-N 2.73Å
916	P	93.3	Very high	77.5	Confident	29 Å²	29	43.4 Å²	43.4	19%	0.188	27%	0.265	C	S	.	.			trans	-68.4	116.6	173.9	27.8	-33.1	0	0	0	109.6	D837 M838 C839	D837-P916 WeakPolarHBondContact O-CG 3.39Å; M838-P916 HydrophobicContact CE-CB 3.85Å; M838-P916 HydrophobicContact SD-CB 4.02Å; C839-P916 PolarHBondContact N-O 2.83Å
917	I	95.1	Very high	80.6	Confident	5 Å²	5	35.5 Å²	35.5	3%	0.026	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	136.7	177.9	-55.6	166.2	0	0	0	108.1	C839 I841 I866 K867 I915 T952	C839-I917 HydrophobicContact CB-CG1 4.25Å; C839-I917 CarbonylContact O-C 3.37Å; C839-I917 VanDerWaalsContact O-CA 3.32Å; C839-I917 WeakPolarHBondContact O-CA 3.41Å; I841-I917 HydrophobicContact CD1-CG2 3.61Å; I841-I917 HydrophobicContact CG1-CG2 4.1Å; I866-I917 HydrophobicContact CB-CD1 3.86Å; I866-I917 HydrophobicContact CD1-CD1 4.36Å; I866-I917 HydrophobicContact CG2-CD1 3.69Å; I866-I917 HydrophobicContact CG2-CG1 4.28Å; K867-I917 HydrophobicContact CG-CD1 4Å; I915-I917 HydrophobicContact CG2-CG1 4.15Å; I915-I917 PolarHBondContact O-N 2.73Å; I917-T952 WeakPolarHBondContact O-CA 3.2Å; I917-T952 WeakPolarHBondContact O-CB 3.38Å
918	I	96.7	Very high	83.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	121.3	163.9	-171.6	169	0	0	0	109.7	I532 M838 C839 V840 I841 T952 F954	I532-I918 HydrophobicContact CG1-CD1 4.15Å; I532-I918 HydrophobicContact CG2-CG2 3.99Å; M838-I918 HydrophobicContact CG-CG2 3.79Å; M838-I918 HydrophobicContact SD-CB 4.05Å; M838-I918 HydrophobicContact SD-CG2 3.77Å; C839-I918 PolarHBondContact O-N 3.48Å; V840-I918 WeakPolarHBondContact CA-O 3.47Å; V840-I918 HydrophobicContact CB-CG2 4.36Å; V840-I918 HydrophobicContact CG1-CG2 4.45Å; V840-I918 HydrophobicContact CG2-CG2 3.89Å; I841-I918 PolarHBondContact N-O 3Å; I918-T952 WeakPolarHBondContact CA-O 3.21Å; I918-F954 HydrophobicContact CD1-CB 4.47Å
919	T	95.7	Very high	85.9	Confident	2 Å²	2	33.8 Å²	33.8	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	125.9	-173.7	-60.7	0	0	0	0	110.2	I841 C859 S863 L921 L930 T952 F954	I841-T919 HydrophobicContact CB-CG2 4.31Å; I841-T919 HydrophobicContact CG2-CG2 4.47Å; C859-T919 HydrophobicContact CB-CG2 3.71Å; S863-T919 PolarHBondContact OG-OG1 3.18Å; T919-L921 HydrophobicContact CG2-CD2 4.39Å; T919-L930 HydrophobicContact CG2-CD2 4.19Å; T919-T952 PolarHBondContact N-O 3.44Å; T919-F954 PolarHBondContact O-N 2.79Å
920	E	93.7	Very high	87.8	Confident	2 Å²	2	30.5 Å²	30.5	1%	0.009	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	135.5	168.8	-173	-177	152.3	0	0	110.2	K528 I841 L842 Q846 F954	K528-E920 HydrophobicContact CD-CG 4.25Å; K528-E920 WeakPolarHBondContact CD-OE1 3.47Å; K528-E920 WeakPolarHBondContact CE-OE1 3.4Å; K528-E920 WeakPolarHBondContact CE-OE2 3.32Å; K528-E920 IonicContact NZ-OE1 2.68Å; K528-E920 PolarHBondContact NZ-OE1 2.98Å; K528-E920 IonicContact NZ-OE2 2.87Å; K528-E920 PolarHBondContact NZ-OE2 3.2Å; I841-E920 PolarHBondContact O-N 3.36Å; L842-E920 HydrophobicContact CD2-CB 4.07Å; Q846-E920 PolarHBondContact NE2-OE1 3.47Å; E920-F954 WeakPolarHBondContact CA-O 3.16Å
921	L	90.7	Very high	88.8	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	144.2	171.7	-62.1	175.6	0	0	0	110.9	D856 T919 V927 L930 A953 F954 A955	D856-L921 HydrophobicContact CB-CD2 3.99Å; D856-L921 WeakPolarHBondContact OD1-CA 3.44Å; T919-L921 HydrophobicContact CG2-CD2 4.39Å; L921-V927 HydrophobicContact CD1-CB 3.8Å; L921-V927 HydrophobicContact CD1-CG2 4.05Å; L921-L930 HydrophobicContact CD1-CD1 4.02Å; L921-L930 HydrophobicContact CD2-CD1 4.49Å; L921-A953 HydrophobicContact CD1-CB 4.19Å; L921-F954 PolarHBondContact N-O 2.69Å; L921-A955 HydrophobicContact CB-CB 4.35Å; L921-A955 WeakPolarHBondContact O-CA 3.15Å
922	V	84.9	Confident	89	Confident	6 Å²	6	33.5 Å²	33.5	4%	0.036	18%	0.179	C	C	.	.	S	Bend	trans	-90.1	-44.3	171.1	-172	0	0	0	0	110.5	Y467 Q846 Q855 D856	Y467-V922 HydrophobicContact CD1-CG1 3.53Å; Y467-V922 HydrophobicContact CE1-CG1 3.56Å; Q846-V922 HydrophobicContact CB-CG2 4.09Å; Q846-V922 HydrophobicContact CG-CG2 3.64Å; Q846-V922 VanDerWaalsContact NE2-CG2 3.27Å; Q855-V922 VanDerWaalsContact OE1-CG1 3.32Å; D856-V922 PolarHBondContact OD1-N 3.01Å; D856-V922 PolarHBondContact OD2-N 3.06Å
923	N	85.5	Confident	89.1	Confident	42 Å²	42	37 Å²	37	23%	0.225	20%	0.198	C	C	.	.			trans	-107.9	126.2	-177.8	179.4	2	0	0	0	111.3	A852 D856 S925 N926	A852-N923 PolarHBondContact O-ND2 3.01Å; D856-N923 PolarHBondContact OD2-N 3.15Å; D856-N923 VanDerWaalsContact OD2-N 3.09Å; N923-S925 VanDerWaalsContact C-N 3.29Å; N923-S925 PolarHBondContact ND2-OG 2.96Å; N923-S925 VanDerWaalsContact ND2-OG 3.14Å; N923-S925 PolarHBondContact O-N 2.91Å; N923-S925 PolarHBondContact OD1-N 3.26Å; N923-S925 VanDerWaalsContact OD1-N 3.1Å; N923-S925 PolarHBondContact OD1-OG 2.7Å; N923-N926 WeakPolarHBondContact O-CB 3.36Å; N923-N926 PolarHBondContact O-N 3.11Å
924	D	86.9	Confident	88.9	Confident	51 Å²	51	35.9 Å²	35.9	27%	0.273	19%	0.187	S	C	.	.	G	3₁₀ helix	trans	-59.1	-37.1	-179.2	-66.7	-14.4	0	0	0	112.7	N926 V927 L942 A955 S957	D924-N926 PolarHBondContact O-N 3.33Å; D924-N926 VanDerWaalsContact O-N 3.09Å; D924-V927 WeakPolarHBondContact O-CB 3.48Å; D924-V927 VanDerWaalsContact O-CG1 3.25Å; D924-V927 WeakPolarHBondContact O-CG1 3.28Å; D924-V927 PolarHBondContact O-N 3.47Å; D924-L942 HydrophobicContact CB-CB 4.34Å; D924-A955 VanDerWaalsContact OD1-CB 3.22Å; D924-A955 WeakPolarHBondContact OD1-CB 3.07Å; D924-S957 VanDerWaalsContact CG-OG 3.25Å; D924-S957 VanDerWaalsContact OD1-CB 3.25Å; D924-S957 WeakPolarHBondContact OD1-CB 3.43Å; D924-S957 PolarHBondContact OD1-OG 3.06Å; D924-S957 VanDerWaalsContact OD2-CB 3.26Å; D924-S957 WeakPolarHBondContact OD2-CB 3.06Å; D924-S957 PolarHBondContact OD2-OG 3.03Å
925	S	87	Confident	88.4	Confident	63 Å²	63	39.3 Å²	39.3	44%	0.441	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-67.7	-11.4	-178.2	74	0	0	0	0	113.8	N923 Q928	N923-S925 VanDerWaalsContact C-N 3.29Å; N923-S925 PolarHBondContact ND2-OG 2.96Å; N923-S925 VanDerWaalsContact ND2-OG 3.14Å; N923-S925 PolarHBondContact O-N 2.91Å; N923-S925 PolarHBondContact OD1-N 3.26Å; N923-S925 VanDerWaalsContact OD1-N 3.1Å; N923-S925 PolarHBondContact OD1-OG 2.7Å; S925-Q928 PolarHBondContact O-NE2 3.1Å
926	N	90.1	Very high	87.4	Confident	5 Å²	5	43 Å²	43	3%	0.027	23%	0.226	C	C	.	.	G	3₁₀ helix	trans	-86	-6.2	179.4	-76.3	-18.1	0	0	0	113.2	S853 D856 I860 N923 D924 Q928 F929	S853-N926 PolarHBondContact O-ND2 3.33Å; S853-N926 PolarHBondContact O-OD1 2.96Å; D856-N926 HydrophobicContact CB-CB 4.3Å; D856-N926 PolarHBondContact OD2-ND2 3.31Å; I860-N926 HydrophobicContact CD1-CB 4.16Å; N923-N926 WeakPolarHBondContact O-CB 3.36Å; N923-N926 PolarHBondContact O-N 3.11Å; D924-N926 PolarHBondContact O-N 3.33Å; D924-N926 VanDerWaalsContact O-N 3.09Å; N926-Q928 VanDerWaalsContact C-N 3.34Å; N926-Q928 PolarHBondContact O-N 2.82Å; N926-F929 HydrophobicContact CB-CD2 4.34Å; N926-F929 PolarHBondContact O-N 2.97Å
927	V	91.3	Very high	86.7	Confident	6 Å²	6	46 Å²	46	4%	0.036	24%	0.24	C	C	.	.	G	3₁₀ helix	trans	-62	-37.4	-176.4	71	0	0	0	0	113.5	L921 D924 F929 L930 L942 T945 P947 A953	L921-V927 HydrophobicContact CD1-CB 3.8Å; L921-V927 HydrophobicContact CD1-CG2 4.05Å; D924-V927 WeakPolarHBondContact O-CB 3.48Å; D924-V927 VanDerWaalsContact O-CG1 3.25Å; D924-V927 WeakPolarHBondContact O-CG1 3.28Å; D924-V927 PolarHBondContact O-N 3.47Å; V927-F929 VanDerWaalsContact C-N 3.26Å; V927-F929 PolarHBondContact O-N 3.01Å; V927-L930 WeakPolarHBondContact O-CB 3.25Å; V927-L930 PolarHBondContact O-N 2.82Å; V927-L942 HydrophobicContact CB-CD1 3.9Å; V927-L942 HydrophobicContact CG1-CD1 3.96Å; V927-L942 HydrophobicContact CG2-CD1 3.94Å; V927-T945 HydrophobicContact CG1-CG2 3.72Å; V927-P947 HydrophobicContact CG2-CB 3.92Å; V927-P947 HydrophobicContact CG2-CG 4.19Å; V927-A953 HydrophobicContact CG2-CB 3.75Å
928	Q	88.6	Confident	85.7	Confident	42 Å²	42	50.6 Å²	50.6	20%	0.196	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-52	-41.7	178.9	59.8	-168.3	-29.1	0	0	112.4	S925 N926 L930 D931	S925-Q928 PolarHBondContact O-NE2 3.1Å; N926-Q928 VanDerWaalsContact C-N 3.34Å; N926-Q928 PolarHBondContact O-N 2.82Å; Q928-L930 PolarHBondContact O-N 2.98Å; Q928-D931 PolarHBondContact O-N 3.01Å
929	F	91.1	Very high	85	Confident	99 Å²	99	57.8 Å²	57.8	43%	0.434	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-68.5	-1.4	-175.9	-52	-53.8	0	0	0	115.4	I860 N926 V927	I860-F929 HydrophobicContact CD1-CB 4.31Å; I860-F929 HydrophobicContact CD1-CD2 4.16Å; I860-F929 HydrophobicContact CG2-CB 3.87Å; N926-F929 HydrophobicContact CB-CD2 4.34Å; N926-F929 PolarHBondContact O-N 2.97Å; V927-F929 VanDerWaalsContact C-N 3.26Å; V927-F929 PolarHBondContact O-N 3.01Å
930	L	91.2	Very high	84.4	Confident	3 Å²	3	60.1 Å²	60.1	2%	0.016	32%	0.323	C	S	.	.	G	3₁₀ helix	trans	-83.3	-30.7	179.4	-66.6	177.3	0	0	0	113.5	I860 K867 T919 L921 V927 Q928 P947 A953	I860-L930 HydrophobicContact CG1-CD2 4.27Å; K867-L930 PolarHBondContact NZ-O 2.95Å; T919-L930 HydrophobicContact CG2-CD2 4.19Å; L921-L930 HydrophobicContact CD1-CD1 4.02Å; L921-L930 HydrophobicContact CD2-CD1 4.49Å; V927-L930 WeakPolarHBondContact O-CB 3.25Å; V927-L930 PolarHBondContact O-N 2.82Å; Q928-L930 PolarHBondContact O-N 2.98Å; L930-P947 HydrophobicContact CB-CB 4.24Å; L930-P947 HydrophobicContact CB-CG 4.28Å; L930-P947 HydrophobicContact CD1-CB 4.29Å; L930-A953 HydrophobicContact CD1-CB 3.68Å
931	D	86.6	Confident	84	Confident	14 Å²	14	64.2 Å²	64.2	8%	0.075	34%	0.342	C	S	.	.			trans	-116.7	170.9	176.5	-83.8	-22.6	0	0	0	110.6	K867 Q928 P947 K1069	K867-D931 IonicContact NZ-OD1 2.65Å; K867-D931 PolarHBondContact NZ-OD1 3.22Å; Q928-D931 PolarHBondContact O-N 3.01Å; D931-P947 HydrophobicContact CB-CG 4.22Å; D931-K1069 IonicContact OD1-NZ 3.77Å; D931-K1069 PolarHBondContact OD1-NZ 2.76Å; D931-K1069 WeakPolarHBondContact OD2-CE 3.41Å; D931-K1069 IonicContact OD2-NZ 2.75Å; D931-K1069 PolarHBondContact OD2-NZ 2.9Å
932	Q	80.7	Confident	83.9	Confident	169 Å²	169	65.1 Å²	65.1	79%	0.79	35%	0.347	S	S	*	.	S	Bend	trans	-134.9	17	-176.1	-62	-175.4	-20.2	0	0	111.9
933	D	81.7	Confident	84.2	Confident	73 Å²	73	65.7 Å²	65.7	39%	0.39	35%	0.348	S	S	.	.	S	Bend	trans	-150	36.1	-169.4	64.8	-63.4	0	0	0	109.4	Q946 R1057 K1069	D933-Q946 PolarHBondContact O-NE2 3.42Å; D933-Q946 VanDerWaalsContact O-NE2 3.11Å; D933-R1057 PolarHBondContact O-NH1 3.41Å; D933-R1057 IonicContact OD2-CZ 2.72Å; D933-R1057 IonicContact OD2-NH1 3.73Å; D933-R1057 PolarHBondContact OD2-NH1 3.15Å; D933-R1057 IonicContact OD2-NH2 2.86Å; D933-K1069 IonicContact OD1-NZ 2.61Å; D933-K1069 PolarHBondContact OD1-NZ 2.81Å; D933-K1069 IonicContact OD2-NZ 2.72Å; D933-K1069 PolarHBondContact OD2-NZ 3.3Å
934	D	78.6	Confident	84.4	Confident	38 Å²	38	65.5 Å²	65.5	20%	0.203	35%	0.347	C	S	.	.	S	Bend	trans	-115.5	158.5	164.6	-152.8	11.5	0	0	0	107.2	D936 Q946	D934-D936 PolarHBondContact O-N 2.81Å; D934-Q946 HydrophobicContact CB-CB 4.2Å; D934-Q946 WeakPolarHBondContact OD1-CB 3.15Å; D934-Q946 WeakPolarHBondContact OD2-CB 3.48Å; D934-Q946 PolarHBondContact OD2-N 3.17Å
935	D	74.6	Confident	84.7	Confident	159 Å²	159	63.7 Å²	63.7	85%	0.85	34%	0.338	S	S	*	.			trans	-90.3	93.3	174.9	-76.7	-56.2	0	0	0	109.1	D937	D935-D937 PolarHBondContact O-N 2.91Å
936	D	71	Confident	84.9	Confident	96 Å²	96	60.8 Å²	60.8	51%	0.513	32%	0.317	S	S	.	.			trans	-64.6	95.9	-172.2	-66.5	-33.6	0	0	0	113.6	D934	D934-D936 PolarHBondContact O-N 2.81Å
937	D	78.3	Confident	85.1	Confident	91 Å²	91	60.5 Å²	60.5	49%	0.487	32%	0.316	S	S	.	.			trans	-108.7	114.9	164.6	-177.8	-13.2	0	0	0	110.5	D935 D939 T940	D935-D937 PolarHBondContact O-N 2.91Å; D937-D939 VanDerWaalsContact C-N 3.27Å; D937-D939 PolarHBondContact O-N 3.48Å; D937-D939 PolarHBondContact OD1-N 3.3Å; D937-T940 WeakPolarHBondContact O-CB 3.47Å; D937-T940 PolarHBondContact O-N 3.39Å; D937-T940 VanDerWaalsContact O-N 3.13Å; D937-T940 PolarHBondContact O-OG1 3.22Å
938	P	75.6	Confident	85.2	Confident	101 Å²	101	60.2 Å²	60.2	66%	0.656	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	-13.8	-176	31	-37.5	0	0	0	115
939	D	80.6	Confident	85.5	Confident	152 Å²	152	58.2 Å²	58.2	81%	0.813	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.7	-3.3	173.1	-77.6	-20.2	0	0	0	112.1	D937 E941	D937-D939 VanDerWaalsContact C-N 3.27Å; D937-D939 PolarHBondContact O-N 3.48Å; D937-D939 PolarHBondContact OD1-N 3.3Å; D939-E941 PolarHBondContact O-N 3.36Å
940	T	84.3	Confident	85.6	Confident	50 Å²	50	53.7 Å²	53.7	31%	0.307	29%	0.285	S	S	.	.	S	Bend	trans	-68.8	120.5	178.5	-57.8	0	0	0	0	112.1	D937 L942 L944 T945	D937-T940 WeakPolarHBondContact O-CB 3.47Å; D937-T940 PolarHBondContact O-N 3.39Å; D937-T940 VanDerWaalsContact O-N 3.13Å; D937-T940 PolarHBondContact O-OG1 3.22Å; T940-L942 PolarHBondContact O-N 3.34Å; T940-L944 HydrophobicContact CG2-CB 3.57Å; T940-L944 HydrophobicContact CG2-CD1 4.32Å; T940-T945 HydrophobicContact CG2-CG2 3.82Å
941	E	85.4	Confident	85.7	Confident	88 Å²	88	53.5 Å²	53.5	41%	0.411	28%	0.284	S	S	.	.			trans	-63.5	135.7	173.5	-62.5	-164	132	0	0	111.3	K399 D939 Y943 L944	K399-E941 IonicContact NZ-OE1 3.65Å; K399-E941 PolarHBondContact NZ-OE1 2.95Å; D939-E941 PolarHBondContact O-N 3.36Å; E941-Y943 HydrophobicContact CB-CD1 4.02Å; E941-Y943 HydrophobicContact CB-CE1 3.76Å; E941-Y943 PolarHBondContact O-N 2.71Å; E941-Y943 WeakPolarHBondContact OE2-CE1 3.43Å; E941-L944 PolarHBondContact O-N 3.36Å
942	L	88.9	Confident	86.1	Confident	19 Å²	19	54 Å²	54	10%	0.099	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-35.5	-45	-171.9	174.1	67	0	0	0	115	D924 V927 T940 L944 T945 F948 A955 V958	D924-L942 HydrophobicContact CB-CB 4.34Å; V927-L942 HydrophobicContact CB-CD1 3.9Å; V927-L942 HydrophobicContact CG1-CD1 3.96Å; V927-L942 HydrophobicContact CG2-CD1 3.94Å; T940-L942 PolarHBondContact O-N 3.34Å; L942-L944 VanDerWaalsContact C-N 3.28Å; L942-L944 PolarHBondContact O-N 3.44Å; L942-T945 PolarHBondContact O-N 3.02Å; L942-T945 PolarHBondContact O-OG1 3.32Å; L942-F948 HydrophobicContact CD1-CB 4.39Å; L942-F948 HydrophobicContact CD1-CD2 4.18Å; L942-F948 HydrophobicContact CD2-CD2 4.06Å; L942-F948 HydrophobicContact CD2-CE2 4.12Å; L942-F948 HydrophobicContact CG-CD2 3.9Å; L942-F948 HydrophobicContact CG-CE2 4.36Å; L942-F948 HydrophobicContact CG-CG 4.26Å; L942-F948 WeakPolarHBondContact O-CB 3.02Å; L942-A955 HydrophobicContact CD2-CB 3.68Å; L942-V958 HydrophobicContact CD2-CG1 3.79Å
943	Y	89.9	Confident	86.7	Confident	19 Å²	19	45.9 Å²	45.9	8%	0.075	25%	0.25	C	C	.	.	G	3₁₀ helix	trans	-70.4	-20.1	-172.9	74.6	-86.9	0	0	0	114.8	Y566 L567 V570 E941	Y566-Y943 HydrophobicContact CE1-CD2 4.46Å; Y566-Y943 WeakPolarHBondContact CE1-O 3.49Å; Y566-Y943 VanDerWaalsContact CZ-O 3.22Å; Y566-Y943 PolarHBondContact OH-O 2.92Å; L567-Y943 HydrophobicContact CD2-CE2 4.3Å; V570-Y943 HydrophobicContact CG1-CD2 4.08Å; V570-Y943 HydrophobicContact CG1-CE2 4Å; V570-Y943 HydrophobicContact CG2-CD2 4.37Å; E941-Y943 HydrophobicContact CB-CD1 4.02Å; E941-Y943 HydrophobicContact CB-CE1 3.76Å; E941-Y943 PolarHBondContact O-N 2.71Å; E941-Y943 WeakPolarHBondContact OE2-CE1 3.43Å
944	L	90.4	Very high	87.3	Confident	37 Å²	37	42.4 Å²	42.4	19%	0.194	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-81.3	-19.7	176.9	-66.6	170.7	0	0	0	112.3	W562 L567 T940 E941 L942	W562-L944 WeakPolarHBondContact CH2-O 3.23Å; L567-L944 HydrophobicContact CD1-CD2 4.48Å; L567-L944 HydrophobicContact CD2-CD2 3.87Å; L567-L944 HydrophobicContact CG-CD2 4.49Å; T940-L944 HydrophobicContact CG2-CB 3.57Å; T940-L944 HydrophobicContact CG2-CD1 4.32Å; E941-L944 PolarHBondContact O-N 3.36Å; L942-L944 VanDerWaalsContact C-N 3.28Å; L942-L944 PolarHBondContact O-N 3.44Å
945	T	91.8	Very high	87.9	Confident	13 Å²	13	40.6 Å²	40.6	8%	0.08	22%	0.222	C	C	.	.	S	Bend	trans	-68.6	143.8	-177	70.5	0	0	0	0	112.2	V927 T940 L942 F948 A949	V927-T945 HydrophobicContact CG1-CG2 3.72Å; T940-T945 HydrophobicContact CG2-CG2 3.82Å; L942-T945 PolarHBondContact O-N 3.02Å; L942-T945 PolarHBondContact O-OG1 3.32Å; T945-F948 PolarHBondContact O-N 3.37Å; T945-A949 WeakPolarHBondContact O-CB 3.42Å; T945-A949 PolarHBondContact O-N 3.09Å
946	Q	92	Very high	88.5	Confident	2 Å²	2	33.7 Å²	33.7	1%	0.009	19%	0.185	C	C	.	.	H	α-helix	trans	-59	-42.7	-177.9	178	175.9	-117.3	0	0	113.9	W562 D933 D934 F948 A949 C950	W562-Q946 HydrophobicContact CH2-CB 4.44Å; W562-Q946 HydrophobicContact CZ2-CB 4.06Å; D933-Q946 PolarHBondContact O-NE2 3.42Å; D933-Q946 VanDerWaalsContact O-NE2 3.11Å; D934-Q946 HydrophobicContact CB-CB 4.2Å; D934-Q946 WeakPolarHBondContact OD1-CB 3.15Å; D934-Q946 WeakPolarHBondContact OD2-CB 3.48Å; D934-Q946 PolarHBondContact OD2-N 3.17Å; Q946-F948 VanDerWaalsContact C-N 3.29Å; Q946-F948 PolarHBondContact O-N 2.72Å; Q946-A949 PolarHBondContact O-N 3.08Å; Q946-C950 VanDerWaalsContact O-CB 3.28Å; Q946-C950 WeakPolarHBondContact O-CB 3.44Å; Q946-C950 PolarHBondContact O-N 3.4Å; Q946-C950 PolarHBondContact O-SG 3.28Å
947	P	93.8	Very high	89.1	Confident	0 Å²	0	29.6 Å²	29.6	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.9	-34.6	-177.2	-22.7	35.5	0	0	0	112.5	V927 L930 D931 G951 T952 A953	V927-P947 HydrophobicContact CG2-CB 3.92Å; V927-P947 HydrophobicContact CG2-CG 4.19Å; L930-P947 HydrophobicContact CB-CB 4.24Å; L930-P947 HydrophobicContact CB-CG 4.28Å; L930-P947 HydrophobicContact CD1-CB 4.29Å; D931-P947 HydrophobicContact CB-CG 4.22Å; P947-G951 PolarHBondContact O-N 2.97Å; P947-T952 WeakPolarHBondContact CA-OG1 3.48Å; P947-T952 PolarHBondContact O-N 2.8Å; P947-T952 PolarHBondContact O-OG1 3Å; P947-A953 HydrophobicContact CB-CB 4.09Å; P947-A953 PolarHBondContact O-N 2.89Å; P947-A953 VanDerWaalsContact O-N 3.15Å
948	F	94.6	Very high	89.6	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-72.4	-49.6	173.5	-173.7	-87.9	0	0	0	111.4	T543 A546 L942 T945 Q946 C950 G951 V958	T543-F948 WeakPolarHBondContact CB-O 3.19Å; T543-F948 HydrophobicContact CG2-CD1 3.87Å; T543-F948 HydrophobicContact CG2-CE1 3.73Å; T543-F948 HydrophobicContact CG2-CZ 4.49Å; T543-F948 WeakPolarHBondContact CG2-O 3.39Å; T543-F948 PolarHBondContact OG1-O 2.89Å; A546-F948 HydrophobicContact CB-CZ 4.03Å; L942-F948 HydrophobicContact CD1-CB 4.39Å; L942-F948 HydrophobicContact CD1-CD2 4.18Å; L942-F948 HydrophobicContact CD2-CD2 4.06Å; L942-F948 HydrophobicContact CD2-CE2 4.12Å; L942-F948 HydrophobicContact CG-CD2 3.9Å; L942-F948 HydrophobicContact CG-CE2 4.36Å; L942-F948 HydrophobicContact CG-CG 4.26Å; L942-F948 WeakPolarHBondContact O-CB 3.02Å; T945-F948 PolarHBondContact O-N 3.37Å; Q946-F948 VanDerWaalsContact C-N 3.29Å; Q946-F948 PolarHBondContact O-N 2.72Å; F948-C950 PolarHBondContact O-N 3.37Å; F948-C950 VanDerWaalsContact O-N 3.17Å; F948-G951 PolarHBondContact O-N 2.89Å; F948-V958 HydrophobicContact CE2-CG1 3.93Å; F948-V958 HydrophobicContact CZ-CG1 4.12Å
949	A	93.8	Very high	90.2	Very high	0 Å²	0	21 Å²	21	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-59.7	-28.4	178.5	0	0	0	0	0	113.3	W562 Y566 T945 Q946 Y1071 V1072	W562-A949 HydrophobicContact CE3-CB 4.5Å; W562-A949 HydrophobicContact CH2-CB 3.77Å; W562-A949 HydrophobicContact CZ3-CB 3.45Å; W562-A949 VanDerWaalsContact CZ3-CB 3.45Å; Y566-A949 HydrophobicContact CD1-CB 4.35Å; Y566-A949 HydrophobicContact CD2-CB 4Å; Y566-A949 HydrophobicContact CE1-CB 4.06Å; Y566-A949 HydrophobicContact CE2-CB 3.72Å; Y566-A949 HydrophobicContact CG-CB 4.33Å; T945-A949 WeakPolarHBondContact O-CB 3.42Å; T945-A949 PolarHBondContact O-N 3.09Å; Q946-A949 PolarHBondContact O-N 3.08Å; A949-Y1071 WeakPolarHBondContact O-CA 3.26Å; A949-V1072 PolarHBondContact O-N 3.02Å
950	C	93.8	Very high	90.5	Very high	3 Å²	3	14.2 Å²	14.2	2%	0.02	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-9.5	174.5	-63.8	0	0	0	0	114.8	Q946 F948 T952 Y1054 R1070	Q946-C950 VanDerWaalsContact O-CB 3.28Å; Q946-C950 WeakPolarHBondContact O-CB 3.44Å; Q946-C950 PolarHBondContact O-N 3.4Å; Q946-C950 PolarHBondContact O-SG 3.28Å; F948-C950 PolarHBondContact O-N 3.37Å; F948-C950 VanDerWaalsContact O-N 3.17Å; C950-T952 HydrophobicContact CB-CG2 4.36Å; C950-Y1054 PolarHBondContact O-OH 3.11Å; C950-R1070 WeakPolarHBondContact CA-O 3.28Å; C950-R1070 VanDerWaalsContact CB-O 3.27Å; C950-R1070 WeakPolarHBondContact CB-O 3.38Å; C950-R1070 PolarHBondContact SG-O 3.29Å; C950-R1070 VanDerWaalsContact SG-O 3.38Å
951	G	94.1	Very high	90.6	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	71.8	28.4	-177.9	0	0	0	0	0	114.9	T543 P947 F948	T543-G951 VanDerWaalsContact OG1-CA 3.26Å; T543-G951 WeakPolarHBondContact OG1-CA 3.5Å; P947-G951 PolarHBondContact O-N 2.97Å; F948-G951 PolarHBondContact O-N 2.89Å
952	T	93.8	Very high	90.9	Very high	23 Å²	23	8 Å²	8	14%	0.141	5%	0.045	C	C	.	.	S	Bend	trans	-98.3	-15.2	174.6	63.7	0	0	0	0	112.9	I917 I918 T919 P947 C950	I917-T952 WeakPolarHBondContact O-CA 3.2Å; I917-T952 WeakPolarHBondContact O-CB 3.38Å; I918-T952 WeakPolarHBondContact CA-O 3.21Å; T919-T952 PolarHBondContact N-O 3.44Å; P947-T952 WeakPolarHBondContact CA-OG1 3.48Å; P947-T952 PolarHBondContact O-N 2.8Å; P947-T952 PolarHBondContact O-OG1 3Å; C950-T952 HydrophobicContact CB-CG2 4.36Å
953	A	94.5	Very high	91	Very high	0 Å²	0	7.2 Å²	7.2	0%	0	4%	0.041	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	146.9	171.9	0	0	0	0	0	111	L921 V927 L930 P947	L921-A953 HydrophobicContact CD1-CB 4.19Å; V927-A953 HydrophobicContact CG2-CB 3.75Å; L930-A953 HydrophobicContact CD1-CB 3.68Å; P947-A953 HydrophobicContact CB-CB 4.09Å; P947-A953 PolarHBondContact O-N 2.89Å; P947-A953 VanDerWaalsContact O-N 3.15Å
954	F	94.5	Very high	91	Very high	0 Å²	0	6.3 Å²	6.3	0%	0	4%	0.037	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	112.9	166.9	-172.5	-94.6	0	0	0	110.5	K528 F531 I532 I918 T919 E920 L921 V958 L959	K528-F954 HydrophobicContact CB-CE1 4.29Å; K528-F954 HydrophobicContact CG-CD1 4.23Å; K528-F954 HydrophobicContact CG-CE1 3.97Å; F531-F954 HydrophobicContact CB-CE2 3.99Å; F531-F954 HydrophobicContact CB-CZ 4.04Å; F531-F954 HydrophobicContact CD2-CE2 4.25Å; F531-F954 AromaticContact CD2-CZ 3.8Å; F531-F954 HydrophobicContact CD2-CZ 3.8Å; F531-F954 HydrophobicContact CG-CE2 4.27Å; F531-F954 HydrophobicContact CG-CZ 4.21Å; I532-F954 HydrophobicContact CD1-CD1 4.33Å; I532-F954 HydrophobicContact CG1-CB 4.49Å; I532-F954 HydrophobicContact CG1-CD1 4.37Å; I532-F954 HydrophobicContact CG1-CG 4.47Å; I918-F954 HydrophobicContact CD1-CB 4.47Å; T919-F954 PolarHBondContact O-N 2.79Å; E920-F954 WeakPolarHBondContact CA-O 3.16Å; L921-F954 PolarHBondContact N-O 2.69Å; F954-V958 HydrophobicContact CE2-CG2 4.02Å; F954-V958 HydrophobicContact CZ-CG2 3.96Å; F954-L959 HydrophobicContact CZ-CD2 4.3Å
955	A	90.4	Very high	90.9	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.032	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	154.5	174.8	0	0	0	0	0	111.6	L921 D924 L942 S957	L921-A955 HydrophobicContact CB-CB 4.35Å; L921-A955 WeakPolarHBondContact O-CA 3.15Å; D924-A955 VanDerWaalsContact OD1-CB 3.22Å; D924-A955 WeakPolarHBondContact OD1-CB 3.07Å; L942-A955 HydrophobicContact CD2-CB 3.68Å; A955-S957 WeakPolarHBondContact CB-OG 3.47Å
956	V	86.6	Confident	90.9	Very high	14 Å²	14	4.4 Å²	4.4	9%	0.085	3%	0.029	C	C	.	.	S	Bend	trans	-77	-25.4	179.7	-169.1	0	0	0	0	112.2	K466 L524 K528 V958 L959	K466-V956 HydrophobicContact CD-CG1 3.95Å; L524-V956 HydrophobicContact CD1-CG1 4.33Å; K528-V956 HydrophobicContact CD-CG2 3.83Å; V956-V958 VanDerWaalsContact C-N 3.29Å; V956-V958 PolarHBondContact O-N 3.18Å; V956-L959 HydrophobicContact CG1-CD1 4.42Å; V956-L959 WeakPolarHBondContact O-CB 3.15Å; V956-L959 PolarHBondContact O-N 2.88Å; V956-L959 VanDerWaalsContact O-N 3.07Å
957	S	84.9	Confident	90.9	Very high	10 Å²	10	5.1 Å²	5.1	7%	0.07	3%	0.031	C	C	.	.	G	3₁₀ helix	trans	-46.4	-44.1	177.4	52.2	0	0	0	0	114.1	D924 A955 L959 D960	D924-S957 VanDerWaalsContact CG-OG 3.25Å; D924-S957 VanDerWaalsContact OD1-CB 3.25Å; D924-S957 WeakPolarHBondContact OD1-CB 3.43Å; D924-S957 PolarHBondContact OD1-OG 3.06Å; D924-S957 VanDerWaalsContact OD2-CB 3.26Å; D924-S957 WeakPolarHBondContact OD2-CB 3.06Å; D924-S957 PolarHBondContact OD2-OG 3.03Å; A955-S957 WeakPolarHBondContact CB-OG 3.47Å; S957-L959 PolarHBondContact O-N 2.96Å; S957-D960 WeakPolarHBondContact O-CB 3.4Å; S957-D960 PolarHBondContact O-N 3.07Å
958	V	87.4	Confident	90.6	Very high	11 Å²	11	7.8 Å²	7.8	7%	0.067	4%	0.043	C	C	.	.	G	3₁₀ helix	trans	-57.3	-26.2	-178	-51.9	0	0	0	0	112.9	A546 F549 L942 F948 F954 V956 D960 S961	A546-V958 HydrophobicContact CB-CB 4.43Å; A546-V958 HydrophobicContact CB-CG2 4.17Å; F549-V958 WeakPolarHBondContact CE2-O 3.36Å; L942-V958 HydrophobicContact CD2-CG1 3.79Å; F948-V958 HydrophobicContact CE2-CG1 3.93Å; F948-V958 HydrophobicContact CZ-CG1 4.12Å; F954-V958 HydrophobicContact CE2-CG2 4.02Å; F954-V958 HydrophobicContact CZ-CG2 3.96Å; V956-V958 VanDerWaalsContact C-N 3.29Å; V956-V958 PolarHBondContact O-N 3.18Å; V958-D960 PolarHBondContact O-N 3.05Å; V958-S961 PolarHBondContact O-N 3.03Å
959	L	89.1	Confident	90.2	Very high	0 Å²	0	9.9 Å²	9.9	0%	0	5%	0.054	C	C	.	.	G	3₁₀ helix	trans	-73.9	-11	179.6	-57.3	-178.8	0	0	0	113.4	L524 L527 K528 F531 F549 F954 V956 S957 L962	L524-L959 HydrophobicContact CD2-CB 3.85Å; L524-L959 HydrophobicContact CD2-CD1 4Å; L527-L959 HydrophobicContact CB-CD1 4.23Å; L527-L959 HydrophobicContact CB-CD2 4.37Å; K528-L959 HydrophobicContact CB-CD1 4.32Å; F531-L959 HydrophobicContact CD2-CD2 4.08Å; F531-L959 HydrophobicContact CE2-CD2 3.64Å; F549-L959 HydrophobicContact CZ-CD2 4.17Å; F954-L959 HydrophobicContact CZ-CD2 4.3Å; V956-L959 HydrophobicContact CG1-CD1 4.42Å; V956-L959 WeakPolarHBondContact O-CB 3.15Å; V956-L959 PolarHBondContact O-N 2.88Å; V956-L959 VanDerWaalsContact O-N 3.07Å; S957-L959 PolarHBondContact O-N 2.96Å; L959-L962 WeakPolarHBondContact O-CB 3.49Å; L959-L962 PolarHBondContact O-N 3.19Å
960	D	86.4	Confident	89.7	Confident	9 Å²	9	12.8 Å²	12.8	5%	0.048	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-66.8	-37.9	172.4	-72.8	-23.1	0	0	0	111.4	N396 K466 Q497 S957 V958 L962 M963	N396-D960 HydrophobicContact CB-CB 4.35Å; N396-D960 PolarHBondContact ND2-OD2 2.98Å; K466-D960 IonicContact NZ-OD1 3.45Å; K466-D960 PolarHBondContact NZ-OD1 2.88Å; K466-D960 IonicContact NZ-OD2 2.85Å; K466-D960 PolarHBondContact NZ-OD2 2.82Å; Q497-D960 PolarHBondContact NE2-OD1 3.43Å; Q497-D960 VanDerWaalsContact NE2-OD1 3.11Å; S957-D960 WeakPolarHBondContact O-CB 3.4Å; S957-D960 PolarHBondContact O-N 3.07Å; V958-D960 PolarHBondContact O-N 3.05Å; D960-L962 PolarHBondContact O-N 2.83Å; D960-L962 VanDerWaalsContact O-N 3.11Å; D960-M963 WeakPolarHBondContact O-CB 3.03Å; D960-M963 PolarHBondContact O-N 2.94Å
961	S	87.4	Confident	89.4	Confident	9 Å²	9	15.4 Å²	15.4	6%	0.063	8%	0.083	C	C	.	.	H	α-helix	trans	-54	-34.6	177.4	-57.7	0	0	0	0	112.4	D400 S550 V958 M963 S964 A965	D400-S961 VanDerWaalsContact CG-OG 3.3Å; D400-S961 PolarHBondContact OD1-OG 3.38Å; D400-S961 VanDerWaalsContact OD2-CA 3.23Å; D400-S961 WeakPolarHBondContact OD2-CA 3.31Å; D400-S961 WeakPolarHBondContact OD2-CB 3.28Å; D400-S961 PolarHBondContact OD2-OG 3.24Å; S550-S961 PolarHBondContact OG-OG 2.96Å; V958-S961 PolarHBondContact O-N 3.03Å; S961-M963 VanDerWaalsContact C-N 3.26Å; S961-M963 PolarHBondContact O-N 2.82Å; S961-S964 WeakPolarHBondContact O-CB 3.46Å; S961-S964 PolarHBondContact O-N 2.78Å; S961-S964 PolarHBondContact O-OG 2.78Å; S961-A965 PolarHBondContact O-N 2.92Å; S961-A965 VanDerWaalsContact O-N 3.11Å
962	L	90.3	Very high	89.1	Confident	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-64.7	-25.3	-178.2	-169.1	62.9	0	0	0	113	I522 L527 F549 L959 D960 S964 A965 T966 I972 L973 I976	I522-L962 HydrophobicContact CD1-CG 4.16Å; I522-L962 HydrophobicContact CG2-CD2 4.14Å; L527-L962 HydrophobicContact CD1-CD2 3.46Å; L527-L962 VanDerWaalsContact CD1-CD2 3.46Å; F549-L962 HydrophobicContact CB-CD1 4.44Å; F549-L962 HydrophobicContact CD2-CB 4.19Å; F549-L962 HydrophobicContact CD2-CD1 4.33Å; F549-L962 HydrophobicContact CE2-CB 4.25Å; F549-L962 HydrophobicContact CG-CD1 4.21Å; L959-L962 WeakPolarHBondContact O-CB 3.49Å; L959-L962 PolarHBondContact O-N 3.19Å; D960-L962 PolarHBondContact O-N 2.83Å; D960-L962 VanDerWaalsContact O-N 3.11Å; L962-S964 VanDerWaalsContact C-N 3.28Å; L962-S964 PolarHBondContact O-N 2.97Å; L962-A965 HydrophobicContact CD1-CB 4.4Å; L962-A965 PolarHBondContact O-N 2.84Å; L962-T966 VanDerWaalsContact O-CB 3.26Å; L962-T966 WeakPolarHBondContact O-CB 3.38Å; L962-T966 PolarHBondContact O-N 2.79Å; L962-T966 PolarHBondContact O-OG1 3.03Å; L962-I972 HydrophobicContact CD1-CG2 4.36Å; L962-L973 HydrophobicContact CD2-CD1 4Å; L962-I976 HydrophobicContact CD1-CD1 3.78Å
963	M	90.9	Very high	88.9	Confident	1 Å²	1	14.7 Å²	14.7	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-60.8	-39.7	170.5	-73.4	-69.2	-71	0	0	111.2	L461 L463 I495 Q497 I522 D960 S961 Y967	L461-M963 HydrophobicContact CB-CE 3.98Å; L461-M963 HydrophobicContact CD2-CE 4.29Å; L461-M963 HydrophobicContact CG-CE 4.26Å; L463-M963 HydrophobicContact CD2-CE 4.19Å; L463-M963 HydrophobicContact CD2-CG 4.41Å; I495-M963 HydrophobicContact CB-CE 4.38Å; I495-M963 HydrophobicContact CG2-CE 3.93Å; I495-M963 HydrophobicContact CG2-SD 3.8Å; Q497-M963 HydrophobicContact CG-CE 4.3Å; Q497-M963 HydrophobicContact CG-CG 3.96Å; Q497-M963 HydrophobicContact CG-SD 3.52Å; Q497-M963 VanDerWaalsContact CG-SD 3.52Å; I522-M963 HydrophobicContact CD1-CG 4.36Å; I522-M963 HydrophobicContact CD1-SD 3.73Å; D960-M963 WeakPolarHBondContact O-CB 3.03Å; D960-M963 PolarHBondContact O-N 2.94Å; S961-M963 VanDerWaalsContact C-N 3.26Å; S961-M963 PolarHBondContact O-N 2.82Å; M963-Y967 PolarHBondContact O-N 2.98Å
964	S	89.8	Confident	88.6	Confident	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-74.3	-44.1	177.1	87.1	0	0	0	0	111.5	R406 S961 L962 T966 Y967 F968	R406-S964 VanDerWaalsContact NH1-CB 3.33Å; R406-S964 PolarHBondContact NH1-OG 3.1Å; R406-S964 PolarHBondContact NH2-OG 3.04Å; S961-S964 WeakPolarHBondContact O-CB 3.46Å; S961-S964 PolarHBondContact O-N 2.78Å; S961-S964 PolarHBondContact O-OG 2.78Å; L962-S964 VanDerWaalsContact C-N 3.28Å; L962-S964 PolarHBondContact O-N 2.97Å; S964-T966 VanDerWaalsContact C-N 3.32Å; S964-T966 PolarHBondContact O-N 3.15Å; S964-Y967 PolarHBondContact O-N 2.86Å; S964-F968 VanDerWaalsContact O-CD2 3.28Å; S964-F968 WeakPolarHBondContact O-CD2 3.35Å; S964-F968 PolarHBondContact O-N 2.89Å; S964-F968 VanDerWaalsContact O-N 3.17Å
965	A	89.3	Confident	88.3	Confident	11 Å²	11	17.9 Å²	17.9	9%	0.091	10%	0.098	C	C	.	.	H	α-helix	trans	-62.4	-39.5	-179.7	0	0	0	0	0	112	F549 S961 L962 F968 N969	F549-A965 HydrophobicContact CB-CB 4.34Å; S961-A965 PolarHBondContact O-N 2.92Å; S961-A965 VanDerWaalsContact O-N 3.11Å; L962-A965 HydrophobicContact CD1-CB 4.4Å; L962-A965 PolarHBondContact O-N 2.84Å; A965-F968 PolarHBondContact O-N 2.83Å; A965-N969 PolarHBondContact O-N 2.96Å
966	T	91.4	Very high	88.3	Confident	0 Å²	0	18.1 Å²	18.1	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-66.6	-37.5	176.2	-55.1	0	0	0	0	111.9	R493 I495 D520 I522 L962 S964 N969 D970 L973	R493-T966 PolarHBondContact NH1-O 2.82Å; R493-T966 PolarHBondContact NH2-O 2.66Å; I495-T966 HydrophobicContact CD1-CG2 4.23Å; I495-T966 HydrophobicContact CG2-CG2 4.29Å; D520-T966 HydrophobicContact CB-CG2 3.77Å; D520-T966 VanDerWaalsContact OD2-CG2 3.27Å; D520-T966 WeakPolarHBondContact OD2-CG2 3.21Å; I522-T966 HydrophobicContact CD1-CG2 4.49Å; L962-T966 VanDerWaalsContact O-CB 3.26Å; L962-T966 WeakPolarHBondContact O-CB 3.38Å; L962-T966 PolarHBondContact O-N 2.79Å; L962-T966 PolarHBondContact O-OG1 3.03Å; S964-T966 VanDerWaalsContact C-N 3.32Å; S964-T966 PolarHBondContact O-N 3.15Å; T966-N969 CarbonylContact O-C 3.53Å; T966-D970 PolarHBondContact O-N 3Å; T966-L973 HydrophobicContact CG2-CB 4.1Å; T966-L973 HydrophobicContact CG2-CD2 4.2Å
967	Y	91.7	Very high	88.4	Confident	17 Å²	17	19 Å²	19	7%	0.067	10%	0.101	C	C	.	.	H	α-helix	trans	-62.6	-43.2	174.7	171.3	-105.6	0	0	0	112.6	I383 F401 D458 A459 R493 I495 M963 S964	I383-Y967 HydrophobicContact CG2-CD2 4.28Å; I383-Y967 HydrophobicContact CG2-CE1 4.36Å; I383-Y967 HydrophobicContact CG2-CE2 3.66Å; F401-Y967 AromaticContact CE2-CD1 3.42Å; F401-Y967 HydrophobicContact CE2-CD1 3.42Å; F401-Y967 VanDerWaalsContact CE2-CD1 3.42Å; F401-Y967 AromaticContact CE2-CE1 3.89Å; F401-Y967 HydrophobicContact CE2-CE1 3.89Å; F401-Y967 HydrophobicContact CE2-CG 4.14Å; F401-Y967 AromaticContact CZ-CD1 3.7Å; F401-Y967 HydrophobicContact CZ-CD1 3.7Å; F401-Y967 AromaticContact CZ-CE1 3.64Å; F401-Y967 HydrophobicContact CZ-CE1 3.64Å; D458-Y967 PolarHBondContact OD2-OH 3.24Å; A459-Y967 HydrophobicContact CB-CD2 3.79Å; A459-Y967 HydrophobicContact CB-CE2 3.75Å; R493-Y967 PolarHBondContact NH1-O 3.28Å; R493-Y967 VanDerWaalsContact NH1-O 3.12Å; I495-Y967 HydrophobicContact CD1-CD2 4.48Å; M963-Y967 PolarHBondContact O-N 2.98Å; S964-Y967 PolarHBondContact O-N 2.86Å
968	F	87.9	Confident	88.6	Confident	55 Å²	55	20.5 Å²	20.5	24%	0.241	11%	0.11	C	C	.	.	H	α-helix	trans	-79.7	-28.4	-179.8	-71.9	-70.2	0	0	0	113.9	F401 R406 V409 S964 A965	F401-F968 HydrophobicContact CD2-CE2 4.03Å; F401-F968 HydrophobicContact CE1-CE2 4.47Å; F401-F968 HydrophobicContact CE1-CZ 4.1Å; F401-F968 AromaticContact CE2-CE2 3.86Å; F401-F968 HydrophobicContact CE2-CE2 3.86Å; F401-F968 HydrophobicContact CE2-CZ 4.1Å; F401-F968 HydrophobicContact CG-CE2 4.42Å; F401-F968 HydrophobicContact CZ-CE2 4.09Å; F401-F968 AromaticContact CZ-CZ 3.84Å; F401-F968 HydrophobicContact CZ-CZ 3.84Å; R406-F968 VanDerWaalsContact NH1-CE2 3.35Å; V409-F968 HydrophobicContact CB-CE1 4.1Å; V409-F968 HydrophobicContact CG1-CE1 4.22Å; V409-F968 HydrophobicContact CG2-CD1 4.42Å; V409-F968 HydrophobicContact CG2-CE1 3.75Å; S964-F968 VanDerWaalsContact O-CD2 3.28Å; S964-F968 WeakPolarHBondContact O-CD2 3.35Å; S964-F968 PolarHBondContact O-N 2.89Å; S964-F968 VanDerWaalsContact O-N 3.17Å; A965-F968 PolarHBondContact O-N 2.83Å
969	N	86.1	Confident	88.7	Confident	45 Å²	45	21.3 Å²	21.3	24%	0.241	11%	0.114	C	C	.	.			trans	-144.2	95.2	177.6	-70.3	-90.9	0	0	0	111.6	T576 A965 T966 N971 I972	T576-N969 PolarHBondContact OG1-OD1 2.88Å; A965-N969 PolarHBondContact O-N 2.96Å; T966-N969 CarbonylContact O-C 3.53Å; N969-N971 PolarHBondContact O-N 2.82Å; N969-N971 VanDerWaalsContact O-N 3.12Å; N969-I972 HydrophobicContact CB-CB 4.41Å; N969-I972 HydrophobicContact CB-CD1 4.46Å; N969-I972 HydrophobicContact CB-CG1 3.45Å; N969-I972 VanDerWaalsContact CB-CG1 3.45Å; N969-I972 WeakPolarHBondContact O-CB 3.48Å; N969-I972 WeakPolarHBondContact O-CG1 3.39Å; N969-I972 PolarHBondContact O-N 3Å
970	D	83.7	Confident	88.8	Confident	60 Å²	60	21.3 Å²	21.3	32%	0.321	11%	0.114	S	C	.	.	H	α-helix	trans	-47	-44.5	179.8	-51	27.9	0	0	0	112.4	R493 T966 I972	R493-D970 IonicContact CZ-OD1 3.97Å; R493-D970 VanDerWaalsContact CZ-OD1 3.26Å; R493-D970 IonicContact CZ-OD2 3.01Å; R493-D970 IonicContact NE-OD2 3.83Å; R493-D970 VanDerWaalsContact NH1-CG 3.27Å; R493-D970 IonicContact NH1-OD1 2.72Å; R493-D970 PolarHBondContact NH1-OD1 3.21Å; R493-D970 IonicContact NH1-OD2 2.98Å; R493-D970 VanDerWaalsContact NH2-CG 3.27Å; R493-D970 IonicContact NH2-OD1 2.8Å; R493-D970 PolarHBondContact NH2-OD1 2.98Å; R493-D970 IonicContact NH2-OD2 3.29Å; T966-D970 PolarHBondContact O-N 3Å; D970-I972 PolarHBondContact O-N 3.22Å
971	N	86.9	Confident	88.8	Confident	58 Å²	58	21.4 Å²	21.4	31%	0.31	11%	0.114	S	C	.	.	H	α-helix	trans	-69.1	-14.2	-175.8	-58.6	-73.1	0	0	0	114.7	F634 N969 T974 L975	F634-N971 HydrophobicContact CE1-CB 3.61Å; F634-N971 HydrophobicContact CZ-CB 3.76Å; N969-N971 PolarHBondContact O-N 2.82Å; N969-N971 VanDerWaalsContact O-N 3.12Å; N971-T974 PolarHBondContact O-N 2.82Å; N971-L975 PolarHBondContact O-N 3.08Å
972	I	87.9	Confident	88.3	Confident	3 Å²	3	21.2 Å²	21.2	2%	0.015	11%	0.114	C	C	.	.	H	α-helix	trans	-65.9	-44.5	-179.1	-67.4	-68.5	0	0	0	110.5	M574 T576 L962 N969 D970 T974 L975 I976	M574-I972 HydrophobicContact CB-CD1 3.93Å; M574-I972 HydrophobicContact CG-CD1 3.53Å; M574-I972 WeakPolarHBondContact O-CD1 3.08Å; M574-I972 HydrophobicContact SD-CD1 3.69Å; T576-I972 HydrophobicContact CG2-CD1 4.19Å; L962-I972 HydrophobicContact CD1-CG2 4.36Å; N969-I972 HydrophobicContact CB-CB 4.41Å; N969-I972 HydrophobicContact CB-CD1 4.46Å; N969-I972 HydrophobicContact CB-CG1 3.45Å; N969-I972 VanDerWaalsContact CB-CG1 3.45Å; N969-I972 WeakPolarHBondContact O-CB 3.48Å; N969-I972 WeakPolarHBondContact O-CG1 3.39Å; N969-I972 PolarHBondContact O-N 3Å; D970-I972 PolarHBondContact O-N 3.22Å; I972-T974 VanDerWaalsContact C-N 3.3Å; I972-T974 PolarHBondContact O-N 2.77Å; I972-L975 PolarHBondContact O-N 3.06Å; I972-I976 HydrophobicContact CG2-CD1 3.62Å; I972-I976 HydrophobicContact CG2-CG1 4.34Å; I972-I976 WeakPolarHBondContact O-CB 3.46Å; I972-I976 WeakPolarHBondContact O-CG1 3.31Å; I972-I976 PolarHBondContact O-N 3.21Å
973	L	89.5	Confident	87.5	Confident	5 Å²	5	21.3 Å²	21.3	3%	0.026	12%	0.115	C	C	.	.	H	α-helix	trans	-60.9	-42.4	175.4	-176.7	63.6	0	0	0	110.6	D520 I522 L527 L962 T966 R977	D520-L973 HydrophobicContact CB-CD2 3.88Å; I522-L973 HydrophobicContact CG1-CD1 4.06Å; I522-L973 HydrophobicContact CG1-CD2 3.76Å; L527-L973 HydrophobicContact CD1-CD1 4.3Å; L962-L973 HydrophobicContact CD2-CD1 4Å; T966-L973 HydrophobicContact CG2-CB 4.1Å; T966-L973 HydrophobicContact CG2-CD2 4.2Å; L973-R977 HydrophobicContact CD1-CG 4.11Å; L973-R977 HydrophobicContact CG-CG 4.32Å; L973-R977 VanDerWaalsContact O-CB 3.27Å; L973-R977 WeakPolarHBondContact O-CB 3.5Å; L973-R977 WeakPolarHBondContact O-CG 3.42Å; L973-R977 PolarHBondContact O-N 2.89Å
974	T	87.6	Confident	86.8	Confident	64 Å²	64	21.8 Å²	21.8	39%	0.393	12%	0.12	S	C	.	.	H	α-helix	trans	-63.5	-43.1	178.7	-33.6	0	0	0	0	112.4	I617 N971 I972 T978	I617-T974 HydrophobicContact CD1-CG2 3.78Å; N971-T974 PolarHBondContact O-N 2.82Å; I972-T974 VanDerWaalsContact C-N 3.3Å; I972-T974 PolarHBondContact O-N 2.77Å; T974-T978 WeakPolarHBondContact O-CB 3.47Å; T974-T978 PolarHBondContact O-N 3.07Å; T974-T978 PolarHBondContact O-OG1 3.3Å
975	L	89.6	Confident	86.4	Confident	4 Å²	4	23.6 Å²	23.6	2%	0.021	13%	0.131	C	C	.	.	H	α-helix	trans	-65.8	-50.3	176.1	171.1	56.8	0	0	0	111.4	M574 A605 I617 I619 F634 N971 I972 R977 T978 L979	M574-L975 HydrophobicContact SD-CD2 3.53Å; M574-L975 VanDerWaalsContact SD-CD2 3.53Å; M574-L975 HydrophobicContact SD-CG 4.23Å; A605-L975 HydrophobicContact CB-CD1 3.93Å; A605-L975 HydrophobicContact CB-CD2 4.46Å; I617-L975 HydrophobicContact CD1-CB 4.28Å; I617-L975 HydrophobicContact CG2-CB 4.47Å; I617-L975 HydrophobicContact CG2-CD1 3.91Å; I619-L975 HydrophobicContact CD1-CD1 3.72Å; I619-L975 HydrophobicContact CG1-CD1 3.71Å; F634-L975 HydrophobicContact CB-CD2 3.72Å; F634-L975 HydrophobicContact CD1-CB 4.21Å; F634-L975 HydrophobicContact CD1-CD2 3.36Å; F634-L975 HydrophobicContact CD1-CG 4.38Å; F634-L975 HydrophobicContact CE1-CB 4.06Å; F634-L975 HydrophobicContact CE1-CD2 4.07Å; F634-L975 HydrophobicContact CG-CD2 3.67Å; N971-L975 PolarHBondContact O-N 3.08Å; I972-L975 PolarHBondContact O-N 3.06Å; L975-R977 PolarHBondContact O-N 3.19Å; L975-T978 PolarHBondContact O-N 2.89Å; L975-T978 VanDerWaalsContact O-N 3.14Å; L975-L979 WeakPolarHBondContact O-CB 3.34Å; L975-L979 PolarHBondContact O-N 2.85Å
976	I	89.9	Confident	86	Confident	4 Å²	4	26.3 Å²	26.3	2%	0.021	15%	0.147	C	C	.	.	H	α-helix	trans	-57.4	-49.4	178.4	-70.9	172	0	0	0	109.9	L527 F531 F549 L962 I972 T978 L979 V980	L527-I976 HydrophobicContact CD2-CG2 4.08Å; F531-I976 HydrophobicContact CE1-CG2 4.26Å; F531-I976 HydrophobicContact CZ-CG2 3.72Å; F549-I976 HydrophobicContact CD1-CD1 3.65Å; F549-I976 HydrophobicContact CE1-CD1 4.2Å; F549-I976 HydrophobicContact CG-CD1 4.36Å; L962-I976 HydrophobicContact CD1-CD1 3.78Å; I972-I976 HydrophobicContact CG2-CD1 3.62Å; I972-I976 HydrophobicContact CG2-CG1 4.34Å; I972-I976 WeakPolarHBondContact O-CB 3.46Å; I972-I976 WeakPolarHBondContact O-CG1 3.31Å; I972-I976 PolarHBondContact O-N 3.21Å; I976-T978 VanDerWaalsContact C-N 3.33Å; I976-T978 PolarHBondContact O-N 3.5Å; I976-L979 PolarHBondContact O-N 2.8Å; I976-V980 HydrophobicContact CG2-CG2 3.98Å; I976-V980 WeakPolarHBondContact O-CB 3.42Å; I976-V980 WeakPolarHBondContact O-CG2 3.12Å; I976-V980 PolarHBondContact O-N 3.46Å
977	R	89.1	Confident	85.5	Confident	33 Å²	33	32.4 Å²	32.4	13%	0.125	18%	0.176	C	C	.	.	H	α-helix	trans	-58	-43.9	176	-72.2	-176.9	70.3	-140.3	-11.6	112	E526 L527 L973 L975 L979 V980 T981 E989	E526-R977 IonicContact OE1-CZ 3.05Å; E526-R977 IonicContact OE1-NE 3.67Å; E526-R977 PolarHBondContact OE1-NE 3.24Å; E526-R977 IonicContact OE1-NH2 3.94Å; E526-R977 PolarHBondContact OE1-NH2 3.41Å; E526-R977 IonicContact OE2-NE 3.45Å; E526-R977 IonicContact OE2-NH2 3.34Å; L527-R977 HydrophobicContact CD2-CG 4.19Å; L973-R977 HydrophobicContact CD1-CG 4.11Å; L973-R977 HydrophobicContact CG-CG 4.32Å; L973-R977 VanDerWaalsContact O-CB 3.27Å; L973-R977 WeakPolarHBondContact O-CB 3.5Å; L973-R977 WeakPolarHBondContact O-CG 3.42Å; L973-R977 PolarHBondContact O-N 2.89Å; L975-R977 PolarHBondContact O-N 3.19Å; R977-L979 PolarHBondContact O-N 2.91Å; R977-V980 PolarHBondContact O-N 3.07Å; R977-T981 VanDerWaalsContact O-CB 3.31Å; R977-T981 WeakPolarHBondContact O-CB 3.5Å; R977-T981 WeakPolarHBondContact O-CG2 3.43Å; R977-T981 PolarHBondContact O-N 3.25Å; R977-T981 PolarHBondContact O-OG1 3.34Å; R977-E989 IonicContact CZ-OE1 2.62Å; R977-E989 IonicContact CZ-OE2 3.88Å; R977-E989 IonicContact NH1-OE1 3.53Å; R977-E989 PolarHBondContact NH1-OE1 3.09Å; R977-E989 IonicContact NH1-OE2 2.66Å; R977-E989 PolarHBondContact NH1-OE2 2.93Å; R977-E989 IonicContact NH2-OE1 3.93Å; R977-E989 PolarHBondContact NH2-OE1 3.19Å; R977-E989 IonicContact NH2-OE2 2.71Å; R977-E989 PolarHBondContact NH2-OE2 2.84Å
978	T	88.5	Confident	85.2	Confident	41 Å²	41	31.8 Å²	31.8	25%	0.252	17%	0.173	S	C	.	.	H	α-helix	trans	-61.6	-44.2	179	-58.6	0	0	0	0	112	I619 T974 L975 I976 G983	I619-T978 HydrophobicContact CD1-CG2 3.85Å; I619-T978 HydrophobicContact CG1-CG2 4.49Å; T974-T978 WeakPolarHBondContact O-CB 3.47Å; T974-T978 PolarHBondContact O-N 3.07Å; T974-T978 PolarHBondContact O-OG1 3.3Å; L975-T978 PolarHBondContact O-N 2.89Å; L975-T978 VanDerWaalsContact O-N 3.14Å; I976-T978 VanDerWaalsContact C-N 3.33Å; I976-T978 PolarHBondContact O-N 3.5Å; T978-G983 PolarHBondContact O-N 2.88Å
979	L	89.1	Confident	85	Confident	28 Å²	28	30.1 Å²	30.1	15%	0.147	17%	0.166	C	C	.	.	H	α-helix	trans	-67.2	-48.7	177.5	-178.5	61.8	0	0	0	111.9	Q534 L545 I619 L975 I976 R977 V1016 L1091	Q534-L979 PolarHBondContact NE2-O 3.44Å; L545-L979 HydrophobicContact CD1-CD2 4Å; L545-L979 HydrophobicContact CD2-CD2 3.83Å; I619-L979 HydrophobicContact CD1-CB 3.83Å; I619-L979 HydrophobicContact CD1-CD1 4.21Å; L975-L979 WeakPolarHBondContact O-CB 3.34Å; L975-L979 PolarHBondContact O-N 2.85Å; I976-L979 PolarHBondContact O-N 2.8Å; R977-L979 PolarHBondContact O-N 2.91Å; L979-V1016 HydrophobicContact CD1-CG2 3.85Å; L979-L1091 HydrophobicContact CD1-CD2 4.19Å
980	V	90.9	Very high	84.8	Confident	1 Å²	1	29.6 Å²	29.6	1%	0.006	17%	0.171	C	C	.	.	H	α-helix	trans	-81.8	-41.7	-166.7	173.1	0	0	0	0	112.6	G530 F531 Q534 L545 I976 R977 G982	G530-V980 VanDerWaalsContact CA-CG1 3.5Å; F531-V980 HydrophobicContact CD1-CG1 4.3Å; F531-V980 HydrophobicContact CD1-CG2 3.89Å; F531-V980 HydrophobicContact CE1-CG2 3.56Å; F531-V980 HydrophobicContact CG-CG1 4.44Å; F531-V980 HydrophobicContact CZ-CG2 4.2Å; Q534-V980 HydrophobicContact CG-CG1 4.48Å; Q534-V980 PolarHBondContact NE2-O 3.39Å; L545-V980 HydrophobicContact CD1-CG2 3.89Å; I976-V980 HydrophobicContact CG2-CG2 3.98Å; I976-V980 WeakPolarHBondContact O-CB 3.42Å; I976-V980 WeakPolarHBondContact O-CG2 3.12Å; I976-V980 PolarHBondContact O-N 3.46Å; R977-V980 PolarHBondContact O-N 3.07Å; V980-G982 PolarHBondContact O-N 2.65Å
981	T	86.8	Confident	84.8	Confident	10 Å²	10	29 Å²	29	6%	0.061	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.5	-9.9	179.9	63.8	0	0	0	0	113.5	E526 R977 G983 A984	E526-T981 HydrophobicContact CG-CG2 4.12Å; E526-T981 WeakPolarHBondContact OE1-CG2 3.45Å; R977-T981 VanDerWaalsContact O-CB 3.31Å; R977-T981 WeakPolarHBondContact O-CB 3.5Å; R977-T981 WeakPolarHBondContact O-CG2 3.43Å; R977-T981 PolarHBondContact O-N 3.25Å; R977-T981 PolarHBondContact O-OG1 3.34Å; T981-G983 VanDerWaalsContact C-N 3.31Å; T981-G983 PolarHBondContact OG1-N 2.87Å; T981-A984 HydrophobicContact CG2-CB 4.25Å; T981-A984 WeakPolarHBondContact OG1-CB 3.27Å; T981-A984 PolarHBondContact OG1-N 3.33Å
982	G	77.8	Confident	84.7	Confident	6 Å²	6	26.5 Å²	26.5	6%	0.062	16%	0.155	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.5	23.2	-167.5	0	0	0	0	0	113.2	V980 R1013	V980-G982 PolarHBondContact O-N 2.65Å; G982-R1013 PolarHBondContact O-NH1 3Å; G982-R1013 PolarHBondContact O-NH2 3.16Å
983	G	72.4	Confident	84.2	Confident	2 Å²	2	28 Å²	28	2%	0.021	17%	0.167	C	C	.	.			trans	97.5	50.1	171.7	0	0	0	0	0	115.7	M730 T978 T981 T985	M730-G983 WeakPolarHBondContact CE-O 3.45Å; T978-G983 PolarHBondContact O-N 2.88Å; T981-G983 VanDerWaalsContact C-N 3.31Å; T981-G983 PolarHBondContact OG1-N 2.87Å; G983-T985 PolarHBondContact O-N 2.91Å; G983-T985 VanDerWaalsContact O-N 3.11Å
984	A	75.8	Confident	83.7	Confident	11 Å²	11	34.5 Å²	34.5	9%	0.091	20%	0.198	C	C	.	.			trans	-66.9	103.2	166.9	0	0	0	0	0	110.9	T981	T981-A984 HydrophobicContact CG2-CB 4.25Å; T981-A984 WeakPolarHBondContact OG1-CB 3.27Å; T981-A984 PolarHBondContact OG1-N 3.33Å
985	T	82.1	Confident	82.9	Confident	38 Å²	38	36.5 Å²	36.5	23%	0.233	20%	0.203	C	C	.	.			trans	-80.7	156.8	175.6	59.7	0	0	0	0	111.5	M730 G983 E987 L988 E989	M730-T985 HydrophobicContact CE-CG2 4.14Å; G983-T985 PolarHBondContact O-N 2.91Å; G983-T985 VanDerWaalsContact O-N 3.11Å; T985-E987 PolarHBondContact O-N 3.41Å; T985-L988 WeakPolarHBondContact O-CA 3.43Å; T985-L988 WeakPolarHBondContact O-CB 3.38Å; T985-L988 PolarHBondContact O-N 3.07Å; T985-L988 PolarHBondContact OG1-N 2.57Å; T985-E989 PolarHBondContact O-N 3.48Å
986	P	80.8	Confident	82.5	Confident	67 Å²	67	40 Å²	40	44%	0.435	22%	0.221	S	C	.	.	H	α-helix	trans	-56.9	-28.8	171.9	-26.5	35.8	0	0	0	113.7	W515 E989 G990	W515-P986 HydrophobicContact CH2-CB 4.5Å; W515-P986 HydrophobicContact CH2-CG 4.09Å; W515-P986 HydrophobicContact CZ2-CB 4.12Å; W515-P986 HydrophobicContact CZ2-CG 4.2Å; P986-E989 PolarHBondContact O-N 3.49Å; P986-G990 PolarHBondContact O-N 2.79Å
987	E	81.6	Confident	82.1	Confident	129 Å²	129	41.7 Å²	41.7	60%	0.603	24%	0.236	S	C	*	.	H	α-helix	trans	-61.1	-43.5	171.7	-55.5	-179.6	128.5	0	0	111.9	T985 G990 L991	T985-E987 PolarHBondContact O-N 3.41Å; E987-G990 PolarHBondContact O-N 2.79Å; E987-L991 WeakPolarHBondContact O-CG 3.35Å; E987-L991 PolarHBondContact O-N 3.36Å
988	L	85.3	Confident	81.9	Confident	3 Å²	3	40.7 Å²	40.7	2%	0.016	23%	0.233	C	C	.	.	H	α-helix	trans	-69.4	-38.6	176.8	-175.8	60.9	0	0	0	111.2	T728 F731 T985 G990 L991 L992 L998	T728-L988 HydrophobicContact CG2-CB 4.25Å; T728-L988 HydrophobicContact CG2-CD1 4.21Å; F731-L988 HydrophobicContact CD2-CD2 3.86Å; F731-L988 HydrophobicContact CE2-CD2 3.48Å; F731-L988 VanDerWaalsContact CE2-CD2 3.48Å; T985-L988 WeakPolarHBondContact O-CA 3.43Å; T985-L988 WeakPolarHBondContact O-CB 3.38Å; T985-L988 PolarHBondContact O-N 3.07Å; T985-L988 PolarHBondContact OG1-N 2.57Å; L988-G990 VanDerWaalsContact C-N 3.3Å; L988-G990 PolarHBondContact O-N 3.06Å; L988-L991 PolarHBondContact O-N 3.36Å; L988-L992 HydrophobicContact CD1-CD1 4.24Å; L988-L992 HydrophobicContact CD1-CG 4.31Å; L988-L992 HydrophobicContact CG-CD1 3.9Å; L988-L992 HydrophobicContact CG-CG 4.42Å; L988-L992 WeakPolarHBondContact O-CB 3.46Å; L988-L992 WeakPolarHBondContact O-CD1 3.48Å; L988-L992 WeakPolarHBondContact O-CG 3.49Å; L988-L992 PolarHBondContact O-N 3.27Å; L988-L998 HydrophobicContact CD1-CD2 3.89Å
989	E	83.7	Confident	81.8	Confident	21 Å²	21	43.9 Å²	43.9	10%	0.098	24%	0.24	C	C	.	.	H	α-helix	trans	-60.6	-40	173	-59.8	-161.6	101.6	0	0	111.5	K504 L508 R977 T985 P986 L992 A993	K504-E989 IonicContact NZ-OE1 3.86Å; K504-E989 PolarHBondContact NZ-OE1 3.07Å; L508-E989 HydrophobicContact CD1-CB 4.12Å; R977-E989 IonicContact CZ-OE1 2.62Å; R977-E989 IonicContact CZ-OE2 3.88Å; R977-E989 IonicContact NH1-OE1 3.53Å; R977-E989 PolarHBondContact NH1-OE1 3.09Å; R977-E989 IonicContact NH1-OE2 2.66Å; R977-E989 PolarHBondContact NH1-OE2 2.93Å; R977-E989 IonicContact NH2-OE1 3.93Å; R977-E989 PolarHBondContact NH2-OE1 3.19Å; R977-E989 IonicContact NH2-OE2 2.71Å; R977-E989 PolarHBondContact NH2-OE2 2.84Å; T985-E989 PolarHBondContact O-N 3.48Å; P986-E989 PolarHBondContact O-N 3.49Å; E989-L992 PolarHBondContact O-N 3.32Å; E989-A993 WeakPolarHBondContact O-CB 3.25Å; E989-A993 PolarHBondContact O-N 3.15Å
990	G	81.4	Confident	81.6	Confident	33 Å²	33	43 Å²	43	34%	0.34	24%	0.238	S	C	.	.	H	α-helix	trans	-62.4	-48.1	173.3	0	0	0	0	0	113.5	P986 E987 L988 L992 A993 E994	P986-G990 PolarHBondContact O-N 2.79Å; E987-G990 PolarHBondContact O-N 2.79Å; L988-G990 VanDerWaalsContact C-N 3.3Å; L988-G990 PolarHBondContact O-N 3.06Å; G990-L992 VanDerWaalsContact C-N 3.25Å; G990-L992 PolarHBondContact O-N 3.31Å; G990-A993 WeakPolarHBondContact O-CB 3.24Å; G990-A993 PolarHBondContact O-N 2.93Å; G990-A993 VanDerWaalsContact O-N 3.09Å; G990-E994 PolarHBondContact O-N 3.03Å; G990-E994 VanDerWaalsContact O-N 3.17Å
991	L	84.4	Confident	81.3	Confident	47 Å²	47	43.4 Å²	43.4	25%	0.246	24%	0.242	C	C	.	.	H	α-helix	trans	-60.6	-34.9	175.9	-72.3	168.2	0	0	0	112.7	T728 E987 L988	T728-L991 HydrophobicContact CG2-CD1 3.88Å; E987-L991 WeakPolarHBondContact O-CG 3.35Å; E987-L991 PolarHBondContact O-N 3.36Å; L988-L991 PolarHBondContact O-N 3.36Å
992	L	83.8	Confident	81.2	Confident	7 Å²	7	49.7 Å²	49.7	4%	0.037	27%	0.266	C	S	.	.	H	α-helix	trans	-76.8	-26.7	176	-67.6	168.8	0	0	0	112.3	Y501 L988 E989 G990 N996	Y501-L992 HydrophobicContact CE1-CD1 4.14Å; L988-L992 HydrophobicContact CD1-CD1 4.24Å; L988-L992 HydrophobicContact CD1-CG 4.31Å; L988-L992 HydrophobicContact CG-CD1 3.9Å; L988-L992 HydrophobicContact CG-CG 4.42Å; L988-L992 WeakPolarHBondContact O-CB 3.46Å; L988-L992 WeakPolarHBondContact O-CD1 3.48Å; L988-L992 WeakPolarHBondContact O-CG 3.49Å; L988-L992 PolarHBondContact O-N 3.27Å; E989-L992 PolarHBondContact O-N 3.32Å; G990-L992 VanDerWaalsContact C-N 3.25Å; G990-L992 PolarHBondContact O-N 3.31Å; L992-N996 WeakPolarHBondContact O-CA 3.46Å; L992-N996 PolarHBondContact O-N 2.86Å
993	A	79.2	Confident	81.5	Confident	34 Å²	34	50.8 Å²	50.8	28%	0.281	27%	0.273	S	S	.	.	H	α-helix	trans	-71.3	-29.3	172.8	0	0	0	0	0	113	A505 E989 G990	A505-A993 HydrophobicContact CB-CB 3.79Å; E989-A993 WeakPolarHBondContact O-CB 3.25Å; E989-A993 PolarHBondContact O-N 3.15Å; G990-A993 WeakPolarHBondContact O-CB 3.24Å; G990-A993 PolarHBondContact O-N 2.93Å; G990-A993 VanDerWaalsContact O-N 3.09Å
994	E	79.1	Confident	82.2	Confident	142 Å²	142	53.3 Å²	53.3	66%	0.664	29%	0.288	S	S	*	.	H	α-helix	trans	-73.7	-45.3	176.3	-69	-172.2	159.4	0	0	113.3	G990	G990-E994 PolarHBondContact O-N 3.03Å; G990-E994 VanDerWaalsContact O-N 3.17Å
995	E	70	Confident	82.5	Confident	106 Å²	106	58.2 Å²	58.2	50%	0.495	32%	0.319	S	S	.	.	H	α-helix	trans	-134.5	1	-168.3	-62.9	-166.3	167.3	0	0	115.6	A997 R999	E995-A997 PolarHBondContact O-N 2.96Å; E995-R999 VanDerWaalsContact CD-CZ 3.41Å; E995-R999 IonicContact OE1-CZ 2.7Å; E995-R999 IonicContact OE1-NE 3.81Å; E995-R999 IonicContact OE1-NH2 3.3Å; E995-R999 PolarHBondContact OE1-NH2 2.8Å; E995-R999 IonicContact OE2-CZ 3.48Å; E995-R999 IonicContact OE2-NE 2.92Å; E995-R999 PolarHBondContact OE2-NE 2.85Å; E995-R999 IonicContact OE2-NH2 3.28Å; E995-R999 PolarHBondContact OE2-NH2 2.79Å
996	N	80.7	Confident	82.5	Confident	76 Å²	76	63.9 Å²	63.9	41%	0.406	34%	0.343	S	S	.	.	S	Bend	trans	51.5	15.2	-177.1	-158.9	15	0	0	0	116.4	R774 L992	R774-N996 PolarHBondContact NH1-O 3.4Å; R774-N996 PolarHBondContact NH1-OD1 3.43Å; L992-N996 WeakPolarHBondContact O-CA 3.46Å; L992-N996 PolarHBondContact O-N 2.86Å
997	A	82.6	Confident	82.6	Confident	40 Å²	40	61.5 Å²	61.5	33%	0.331	33%	0.327	S	S	.	.	S	Bend	trans	-133.8	146.1	-173.7	0	0	0	0	0	112.4	E995 R999	E995-A997 PolarHBondContact O-N 2.96Å; A997-R999 PolarHBondContact O-N 2.9Å
998	L	84.9	Confident	82.8	Confident	13 Å²	13	58.4 Å²	58.4	7%	0.068	31%	0.314	C	S	.	.			trans	-75.8	113	175.5	-82	167.4	0	0	0	110.7	D726 W733 M778 F812 L988	D726-L998 HydrophobicContact CB-CD2 4.21Å; W733-L998 PolarHBondContact NE1-O 3.33Å; M778-L998 HydrophobicContact CE-CD1 4.26Å; F812-L998 HydrophobicContact CE1-CD1 3.68Å; F812-L998 HydrophobicContact CE2-CD1 4.39Å; F812-L998 HydrophobicContact CZ-CD1 3.47Å; F812-L998 VanDerWaalsContact CZ-CD1 3.47Å; L988-L998 HydrophobicContact CD1-CD2 3.89Å
999	R	86.1	Confident	82.7	Confident	107 Å²	107	61.1 Å²	61.1	40%	0.404	34%	0.337	S	S	.	.	P	Polyproline II helix	trans	-81.6	133	176.2	-72.6	172.8	148.4	-169	-12.6	110.9	D726 S727 E995 A997	D726-R999 CarbonylContact C-O 3.09Å; D726-R999 WeakPolarHBondContact CA-O 3.18Å; S727-R999 PolarHBondContact N-O 3.29Å; E995-R999 VanDerWaalsContact CD-CZ 3.41Å; E995-R999 IonicContact OE1-CZ 2.7Å; E995-R999 IonicContact OE1-NE 3.81Å; E995-R999 IonicContact OE1-NH2 3.3Å; E995-R999 PolarHBondContact OE1-NH2 2.8Å; E995-R999 IonicContact OE2-CZ 3.48Å; E995-R999 IonicContact OE2-NE 2.92Å; E995-R999 PolarHBondContact OE2-NE 2.85Å; E995-R999 IonicContact OE2-NH2 3.28Å; E995-R999 PolarHBondContact OE2-NH2 2.79Å; A997-R999 PolarHBondContact O-N 2.9Å
1000	G	84.8	Confident	82.8	Confident	10 Å²	10	63.4 Å²	63.4	10%	0.103	35%	0.35	C	S	.	.	B	Isolated β-bridge	trans	-76.6	128.5	176.4	0	0	0	0	0	112.6	K723 W733	K723-G1000 WeakPolarHBondContact CD-O 3.4Å; K723-G1000 WeakPolarHBondContact CE-O 3.49Å; K723-G1000 PolarHBondContact NZ-O 2.98Å; W733-G1000 VanDerWaalsContact CD2-CA 3.41Å
1001	G	84.1	Confident	83	Confident	9 Å²	9	62.8 Å²	62.8	9%	0.093	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-94.3	172.2	178.3	0	0	0	0	0	114	K723 Y725 D726	K723-G1001 WeakPolarHBondContact CB-O 3.33Å; K723-G1001 VanDerWaalsContact CG-O 3.26Å; K723-G1001 WeakPolarHBondContact CG-O 3.36Å; Y725-G1001 PolarHBondContact O-N 3.16Å; D726-G1001 VanDerWaalsContact C-N 3.29Å; D726-G1001 WeakPolarHBondContact O-CA 3.42Å; D726-G1001 PolarHBondContact O-N 3.21Å
1002	Y	84.8	Confident	83	Confident	142 Å²	142	64.1 Å²	64.1	56%	0.557	35%	0.345	S	S	*	.	P	Polyproline II helix	trans	-99.5	139.3	163.9	-70	-73.9	0	0	0	109	K723 T1004	K723-Y1002 HydrophobicContact CG-CD1 4.27Å; K723-Y1002 HydrophobicContact CG-CE1 4.17Å; Y1002-T1004 PolarHBondContact O-N 3.35Å
1003	S	84.3	Confident	83.2	Confident	30 Å²	30	66.4 Å²	66.4	21%	0.21	35%	0.352	C	S	.	.			trans	-70.9	86.6	-177.1	-50.4	0	0	0	0	112
1004	T	86.3	Confident	83.6	Confident	55 Å²	55	65.6 Å²	65.6	34%	0.337	35%	0.345	S	S	.	.			trans	-81.4	160	169.6	81.7	0	0	0	0	110.9	Y1002 Q1006 T1007 L1008	Y1002-T1004 PolarHBondContact O-N 3.35Å; T1004-Q1006 PolarHBondContact O-N 3.38Å; T1004-Q1006 PolarHBondContact OG1-N 3.46Å; T1004-T1007 WeakPolarHBondContact O-CB 3.45Å; T1004-T1007 PolarHBondContact O-N 2.84Å; T1004-T1007 WeakPolarHBondContact OG1-CB 3.17Å; T1004-T1007 PolarHBondContact OG1-N 3.48Å; T1004-T1007 PolarHBondContact OG1-OG1 2.96Å; T1004-L1008 WeakPolarHBondContact O-CG 3.43Å; T1004-L1008 PolarHBondContact O-N 2.8Å
1005	P	83.8	Confident	84.1	Confident	113 Å²	113	60.7 Å²	60.7	73%	0.734	32%	0.32	S	S	*	.	H	α-helix	trans	-57.7	-31.8	173.6	-26.4	36.1	0	0	0	113.8	A1009	P1005-A1009 PolarHBondContact O-N 3.04Å; P1005-A1009 VanDerWaalsContact O-N 3.08Å
1006	Q	81.6	Confident	85.1	Confident	158 Å²	158	56 Å²	56	74%	0.738	30%	0.298	S	S	*	.	H	α-helix	trans	-70.6	-48	175.2	-66.9	171.9	-46.7	0	0	110.9	T1004 L1008 A1009 N1010	T1004-Q1006 PolarHBondContact O-N 3.38Å; T1004-Q1006 PolarHBondContact OG1-N 3.46Å; Q1006-L1008 PolarHBondContact O-N 3.47Å; Q1006-A1009 PolarHBondContact O-N 2.86Å; Q1006-A1009 VanDerWaalsContact O-N 3.07Å; Q1006-N1010 PolarHBondContact O-N 3.31Å
1007	T	83.4	Confident	85.6	Confident	17 Å²	17	53.2 Å²	53.2	10%	0.104	29%	0.286	C	S	.	.	H	α-helix	trans	-56.7	-32.7	174.3	-47.7	0	0	0	0	112.3	G729 T1004	G729-T1007 VanDerWaalsContact CA-CG2 3.4Å; T1004-T1007 WeakPolarHBondContact O-CB 3.45Å; T1004-T1007 PolarHBondContact O-N 2.84Å; T1004-T1007 WeakPolarHBondContact OG1-CB 3.17Å; T1004-T1007 PolarHBondContact OG1-N 3.48Å; T1004-T1007 PolarHBondContact OG1-OG1 2.96Å
1008	L	84.8	Confident	86	Confident	64 Å²	64	53.7 Å²	53.7	34%	0.335	28%	0.282	S	S	.	.	H	α-helix	trans	-80.3	-30.7	176.6	-69.5	172.8	0	0	0	113.3	Y725 T1004 Q1006 N1010 R1011	Y725-L1008 HydrophobicContact CE2-CD2 4.05Å; T1004-L1008 WeakPolarHBondContact O-CG 3.43Å; T1004-L1008 PolarHBondContact O-N 2.8Å; Q1006-L1008 PolarHBondContact O-N 3.47Å; L1008-N1010 VanDerWaalsContact C-N 3.29Å; L1008-N1010 PolarHBondContact O-N 2.88Å; L1008-R1011 VanDerWaalsContact O-CB 3.24Å; L1008-R1011 WeakPolarHBondContact O-CB 3.33Å; L1008-R1011 VanDerWaalsContact O-CG 3.25Å; L1008-R1011 WeakPolarHBondContact O-CG 3.33Å; L1008-R1011 PolarHBondContact O-N 3.42Å
1009	A	83.9	Confident	86.3	Confident	59 Å²	59	54.7 Å²	54.7	49%	0.488	29%	0.287	S	S	.	.	H	α-helix	trans	-67.7	-29.2	174.5	0	0	0	0	0	112.5	P1005 Q1006 R1011 D1012	P1005-A1009 PolarHBondContact O-N 3.04Å; P1005-A1009 VanDerWaalsContact O-N 3.08Å; Q1006-A1009 PolarHBondContact O-N 2.86Å; Q1006-A1009 VanDerWaalsContact O-N 3.07Å; A1009-R1011 PolarHBondContact O-N 3.32Å; A1009-D1012 PolarHBondContact O-N 3.24Å; A1009-D1012 VanDerWaalsContact O-N 3.1Å
1010	N	84.5	Confident	86.6	Confident	69 Å²	69	50.8 Å²	50.8	37%	0.369	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-6.1	172.5	-69.9	-5.3	0	0	0	113.9	T728 M730 Q1006 L1008 R1013	T728-N1010 PolarHBondContact O-ND2 3.01Å; M730-N1010 HydrophobicContact SD-CB 3.92Å; Q1006-N1010 PolarHBondContact O-N 3.31Å; L1008-N1010 VanDerWaalsContact C-N 3.29Å; L1008-N1010 PolarHBondContact O-N 2.88Å; N1010-R1013 WeakPolarHBondContact O-CD 3.45Å; N1010-R1013 PolarHBondContact O-NE 3.19Å
1011	R	85.9	Confident	86.8	Confident	20 Å²	20	50.4 Å²	50.4	8%	0.075	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-15.1	176.6	-54.5	-177.9	56.2	-115.2	-8.6	113.5	Y725 S783 L1008 A1009 R1013 F1094	Y725-R1011 PolarHBondContact OH-NE 3.37Å; S783-R1011 VanDerWaalsContact O-CZ 3.24Å; S783-R1011 PolarHBondContact O-NE 2.81Å; S783-R1011 PolarHBondContact O-NH2 3.33Å; L1008-R1011 VanDerWaalsContact O-CB 3.24Å; L1008-R1011 WeakPolarHBondContact O-CB 3.33Å; L1008-R1011 VanDerWaalsContact O-CG 3.25Å; L1008-R1011 WeakPolarHBondContact O-CG 3.33Å; L1008-R1011 PolarHBondContact O-N 3.42Å; A1009-R1011 PolarHBondContact O-N 3.32Å; R1011-R1013 PolarHBondContact O-N 3.33Å; R1011-F1094 VanDerWaalsContact NH2-CE2 3.34Å
1012	D	83.6	Confident	86.8	Confident	76 Å²	76	57.8 Å²	57.8	41%	0.406	30%	0.299	S	S	.	.			trans	-80.7	54.1	-172.9	-70.1	19.4	0	0	0	111.5	A1009 H1096	A1009-D1012 PolarHBondContact O-N 3.24Å; A1009-D1012 VanDerWaalsContact O-N 3.1Å; D1012-H1096 IonicContact OD1-CE1 3.75Å; D1012-H1096 PolarHBondContact OD1-CE1 3.13Å; D1012-H1096 IonicContact OD1-NE2 3.18Å; D1012-H1096 PolarHBondContact OD1-NE2 3.08Å; D1012-H1096 IonicContact OD2-CD2 2.71Å; D1012-H1096 IonicContact OD2-CE1 3.22Å; D1012-H1096 IonicContact OD2-NE2 2.89Å; D1012-H1096 PolarHBondContact OD2-NE2 3.31Å
1013	R	88.1	Confident	86.5	Confident	54 Å²	54	56.7 Å²	56.7	20%	0.204	30%	0.303	C	S	.	.			trans	-117.5	144.6	-177	-62.9	177.5	-67.8	116.1	-11.5	109.2	M730 S783 N784 G982 N1010 R1011	M730-R1013 VanDerWaalsContact CE-CZ 3.41Å; M730-R1013 VanDerWaalsContact CE-NE 3.33Å; M730-R1013 PolarHBondContact O-NH2 2.76Å; S783-R1013 PolarHBondContact OG-NH2 2.81Å; N784-R1013 WeakPolarHBondContact CB-O 3.46Å; G982-R1013 PolarHBondContact O-NH1 3Å; G982-R1013 PolarHBondContact O-NH2 3.16Å; N1010-R1013 WeakPolarHBondContact O-CD 3.45Å; N1010-R1013 PolarHBondContact O-NE 3.19Å; R1011-R1013 PolarHBondContact O-N 3.33Å
1014	C	88.4	Confident	86.4	Confident	17 Å²	17	57.3 Å²	57.3	12%	0.115	31%	0.314	C	S	.	.			trans	-59.2	155	176.1	-75.1	0	0	0	0	112.5	N620 N784 L1091 M1092 Q1093	N620-C1014 PolarHBondContact O-SG 2.77Å; N784-C1014 PolarHBondContact ND2-O 2.95Å; C1014-L1091 HydrophobicContact CB-CB 4.2Å; C1014-L1091 HydrophobicContact CB-CD2 4.39Å; C1014-M1092 CarbonylContact C-O 3.54Å; C1014-M1092 WeakPolarHBondContact CA-O 3.44Å; C1014-Q1093 PolarHBondContact SG-NE2 2.7Å
1015	R	88.5	Confident	86.3	Confident	39 Å²	39	57.8 Å²	57.8	15%	0.147	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	143.3	170.8	67.8	-166.3	-167.2	175.9	9.7	109.7	N784 F785 E789 M1092	N784-R1015 PolarHBondContact O-NH1 3Å; F785-R1015 HydrophobicContact CE1-CB 4.42Å; F785-R1015 HydrophobicContact CZ-CB 4.04Å; E789-R1015 IonicContact OE1-CZ 3.78Å; E789-R1015 VanDerWaalsContact OE1-CZ 3.29Å; E789-R1015 IonicContact OE1-NH1 3.97Å; E789-R1015 PolarHBondContact OE1-NH1 3.39Å; E789-R1015 IonicContact OE1-NH2 3.41Å; E789-R1015 PolarHBondContact OE1-NH2 3.42Å; E789-R1015 IonicContact OE2-CZ 2.78Å; E789-R1015 IonicContact OE2-NH1 2.7Å; E789-R1015 PolarHBondContact OE2-NH1 3Å; E789-R1015 IonicContact OE2-NH2 3.98Å; R1015-M1092 HydrophobicContact CG-CB 4.03Å; R1015-M1092 PolarHBondContact N-O 3.21Å; R1015-M1092 PolarHBondContact O-N 3.22Å
1016	V	91.7	Very high	86.5	Confident	7 Å²	7	52.8 Å²	52.8	4%	0.042	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	136	172.9	-173.3	0	0	0	0	108.9	A538 L541 L979 F1051 L1091	A538-V1016 HydrophobicContact CB-CG1 3.91Å; L541-V1016 HydrophobicContact CD1-CG1 3.91Å; L541-V1016 HydrophobicContact CD2-CB 4.3Å; L541-V1016 HydrophobicContact CD2-CG1 3.85Å; L541-V1016 HydrophobicContact CD2-CG2 4.06Å; L541-V1016 HydrophobicContact CG-CG1 4.47Å; L979-V1016 HydrophobicContact CD1-CG2 3.85Å; V1016-F1051 HydrophobicContact CG1-CZ 4.03Å; V1016-L1091 HydrophobicContact CG2-CD2 3.9Å
1017	A	91.2	Very high	86.7	Confident	18 Å²	18	47 Å²	47	15%	0.149	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.2	161.4	173.9	0	0	0	0	0	111.1	C1090 M1092	A1017-C1090 PolarHBondContact N-O 2.73Å; A1017-C1090 PolarHBondContact O-N 3.3Å; A1017-C1090 PolarHBondContact O-SG 2.76Å; A1017-M1092 HydrophobicContact CB-CG 3.91Å; A1017-M1092 HydrophobicContact CB-SD 3.57Å; A1017-M1092 VanDerWaalsContact CB-SD 3.57Å
1018	Q	92.2	Very high	86.8	Confident	51 Å²	51	51.6 Å²	51.6	24%	0.238	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	135.6	167.3	-82.7	166.1	-27.9	0	0	110.3	A538 Q539 I1088 F1089	A538-Q1018 HydrophobicContact CB-CG 3.86Å; Q539-Q1018 VanDerWaalsContact N-OE1 3.16Å; Q539-Q1018 PolarHBondContact O-NE2 3.12Å; Q1018-I1088 WeakPolarHBondContact CA-O 3.48Å; Q1018-F1089 HydrophobicContact CG-CD1 4.07Å; Q1018-F1089 HydrophobicContact CG-CE1 4.24Å
1019	L	91.2	Very high	86.8	Confident	33 Å²	33	49.7 Å²	49.7	17%	0.173	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	132.1	171.4	-61.8	172.7	0	0	0	109.1	F1026 M1048 L1087 I1088 C1090	L1019-F1026 HydrophobicContact CD1-CE2 4.14Å; L1019-M1048 HydrophobicContact CD1-CE 3.7Å; L1019-M1048 HydrophobicContact CD1-SD 4.15Å; L1019-L1087 CarbonylContact O-C 3.16Å; L1019-L1087 WeakPolarHBondContact O-CA 3.27Å; L1019-I1088 PolarHBondContact N-O 3.42Å; L1019-I1088 PolarHBondContact O-N 2.7Å; L1019-C1090 HydrophobicContact CD1-CB 4.27Å
1020	A	91.6	Very high	86.6	Confident	26 Å²	26	46.9 Å²	46.9	22%	0.215	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	143.4	169.5	0	0	0	0	0	110.7	Y1022 L1087	A1020-Y1022 HydrophobicContact CB-CD1 3.89Å; A1020-Y1022 HydrophobicContact CB-CE1 3.52Å; A1020-Y1022 HydrophobicContact CB-CE2 4.36Å; A1020-Y1022 HydrophobicContact CB-CG 4.46Å; A1020-L1087 HydrophobicContact CB-CD2 3.67Å
1021	L	88.6	Confident	86.5	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.005	27%	0.272	C	S	.	.	S	Bend	trans	-87.3	-20.3	173.2	-66.7	-171.9	0	0	0	114	D1023 F1026 A1027 L1038 L1082 P1084 D1086 I1088	L1021-D1023 PolarHBondContact O-N 2.92Å; L1021-F1026 HydrophobicContact CD2-CB 4.01Å; L1021-A1027 WeakPolarHBondContact O-CA 3.25Å; L1021-A1027 VanDerWaalsContact O-CB 3.3Å; L1021-A1027 WeakPolarHBondContact O-CB 3.41Å; L1021-L1038 HydrophobicContact CD2-CD1 4.35Å; L1021-L1038 HydrophobicContact CD2-CD2 4.1Å; L1021-L1082 HydrophobicContact CD1-CB 4.15Å; L1021-L1082 HydrophobicContact CD1-CD1 4.1Å; L1021-L1082 HydrophobicContact CD1-CD2 4.17Å; L1021-L1082 HydrophobicContact CD1-CG 4.38Å; L1021-P1084 CarbonylContact C-O 3.56Å; L1021-D1086 HydrophobicContact CD1-CB 4.18Å; L1021-D1086 PolarHBondContact N-O 2.72Å; L1021-I1088 HydrophobicContact CD1-CD1 4.16Å; L1021-I1088 HydrophobicContact CD1-CG1 4.2Å; L1021-I1088 HydrophobicContact CD2-CG1 3.91Å; L1021-I1088 HydrophobicContact CG-CD1 4.42Å; L1021-I1088 HydrophobicContact CG-CG1 3.93Å
1022	Y	83.8	Confident	86.2	Confident	165 Å²	165	51.2 Å²	51.2	65%	0.647	29%	0.289	S	S	*	.	S	Bend	trans	-73.5	-4.3	-179	63.4	-103.5	0	0	0	114.9	A1020 P1084	A1020-Y1022 HydrophobicContact CB-CD1 3.89Å; A1020-Y1022 HydrophobicContact CB-CE1 3.52Å; A1020-Y1022 HydrophobicContact CB-CE2 4.36Å; A1020-Y1022 HydrophobicContact CB-CG 4.46Å; Y1022-P1084 WeakPolarHBondContact CB-O 3.48Å; Y1022-P1084 PolarHBondContact N-O 3.21Å; Y1022-P1084 VanDerWaalsContact N-O 3.14Å
1023	D	78.9	Confident	86.5	Confident	119 Å²	119	48.3 Å²	48.3	64%	0.636	28%	0.278	S	S	*	.	S	Bend	trans	-146.6	159.1	179.5	-170.2	14.2	0	0	0	110.6	L1021	L1021-D1023 PolarHBondContact O-N 2.92Å
1024	G	82.4	Confident	86.7	Confident	42 Å²	42	47.5 Å²	47.5	43%	0.433	28%	0.28	S	S	.	.	S	Bend	trans	81.4	-164.6	175.9	0	0	0	0	0	115.6	F1026 A1027	G1024-F1026 PolarHBondContact O-N 2.9Å; G1024-A1027 PolarHBondContact O-N 2.95Å
1025	P	83.6	Confident	87	Confident	66 Å²	66	46.8 Å²	46.8	43%	0.429	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	9.6	-164.5	33.8	-38	0	0	0	115	K1041 Y1046	P1025-K1041 PolarHBondContact O-NZ 3.42Å; P1025-Y1046 WeakPolarHBondContact CB-OH 3.44Å; P1025-Y1046 HydrophobicContact CG-CE2 4.19Å; P1025-Y1046 WeakPolarHBondContact CG-OH 3.39Å
1026	F	88.1	Confident	87.3	Confident	8 Å²	8	44.9 Å²	44.9	4%	0.035	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	0.8	-178.8	-54.4	-64.6	0	0	0	113.5	L1019 L1021 G1024 D1028 L1029 G1030 L1038 K1041 A1042 Y1046 M1048	L1019-F1026 HydrophobicContact CD1-CE2 4.14Å; L1021-F1026 HydrophobicContact CD2-CB 4.01Å; G1024-F1026 PolarHBondContact O-N 2.9Å; F1026-D1028 WeakPolarHBondContact CA-OD1 3.46Å; F1026-D1028 PolarHBondContact O-N 3.01Å; F1026-L1029 WeakPolarHBondContact O-CB 3.35Å; F1026-L1029 PolarHBondContact O-N 3.34Å; F1026-G1030 PolarHBondContact O-N 2.85Å; F1026-L1038 HydrophobicContact CB-CD1 3.78Å; F1026-L1038 HydrophobicContact CD1-CD1 3.51Å; F1026-L1038 HydrophobicContact CD2-CD1 4.44Å; F1026-L1038 HydrophobicContact CE1-CD1 4.19Å; F1026-L1038 HydrophobicContact CG-CD1 3.66Å; F1026-K1041 HydrophobicContact CD1-CD 4.06Å; F1026-K1041 HydrophobicContact CE1-CB 4.46Å; F1026-K1041 HydrophobicContact CE1-CD 4.22Å; F1026-K1041 HydrophobicContact CE1-CG 4.17Å; F1026-A1042 HydrophobicContact CE1-CB 4.01Å; F1026-A1042 HydrophobicContact CZ-CB 3.85Å; F1026-Y1046 HydrophobicContact CE1-CD2 4.43Å; F1026-Y1046 HydrophobicContact CE1-CE2 4.22Å; F1026-Y1046 HydrophobicContact CE2-CE2 4.45Å; F1026-Y1046 AromaticContact CZ-CD2 3.71Å; F1026-Y1046 HydrophobicContact CZ-CD2 3.71Å; F1026-Y1046 AromaticContact CZ-CE2 3.69Å; F1026-Y1046 HydrophobicContact CZ-CE2 3.69Å; F1026-M1048 HydrophobicContact CE2-CE 3.7Å; F1026-M1048 HydrophobicContact CZ-CE 3.79Å
1027	A	86.3	Confident	87.3	Confident	35 Å²	35	48.1 Å²	48.1	29%	0.289	28%	0.284	S	S	.	.	H	α-helix	trans	-62.4	-26.6	177.6	0	0	0	0	0	112.9	L1021 G1024 L1029 G1030	L1021-A1027 WeakPolarHBondContact O-CA 3.25Å; L1021-A1027 VanDerWaalsContact O-CB 3.3Å; L1021-A1027 WeakPolarHBondContact O-CB 3.41Å; G1024-A1027 PolarHBondContact O-N 2.95Å; A1027-L1029 PolarHBondContact O-N 2.86Å; A1027-G1030 PolarHBondContact O-N 3.11Å; A1027-G1030 VanDerWaalsContact O-N 3.11Å
1028	D	85.7	Confident	87.5	Confident	115 Å²	115	47.4 Å²	47.4	62%	0.615	28%	0.278	S	S	*	.	H	α-helix	trans	-65.3	-13	171	63.6	-25.7	0	0	0	114.6	F1026 K1041	F1026-D1028 WeakPolarHBondContact CA-OD1 3.46Å; F1026-D1028 PolarHBondContact O-N 3.01Å; D1028-K1041 IonicContact OD1-NZ 3.86Å; D1028-K1041 PolarHBondContact OD1-NZ 3.42Å; D1028-K1041 IonicContact OD2-NZ 2.71Å; D1028-K1041 PolarHBondContact OD2-NZ 3.07Å
1029	L	85.3	Confident	87.6	Confident	24 Å²	24	45 Å²	45	13%	0.126	27%	0.267	C	S	.	.	H	α-helix	trans	-107.2	-9.9	172.7	-73.8	158	0	0	0	112.8	F1026 A1027 G1033 D1037 L1038 K1041 L1082	F1026-L1029 WeakPolarHBondContact O-CB 3.35Å; F1026-L1029 PolarHBondContact O-N 3.34Å; A1027-L1029 PolarHBondContact O-N 2.86Å; L1029-G1033 VanDerWaalsContact O-CA 3.32Å; L1029-G1033 WeakPolarHBondContact O-CA 3.38Å; L1029-G1033 PolarHBondContact O-N 2.71Å; L1029-G1033 VanDerWaalsContact O-N 3.17Å; L1029-D1037 HydrophobicContact CD2-CB 3.92Å; L1029-L1038 HydrophobicContact CD1-CB 4.23Å; L1029-L1038 HydrophobicContact CD1-CD1 4.17Å; L1029-K1041 HydrophobicContact CD1-CB 4.44Å; L1029-K1041 HydrophobicContact CD1-CD 3.49Å; L1029-K1041 VanDerWaalsContact CD1-CD 3.49Å; L1029-L1082 HydrophobicContact CB-CD1 4.49Å
1030	G	79.9	Confident	87.7	Confident	0 Å²	0	44.1 Å²	44.1	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.9	-32.2	179.5	0	0	0	0	0	113.1	F1026 A1027 G1032 V1083 P1084	F1026-G1030 PolarHBondContact O-N 2.85Å; A1027-G1030 PolarHBondContact O-N 3.11Å; A1027-G1030 VanDerWaalsContact O-N 3.11Å; G1030-G1032 VanDerWaalsContact C-N 3.27Å; G1030-G1032 PolarHBondContact O-N 2.87Å; G1030-V1083 CarbonylContact O-C 3.53Å; G1030-P1084 WeakPolarHBondContact O-CD 3.34Å; G1030-P1084 VanDerWaalsContact O-N 3.14Å
1031	D	82.1	Confident	87.8	Confident	137 Å²	137	45.7 Å²	45.7	73%	0.733	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	65.5	-178.4	-68.2	-24.4	0	0	0	112
1032	G	79.4	Confident	88	Confident	42 Å²	42	45.7 Å²	45.7	43%	0.433	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	23.7	176	0	0	0	0	0	115	G1030 L1082	G1030-G1032 VanDerWaalsContact C-N 3.27Å; G1030-G1032 PolarHBondContact O-N 2.87Å; G1032-L1082 PolarHBondContact N-O 2.65Å
1033	G	88.8	Confident	88.4	Confident	16 Å²	16	37.9 Å²	37.9	17%	0.165	24%	0.235	C	C	.	.			trans	-77.1	163.5	173.8	0	0	0	0	0	113.3	L1029 L1082	L1029-G1033 VanDerWaalsContact O-CA 3.32Å; L1029-G1033 WeakPolarHBondContact O-CA 3.38Å; L1029-G1033 PolarHBondContact O-N 2.71Å; L1029-G1033 VanDerWaalsContact O-N 3.17Å; G1033-L1082 WeakPolarHBondContact O-CB 3.27Å; G1033-L1082 WeakPolarHBondContact O-CG 3.29Å; G1033-L1082 PolarHBondContact O-N 3.39Å
1034	C	93.9	Very high	89	Confident	37 Å²	37	37.9 Å²	37.9	25%	0.25	23%	0.229	C	C	.	.	B	Isolated β-bridge	trans	-85	138.1	176.1	-66.8	0	0	0	0	112	G1036 D1037 L1038	C1034-G1036 PolarHBondContact O-N 2.8Å; C1034-D1037 PolarHBondContact O-N 2.99Å; C1034-D1037 VanDerWaalsContact O-N 3.13Å; C1034-L1038 PolarHBondContact O-N 3.1Å
1035	Y	94.9	Very high	89.3	Confident	1 Å²	1	40 Å²	40	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-56	-35.2	175.9	-179.3	-88.7	0	0	0	112.7	Y596 D1037 L1038 F1039 F1051 G1052 I1053 P1076 F1080 L1082	Y596-Y1035 WeakPolarHBondContact OH-CD1 3.4Å; Y1035-D1037 VanDerWaalsContact C-N 3.33Å; Y1035-D1037 PolarHBondContact O-N 2.82Å; Y1035-L1038 WeakPolarHBondContact O-CB 3.44Å; Y1035-L1038 PolarHBondContact O-N 3.19Å; Y1035-F1039 HydrophobicContact CE1-CB 4.4Å; Y1035-F1039 WeakPolarHBondContact O-CB 3.43Å; Y1035-F1039 PolarHBondContact O-N 3.02Å; Y1035-F1051 PolarHBondContact OH-N 3.07Å; Y1035-G1052 PolarHBondContact OH-N 3.24Å; Y1035-I1053 HydrophobicContact CD2-CD1 3.71Å; Y1035-I1053 HydrophobicContact CD2-CG1 3.78Å; Y1035-I1053 HydrophobicContact CE2-CD1 4.17Å; Y1035-I1053 HydrophobicContact CE2-CG1 3.72Å; Y1035-P1076 HydrophobicContact CD1-CG 3.79Å; Y1035-P1076 HydrophobicContact CD2-CG 3.76Å; Y1035-P1076 HydrophobicContact CE1-CG 3.78Å; Y1035-P1076 HydrophobicContact CE2-CG 3.73Å; Y1035-P1076 HydrophobicContact CG-CG 3.78Å; Y1035-F1080 PolarHBondContact N-O 3Å; Y1035-L1082 HydrophobicContact CD2-CD2 4.08Å
1036	G	93.3	Very high	89.6	Confident	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-63.5	-34	178.3	0	0	0	0	0	114.7	C1034 C1040 Y1078	C1034-G1036 PolarHBondContact O-N 2.8Å; G1036-C1040 WeakPolarHBondContact O-CB 3.4Å; G1036-C1040 PolarHBondContact O-N 3.36Å; G1036-C1040 VanDerWaalsContact O-N 3.09Å; G1036-C1040 PolarHBondContact O-SG 2.74Å; G1036-Y1078 VanDerWaalsContact CA-CD2 3.46Å; G1036-Y1078 VanDerWaalsContact CA-CE2 3.43Å; G1036-Y1078 PolarHBondContact N-O 3.42Å
1037	D	93.2	Very high	89.8	Confident	74 Å²	74	43 Å²	43	40%	0.396	24%	0.24	S	C	.	.	H	α-helix	trans	-72.4	-41	175.1	-71.3	-40.9	0	0	0	111.2	L1029 C1034 Y1035 C1040 K1041 Y1078	L1029-D1037 HydrophobicContact CD2-CB 3.92Å; C1034-D1037 PolarHBondContact O-N 2.99Å; C1034-D1037 VanDerWaalsContact O-N 3.13Å; Y1035-D1037 VanDerWaalsContact C-N 3.33Å; Y1035-D1037 PolarHBondContact O-N 2.82Å; D1037-C1040 PolarHBondContact O-N 2.84Å; D1037-K1041 WeakPolarHBondContact O-CB 3.5Å; D1037-K1041 PolarHBondContact O-N 3.06Å; D1037-Y1078 PolarHBondContact OD1-OH 2.97Å
1038	L	93.8	Very high	90.1	Very high	3 Å²	3	42.1 Å²	42.1	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-58.1	-49.9	172.2	174.5	66.5	0	0	0	111.5	L1021 F1026 L1029 C1034 Y1035 C1040 K1041 A1042 L1082 I1088	L1021-L1038 HydrophobicContact CD2-CD1 4.35Å; L1021-L1038 HydrophobicContact CD2-CD2 4.1Å; F1026-L1038 HydrophobicContact CB-CD1 3.78Å; F1026-L1038 HydrophobicContact CD1-CD1 3.51Å; F1026-L1038 HydrophobicContact CD2-CD1 4.44Å; F1026-L1038 HydrophobicContact CE1-CD1 4.19Å; F1026-L1038 HydrophobicContact CG-CD1 3.66Å; L1029-L1038 HydrophobicContact CD1-CB 4.23Å; L1029-L1038 HydrophobicContact CD1-CD1 4.17Å; C1034-L1038 PolarHBondContact O-N 3.1Å; Y1035-L1038 WeakPolarHBondContact O-CB 3.44Å; Y1035-L1038 PolarHBondContact O-N 3.19Å; L1038-C1040 VanDerWaalsContact C-N 3.33Å; L1038-C1040 PolarHBondContact O-N 2.88Å; L1038-K1041 PolarHBondContact O-N 3.34Å; L1038-A1042 VanDerWaalsContact O-CB 3.3Å; L1038-A1042 WeakPolarHBondContact O-CB 3.27Å; L1038-A1042 PolarHBondContact O-N 3.43Å; L1038-L1082 HydrophobicContact CB-CD1 3.98Å; L1038-L1082 HydrophobicContact CD2-CD1 3.82Å; L1038-L1082 HydrophobicContact CD2-CD2 4.41Å; L1038-L1082 HydrophobicContact CG-CD1 4.49Å; L1038-I1088 HydrophobicContact CD2-CD1 4.01Å; L1038-I1088 HydrophobicContact CD2-CG1 3.92Å; L1038-I1088 HydrophobicContact CD2-CG2 4.28Å
1039	F	94.9	Very high	90.5	Very high	1 Å²	1	36.6 Å²	36.6	0%	0.004	20%	0.2	C	C	.	.	H	α-helix	trans	-54.1	-49.6	175.9	176.7	-88	0	0	0	111	Y596 L602 Y1035 K1041 L1043 L1049 C1050	Y596-F1039 AromaticContact CD1-CD1 3.64Å; Y596-F1039 HydrophobicContact CD1-CD1 3.64Å; Y596-F1039 AromaticContact CD1-CE1 3.89Å; Y596-F1039 HydrophobicContact CD1-CE1 3.89Å; Y596-F1039 HydrophobicContact CD1-CG 4.09Å; Y596-F1039 HydrophobicContact CD2-CZ 4.42Å; Y596-F1039 HydrophobicContact CE1-CB 4.41Å; Y596-F1039 HydrophobicContact CE1-CD1 4.25Å; Y596-F1039 HydrophobicContact CE1-CG 4.26Å; Y596-F1039 AromaticContact CG-CD1 4Å; Y596-F1039 HydrophobicContact CG-CD1 4Å; Y596-F1039 AromaticContact CG-CE1 3.76Å; Y596-F1039 HydrophobicContact CG-CE1 3.76Å; Y596-F1039 HydrophobicContact CG-CE2 4.48Å; Y596-F1039 HydrophobicContact CG-CG 4.46Å; Y596-F1039 HydrophobicContact CG-CZ 4.02Å; L602-F1039 HydrophobicContact CD1-CE2 3.62Å; L602-F1039 HydrophobicContact CD1-CZ 4.11Å; Y1035-F1039 HydrophobicContact CE1-CB 4.4Å; Y1035-F1039 WeakPolarHBondContact O-CB 3.43Å; Y1035-F1039 PolarHBondContact O-N 3.02Å; F1039-K1041 PolarHBondContact O-N 2.92Å; F1039-L1043 HydrophobicContact CE1-CD2 3.79Å; F1039-L1043 HydrophobicContact CZ-CD2 3.98Å; F1039-L1043 WeakPolarHBondContact O-CB 3.45Å; F1039-L1043 PolarHBondContact O-N 3.43Å; F1039-L1049 HydrophobicContact CE2-CD1 3.55Å; F1039-L1049 HydrophobicContact CE2-CG 4.24Å; F1039-L1049 HydrophobicContact CZ-CD1 3.62Å; F1039-C1050 HydrophobicContact CD2-CB 4.17Å; F1039-C1050 WeakPolarHBondContact CD2-O 3.18Å; F1039-C1050 WeakPolarHBondContact CE2-O 3.46Å
1040	C	93.8	Very high	90.9	Very high	14 Å²	14	35.5 Å²	35.5	10%	0.095	19%	0.194	C	C	.	.	H	α-helix	trans	-64.6	-40.5	-179.9	-69	0	0	0	0	112.9	G1036 D1037 L1038 K1044	G1036-C1040 WeakPolarHBondContact O-CB 3.4Å; G1036-C1040 PolarHBondContact O-N 3.36Å; G1036-C1040 VanDerWaalsContact O-N 3.09Å; G1036-C1040 PolarHBondContact O-SG 2.74Å; D1037-C1040 PolarHBondContact O-N 2.84Å; L1038-C1040 VanDerWaalsContact C-N 3.33Å; L1038-C1040 PolarHBondContact O-N 2.88Å; C1040-K1044 VanDerWaalsContact O-CB 3.3Å; C1040-K1044 WeakPolarHBondContact O-CB 3.28Å; C1040-K1044 VanDerWaalsContact O-CG 3.26Å; C1040-K1044 WeakPolarHBondContact O-CG 3.29Å; C1040-K1044 PolarHBondContact O-N 3.42Å; C1040-K1044 VanDerWaalsContact O-N 3.08Å
1041	K	92.8	Very high	91.5	Very high	60 Å²	60	35.9 Å²	35.9	26%	0.261	20%	0.196	S	C	.	.	H	α-helix	trans	-68.5	-46.9	178.7	-168.8	-176.4	-178.2	-164.2	0	111.4	P1025 F1026 D1028 L1029 D1037 L1038 F1039 T1045	P1025-K1041 PolarHBondContact O-NZ 3.42Å; F1026-K1041 HydrophobicContact CD1-CD 4.06Å; F1026-K1041 HydrophobicContact CE1-CB 4.46Å; F1026-K1041 HydrophobicContact CE1-CD 4.22Å; F1026-K1041 HydrophobicContact CE1-CG 4.17Å; D1028-K1041 IonicContact OD1-NZ 3.86Å; D1028-K1041 PolarHBondContact OD1-NZ 3.42Å; D1028-K1041 IonicContact OD2-NZ 2.71Å; D1028-K1041 PolarHBondContact OD2-NZ 3.07Å; L1029-K1041 HydrophobicContact CD1-CB 4.44Å; L1029-K1041 HydrophobicContact CD1-CD 3.49Å; L1029-K1041 VanDerWaalsContact CD1-CD 3.49Å; D1037-K1041 WeakPolarHBondContact O-CB 3.5Å; D1037-K1041 PolarHBondContact O-N 3.06Å; L1038-K1041 PolarHBondContact O-N 3.34Å; F1039-K1041 PolarHBondContact O-N 2.92Å; K1041-T1045 VanDerWaalsContact O-CB 3.26Å; K1041-T1045 WeakPolarHBondContact O-CB 3.48Å; K1041-T1045 PolarHBondContact O-N 3.14Å; K1041-T1045 PolarHBondContact O-OG1 2.87Å; K1041-T1045 VanDerWaalsContact O-OG1 3.06Å
1042	A	92.7	Very high	92.1	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-62.9	-44.2	178.9	0	0	0	0	0	112.2	F1026 L1038 Y1046 N1047 M1048	F1026-A1042 HydrophobicContact CE1-CB 4.01Å; F1026-A1042 HydrophobicContact CZ-CB 3.85Å; L1038-A1042 VanDerWaalsContact O-CB 3.3Å; L1038-A1042 WeakPolarHBondContact O-CB 3.27Å; L1038-A1042 PolarHBondContact O-N 3.43Å; A1042-Y1046 PolarHBondContact O-N 2.94Å; A1042-N1047 PolarHBondContact O-N 2.92Å; A1042-M1048 CarbonylContact C-O 3.54Å; A1042-M1048 HydrophobicContact CB-CB 4.37Å; A1042-M1048 PolarHBondContact O-N 2.79Å
1043	L	93.1	Very high	92.9	Very high	2 Å²	2	27.3 Å²	27.3	1%	0.01	14%	0.14	C	C	.	.	H	α-helix	trans	-68.4	-45.4	-179.4	-174.5	61.3	0	0	0	112.1	P589 C592 F1039 N1047 M1048 L1049	P589-L1043 HydrophobicContact CB-CD1 3.88Å; P589-L1043 HydrophobicContact CB-CG 4.04Å; P589-L1043 HydrophobicContact CG-CD1 4.43Å; P589-L1043 WeakPolarHBondContact O-CD2 3.23Å; C592-L1043 HydrophobicContact CB-CD2 3.75Å; F1039-L1043 HydrophobicContact CE1-CD2 3.79Å; F1039-L1043 HydrophobicContact CZ-CD2 3.98Å; F1039-L1043 WeakPolarHBondContact O-CB 3.45Å; F1039-L1043 PolarHBondContact O-N 3.43Å; L1043-N1047 WeakPolarHBondContact O-CA 3.39Å; L1043-N1047 PolarHBondContact O-N 3.36Å; L1043-M1048 WeakPolarHBondContact CA-O 3.35Å; L1043-M1048 PolarHBondContact N-O 3.01Å; L1043-L1049 HydrophobicContact CD1-CD1 4.14Å; L1043-L1049 HydrophobicContact CD2-CD1 4.41Å
1044	K	90.6	Very high	93.3	Very high	119 Å²	119	26.8 Å²	26.8	52%	0.517	13%	0.133	S	C	.	.	H	α-helix	trans	-69.6	-42.4	179.6	-73.7	172.2	-179.1	169.5	0	113.5	E593 C1040	E593-K1044 VanDerWaalsContact CD-NZ 3.31Å; E593-K1044 WeakPolarHBondContact OE1-CE 3.25Å; E593-K1044 IonicContact OE1-NZ 3.95Å; E593-K1044 PolarHBondContact OE1-NZ 3.28Å; E593-K1044 WeakPolarHBondContact OE2-CE 3.28Å; E593-K1044 IonicContact OE2-NZ 3.02Å; E593-K1044 PolarHBondContact OE2-NZ 2.98Å; C1040-K1044 VanDerWaalsContact O-CB 3.3Å; C1040-K1044 WeakPolarHBondContact O-CB 3.28Å; C1040-K1044 VanDerWaalsContact O-CG 3.26Å; C1040-K1044 WeakPolarHBondContact O-CG 3.29Å; C1040-K1044 PolarHBondContact O-N 3.42Å; C1040-K1044 VanDerWaalsContact O-N 3.08Å
1045	T	89.9	Confident	93.3	Very high	85 Å²	85	26 Å²	26	52%	0.521	13%	0.125	S	C	.	.	H	α-helix	trans	-84.9	-34.5	-171.7	-53.8	0	0	0	0	112.5	K1041	K1041-T1045 VanDerWaalsContact O-CB 3.26Å; K1041-T1045 WeakPolarHBondContact O-CB 3.48Å; K1041-T1045 PolarHBondContact O-N 3.14Å; K1041-T1045 PolarHBondContact O-OG1 2.87Å; K1041-T1045 VanDerWaalsContact O-OG1 3.06Å
1046	Y	89.1	Confident	93.2	Very high	102 Å²	102	27.6 Å²	27.6	40%	0.4	13%	0.133	S	C	.	.	H	α-helix	trans	-127.8	-3.3	-170.7	-56.9	-80.5	0	0	0	114.3	P1025 F1026 A1042 M1048	P1025-Y1046 WeakPolarHBondContact CB-OH 3.44Å; P1025-Y1046 HydrophobicContact CG-CE2 4.19Å; P1025-Y1046 WeakPolarHBondContact CG-OH 3.39Å; F1026-Y1046 HydrophobicContact CE1-CD2 4.43Å; F1026-Y1046 HydrophobicContact CE1-CE2 4.22Å; F1026-Y1046 HydrophobicContact CE2-CE2 4.45Å; F1026-Y1046 AromaticContact CZ-CD2 3.71Å; F1026-Y1046 HydrophobicContact CZ-CD2 3.71Å; F1026-Y1046 AromaticContact CZ-CE2 3.69Å; F1026-Y1046 HydrophobicContact CZ-CE2 3.69Å; A1042-Y1046 PolarHBondContact O-N 2.94Å; Y1046-M1048 HydrophobicContact CD2-CE 3.95Å; Y1046-M1048 HydrophobicContact CG-CE 3.93Å; Y1046-M1048 PolarHBondContact O-N 2.92Å
1047	N	91.4	Very high	93	Very high	37 Å²	37	29.2 Å²	29.2	20%	0.198	14%	0.14	C	C	.	.			trans	57.7	27.3	-170.9	-45.9	-86.2	0	0	0	113.2	N620 N623 A1042 L1043 Q1093	N620-N1047 PolarHBondContact ND2-O 2.95Å; N623-N1047 PolarHBondContact ND2-OD1 3.4Å; A1042-N1047 PolarHBondContact O-N 2.92Å; L1043-N1047 WeakPolarHBondContact O-CA 3.39Å; L1043-N1047 PolarHBondContact O-N 3.36Å; N1047-Q1093 HydrophobicContact CB-CG 3.84Å; N1047-Q1093 PolarHBondContact O-NE2 3.3Å
1048	M	92.6	Very high	92.5	Very high	15 Å²	15	26.8 Å²	26.8	7%	0.074	13%	0.127	C	C	.	.			trans	-89.2	117.1	176.1	-63.9	-169.7	-57.2	0	0	109	L1019 F1026 A1042 L1043 Y1046 L1091 M1092	L1019-M1048 HydrophobicContact CD1-CE 3.7Å; L1019-M1048 HydrophobicContact CD1-SD 4.15Å; F1026-M1048 HydrophobicContact CE2-CE 3.7Å; F1026-M1048 HydrophobicContact CZ-CE 3.79Å; A1042-M1048 CarbonylContact C-O 3.54Å; A1042-M1048 HydrophobicContact CB-CB 4.37Å; A1042-M1048 PolarHBondContact O-N 2.79Å; L1043-M1048 WeakPolarHBondContact CA-O 3.35Å; L1043-M1048 PolarHBondContact N-O 3.01Å; Y1046-M1048 HydrophobicContact CD2-CE 3.95Å; Y1046-M1048 HydrophobicContact CG-CE 3.93Å; Y1046-M1048 PolarHBondContact O-N 2.92Å; M1048-L1091 WeakPolarHBondContact CA-O 3.44Å; M1048-M1092 HydrophobicContact CG-CG 4.47Å; M1048-M1092 HydrophobicContact SD-CE 3.76Å; M1048-M1092 HydrophobicContact SD-CG 3.91Å
1049	L	94.4	Very high	91.8	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	110.8	174.8	-169.7	78.5	0	0	0	108.7	C592 L602 L603 I604 N620 F1039 L1043 C1090 L1091	C592-L1049 HydrophobicContact CB-CD1 4.19Å; L602-L1049 HydrophobicContact CD1-CD1 4.38Å; L602-L1049 HydrophobicContact CD1-CD2 4.5Å; L602-L1049 HydrophobicContact CD1-CG 4.48Å; L603-L1049 WeakPolarHBondContact O-CD2 3.36Å; I604-L1049 HydrophobicContact CB-CD2 4.31Å; I604-L1049 HydrophobicContact CG1-CD2 3.96Å; N620-L1049 HydrophobicContact CB-CB 4.32Å; F1039-L1049 HydrophobicContact CE2-CD1 3.55Å; F1039-L1049 HydrophobicContact CE2-CG 4.24Å; F1039-L1049 HydrophobicContact CZ-CD1 3.62Å; L1043-L1049 HydrophobicContact CD1-CD1 4.14Å; L1043-L1049 HydrophobicContact CD2-CD1 4.41Å; L1049-C1090 CarbonylContact O-C 3.33Å; L1049-C1090 VanDerWaalsContact O-CA 3.23Å; L1049-C1090 WeakPolarHBondContact O-CA 3.4Å; L1049-L1091 HydrophobicContact CB-CB 4.35Å; L1049-L1091 HydrophobicContact CD2-CD1 4.21Å; L1049-L1091 PolarHBondContact N-O 3.02Å; L1049-L1091 PolarHBondContact O-N 3.42Å
1050	C	94.9	Very high	90.8	Very high	1 Å²	1	31.1 Å²	31.1	1%	0.007	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76	140.2	168.4	-62	0	0	0	0	109.5	F1039 I1088 F1089	F1039-C1050 HydrophobicContact CD2-CB 4.17Å; F1039-C1050 WeakPolarHBondContact CD2-O 3.18Å; F1039-C1050 WeakPolarHBondContact CE2-O 3.46Å; C1050-I1088 HydrophobicContact CB-CG2 4.06Å; C1050-F1089 WeakPolarHBondContact CA-O 3.29Å
1051	F	92.7	Very high	89.8	Confident	7 Å²	7	34.4 Å²	34.4	3%	0.031	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	-3.5	-178.3	61.9	-85.8	0	0	0	115.6	L541 M544 L602 I604 V1016 Y1035 N1075 F1089 L1091	L541-F1051 HydrophobicContact CD1-CE2 3.7Å; L541-F1051 HydrophobicContact CD1-CZ 3.77Å; M544-F1051 HydrophobicContact SD-CD2 3.44Å; M544-F1051 WeakPolarHBondContact SD-CD2 3.36Å; M544-F1051 HydrophobicContact SD-CE2 3.31Å; M544-F1051 WeakPolarHBondContact SD-CE2 3.38Å; M544-F1051 HydrophobicContact SD-CZ 4.5Å; L602-F1051 HydrophobicContact CD2-CB 3.81Å; I604-F1051 HydrophobicContact CD1-CB 4.34Å; V1016-F1051 HydrophobicContact CG1-CZ 4.03Å; Y1035-F1051 PolarHBondContact OH-N 3.07Å; F1051-N1075 PolarHBondContact O-N 3.18Å; F1051-F1089 HydrophobicContact CD1-CB 4.44Å; F1051-F1089 HydrophobicContact CD2-CB 4.31Å; F1051-F1089 HydrophobicContact CE1-CB 4.15Å; F1051-F1089 HydrophobicContact CE2-CB 4.03Å; F1051-F1089 HydrophobicContact CZ-CB 3.94Å; F1051-F1089 PolarHBondContact N-O 3.17Å; F1051-L1091 HydrophobicContact CD1-CG 4.17Å; F1051-L1091 HydrophobicContact CE1-CD2 4.27Å; F1051-L1091 HydrophobicContact CE1-CG 3.82Å
1052	G	95.1	Very high	88.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176.7	-177.3	167.7	0	0	0	0	0	113.6	Y1035 I1073 F1089	Y1035-G1052 PolarHBondContact OH-N 3.24Å; G1052-I1073 CarbonylContact C-O 3.55Å; G1052-I1073 WeakPolarHBondContact CA-O 3.46Å; G1052-F1089 PolarHBondContact O-N 3.19Å
1053	I	95.9	Very high	87.2	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	150.8	-179	-54.2	168.4	0	0	0	109.1	Y1035 R1055 I1073 P1076 F1080 L1082 D1086 L1087 I1088	Y1035-I1053 HydrophobicContact CD2-CD1 3.71Å; Y1035-I1053 HydrophobicContact CD2-CG1 3.78Å; Y1035-I1053 HydrophobicContact CE2-CD1 4.17Å; Y1035-I1053 HydrophobicContact CE2-CG1 3.72Å; I1053-R1055 HydrophobicContact CG2-CB 4.11Å; I1053-I1073 HydrophobicContact CB-CB 4.27Å; I1053-I1073 PolarHBondContact N-O 2.81Å; I1053-I1073 PolarHBondContact O-N 2.88Å; I1053-P1076 HydrophobicContact CD1-CB 4.29Å; I1053-P1076 HydrophobicContact CD1-CG 3.82Å; I1053-P1076 HydrophobicContact CG1-CG 4.08Å; I1053-F1080 HydrophobicContact CD1-CD1 3.53Å; I1053-F1080 HydrophobicContact CD1-CE1 3.48Å; I1053-F1080 VanDerWaalsContact CD1-CE1 3.48Å; I1053-L1082 HydrophobicContact CD1-CD2 4.1Å; I1053-D1086 HydrophobicContact CG2-CB 3.91Å; I1053-L1087 CarbonylContact C-O 3.59Å; I1053-I1088 HydrophobicContact CB-CD1 4.37Å; I1053-I1088 HydrophobicContact CG1-CD1 3.84Å; I1053-I1088 HydrophobicContact CG2-CD1 4.16Å
1054	Y	96.1	Very high	86.1	Confident	5 Å²	5	47.2 Å²	47.2	2%	0.02	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	83.9	171.7	-165.7	-135.1	0	0	0	108.8	Q539 C950 R1070 Y1071 V1072 L1087 F1089	Q539-Y1054 HydrophobicContact CB-CE1 3.95Å; Q539-Y1054 VanDerWaalsContact CD-OH 3.27Å; Q539-Y1054 HydrophobicContact CG-CE1 4.06Å; Q539-Y1054 WeakPolarHBondContact CG-OH 3.26Å; Q539-Y1054 PolarHBondContact NE2-OH 3.34Å; C950-Y1054 PolarHBondContact O-OH 3.11Å; Y1054-R1070 HydrophobicContact CD1-CB 3.75Å; Y1054-R1070 VanDerWaalsContact CD1-CD 3.47Å; Y1054-R1070 HydrophobicContact CD1-CG 4.27Å; Y1054-R1070 HydrophobicContact CD2-CB 3.82Å; Y1054-R1070 HydrophobicContact CE1-CB 3.57Å; Y1054-R1070 HydrophobicContact CE1-CG 4.22Å; Y1054-R1070 HydrophobicContact CE2-CB 3.64Å; Y1054-R1070 WeakPolarHBondContact CE2-O 3.05Å; Y1054-R1070 HydrophobicContact CG-CB 3.85Å; Y1054-R1070 VanDerWaalsContact CZ-CB 3.49Å; Y1054-R1070 PolarHBondContact O-NH1 2.87Å; Y1054-R1070 PolarHBondContact OH-O 3.12Å; Y1054-Y1071 CarbonylContact C-O 3.51Å; Y1054-Y1071 WeakPolarHBondContact CA-O 3.18Å; Y1054-Y1071 WeakPolarHBondContact CD2-O 3.38Å; Y1054-V1072 HydrophobicContact CD2-CG2 4.01Å; Y1054-V1072 HydrophobicContact CE2-CG2 4.15Å; Y1054-L1087 HydrophobicContact CD1-CD1 4.33Å; Y1054-L1087 PolarHBondContact N-O 2.82Å; Y1054-L1087 PolarHBondContact O-N 3.13Å; Y1054-F1089 HydrophobicContact CD2-CE2 4.26Å; Y1054-F1089 HydrophobicContact CD2-CZ 4.18Å; Y1054-F1089 HydrophobicContact CG-CE2 4.17Å; Y1054-F1089 HydrophobicContact CG-CZ 4.13Å
1055	R	94.4	Very high	85.3	Confident	20 Å²	20	44.5 Å²	44.5	8%	0.075	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	140.7	-167.3	174.5	159.4	-72.7	178.2	2.2	111.2	I1053 R1057 A1059 R1070 Y1071 I1073 F1080 E1081 D1086	I1053-R1055 HydrophobicContact CG2-CB 4.11Å; R1055-R1057 PolarHBondContact O-N 3.44Å; R1055-A1059 HydrophobicContact CG-CB 4.02Å; R1055-R1070 CarbonylContact O-C 3.47Å; R1055-R1070 WeakPolarHBondContact O-CA 3.42Å; R1055-R1070 WeakPolarHBondContact O-CB 3.19Å; R1055-Y1071 HydrophobicContact CB-CE1 4.08Å; R1055-Y1071 HydrophobicContact CG-CE1 3.96Å; R1055-Y1071 PolarHBondContact N-O 3.42Å; R1055-Y1071 VanDerWaalsContact O-CD1 3.3Å; R1055-Y1071 WeakPolarHBondContact O-CD1 3.46Å; R1055-Y1071 PolarHBondContact O-N 2.91Å; R1055-I1073 HydrophobicContact CB-CD1 4.18Å; R1055-F1080 VanDerWaalsContact NH1-CE1 3.31Å; R1055-E1081 PolarHBondContact NH2-O 2.83Å; R1055-D1086 VanDerWaalsContact CA-OD1 3.3Å; R1055-D1086 WeakPolarHBondContact CA-OD1 3.46Å; R1055-D1086 VanDerWaalsContact CB-OD1 3.3Å; R1055-D1086 WeakPolarHBondContact CB-OD1 3.31Å; R1055-D1086 WeakPolarHBondContact CG-OD1 3.32Å; R1055-D1086 IonicContact CZ-OD1 3.76Å; R1055-D1086 IonicContact CZ-OD2 2.66Å; R1055-D1086 IonicContact NE-OD1 2.82Å; R1055-D1086 PolarHBondContact NE-OD1 3.31Å; R1055-D1086 VanDerWaalsContact NE-OD1 3.08Å; R1055-D1086 IonicContact NE-OD2 2.68Å; R1055-D1086 PolarHBondContact NE-OD2 3.41Å; R1055-D1086 IonicContact NH2-OD1 2.69Å; R1055-D1086 IonicContact NH2-OD2 3.11Å; R1055-D1086 PolarHBondContact NH2-OD2 3.19Å
1056	L	92.3	Very high	84.6	Confident	34 Å²	34	49.3 Å²	49.3	18%	0.178	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	134.2	173.1	-76.9	166.1	0	0	0	110	D1058 A1059 T1068 K1069 R1070 T1085	L1056-D1058 VanDerWaalsContact C-N 3.3Å; L1056-D1058 PolarHBondContact O-N 3.25Å; L1056-A1059 HydrophobicContact CB-CB 4.12Å; L1056-A1059 WeakPolarHBondContact O-CB 3.31Å; L1056-A1059 PolarHBondContact O-N 3.07Å; L1056-A1059 VanDerWaalsContact O-N 3.09Å; L1056-T1068 WeakPolarHBondContact CD2-O 3.23Å; L1056-K1069 WeakPolarHBondContact CA-O 3.45Å; L1056-R1070 HydrophobicContact CD2-CG 3.71Å; L1056-R1070 HydrophobicContact CG-CG 4.07Å; L1056-T1085 HydrophobicContact CD1-CG2 4.49Å
1057	R	88.4	Confident	84.3	Confident	35 Å²	35	45.9 Å²	45.9	13%	0.132	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-50.8	-51.9	-178.2	-170.9	-168.7	68.9	-166.6	-5.2	111.2	W562 D933 R1055 A1059 H1060 C1067 K1069 Y1071	W562-R1057 HydrophobicContact CB-CG 4.03Å; W562-R1057 HydrophobicContact CD2-CG 4.48Å; W562-R1057 HydrophobicContact CG-CG 3.77Å; D933-R1057 PolarHBondContact O-NH1 3.41Å; D933-R1057 IonicContact OD2-CZ 2.72Å; D933-R1057 IonicContact OD2-NH1 3.73Å; D933-R1057 PolarHBondContact OD2-NH1 3.15Å; D933-R1057 IonicContact OD2-NH2 2.86Å; R1055-R1057 PolarHBondContact O-N 3.44Å; R1057-A1059 VanDerWaalsContact C-N 3.25Å; R1057-A1059 PolarHBondContact O-N 3Å; R1057-H1060 PolarHBondContact O-CE1 2.59Å; R1057-H1060 PolarHBondContact O-ND1 3.48Å; R1057-C1067 PolarHBondContact NH2-SG 3.3Å; R1057-K1069 PolarHBondContact N-O 3.12Å; R1057-Y1071 HydrophobicContact CB-CD1 4.42Å
1058	D	84.6	Confident	84	Confident	23 Å²	23	47.3 Å²	47.3	12%	0.123	29%	0.287	C	S	.	.	G	3₁₀ helix	trans	-83.9	8.7	-173.2	-58.5	-1.4	0	0	0	113	L1056 H1060 L1061 S1065 C1067	L1056-D1058 VanDerWaalsContact C-N 3.3Å; L1056-D1058 PolarHBondContact O-N 3.25Å; D1058-H1060 PolarHBondContact O-N 3.03Å; D1058-L1061 HydrophobicContact CB-CD1 4.12Å; D1058-L1061 WeakPolarHBondContact O-CB 3.33Å; D1058-L1061 PolarHBondContact O-N 2.77Å; D1058-S1065 WeakPolarHBondContact OD2-CB 3.45Å; D1058-S1065 PolarHBondContact OD2-OG 3.35Å; D1058-C1067 WeakPolarHBondContact OD2-CB 3.33Å
1059	A	78	Confident	83.9	Confident	36 Å²	36	48.6 Å²	48.6	30%	0.298	29%	0.292	S	S	.	.	G	3₁₀ helix	trans	-64.7	-23.7	-175.6	0	0	0	0	0	114.9	R1055 L1056 R1057 L1061	R1055-A1059 HydrophobicContact CG-CB 4.02Å; L1056-A1059 HydrophobicContact CB-CB 4.12Å; L1056-A1059 WeakPolarHBondContact O-CB 3.31Å; L1056-A1059 PolarHBondContact O-N 3.07Å; L1056-A1059 VanDerWaalsContact O-N 3.09Å; R1057-A1059 VanDerWaalsContact C-N 3.25Å; R1057-A1059 PolarHBondContact O-N 3Å; A1059-L1061 VanDerWaalsContact C-N 3.32Å
1060	H	74.3	Confident	83.9	Confident	58 Å²	58	50.4 Å²	50.4	27%	0.269	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-80.6	-14.6	176.4	62.5	-78.1	0	0	0	112.4	D560 R1057 D1058	D560-H1060 PolarHBondContact O-CD2 2.73Å; D560-H1060 PolarHBondContact O-NE2 3.02Å; R1057-H1060 PolarHBondContact O-CE1 2.59Å; R1057-H1060 PolarHBondContact O-ND1 3.48Å; D1058-H1060 PolarHBondContact O-N 3.03Å
1061	L	73.3	Confident	83.9	Confident	84 Å²	84	50.4 Å²	50.4	44%	0.44	30%	0.299	S	S	.	.	S	Bend	trans	-86.6	124.6	-178.6	-57.7	176.9	0	0	0	110.3	D1058 A1059 T1063	D1058-L1061 HydrophobicContact CB-CD1 4.12Å; D1058-L1061 WeakPolarHBondContact O-CB 3.33Å; D1058-L1061 PolarHBondContact O-N 2.77Å; A1059-L1061 VanDerWaalsContact C-N 3.32Å; L1061-T1063 PolarHBondContact O-N 2.89Å
1062	G	61.7	Low	84.1	Confident	91 Å²	91	50.1 Å²	50.1	94%	0.938	30%	0.297	S	S	*	.	S	Bend	trans	-65.8	7	178	0	0	0	0	0	115.8
1063	T	68.8	Low	84.1	Confident	101 Å²	101	50.2 Å²	50.2	62%	0.62	30%	0.298	S	S	*	.	S	Bend	trans	-116.3	124.4	177.6	51.5	0	0	0	0	110.3	L1061 S1065	L1061-T1063 PolarHBondContact O-N 2.89Å; T1063-S1065 PolarHBondContact O-N 2.71Å
1064	P	69.1	Low	84.1	Confident	138 Å²	138	50.3 Å²	50.3	90%	0.896	30%	0.298	S	S	*	.			trans	-68.9	103.1	-176.3	27.5	-34.5	0	0	0	112
1065	S	74.9	Confident	84	Confident	63 Å²	63	51 Å²	51	44%	0.441	30%	0.303	S	S	.	.			trans	-76.6	160.1	171.2	-178.6	0	0	0	0	111.9	D1058 T1063 C1067	D1058-S1065 WeakPolarHBondContact OD2-CB 3.45Å; D1058-S1065 PolarHBondContact OD2-OG 3.35Å; T1063-S1065 PolarHBondContact O-N 2.71Å; S1065-C1067 WeakPolarHBondContact OG-CB 3.4Å; S1065-C1067 PolarHBondContact OG-N 3.15Å; S1065-C1067 VanDerWaalsContact OG-N 3.09Å
1066	Q	75.3	Confident	84	Confident	186 Å²	186	50.1 Å²	50.1	87%	0.869	30%	0.299	S	S	*	.			trans	-93.7	1	168.6	-66.7	-168.3	-7	0	0	113.1	T1068	Q1066-T1068 PolarHBondContact O-N 2.81Å
1067	C	82	Confident	84.1	Confident	30 Å²	30	50.8 Å²	50.8	20%	0.203	31%	0.305	C	S	.	.			trans	-66.4	117.7	178.5	-169.8	0	0	0	0	111.3	R1057 D1058 S1065	R1057-C1067 PolarHBondContact NH2-SG 3.3Å; D1058-C1067 WeakPolarHBondContact OD2-CB 3.33Å; S1065-C1067 WeakPolarHBondContact OG-CB 3.4Å; S1065-C1067 PolarHBondContact OG-N 3.15Å; S1065-C1067 VanDerWaalsContact OG-N 3.09Å
1068	T	85.3	Confident	84.2	Confident	67 Å²	67	51.8 Å²	51.8	41%	0.411	31%	0.31	S	S	.	.			trans	-91.1	0.7	177.2	59.2	0	0	0	0	113.5	L1056 Q1066	L1056-T1068 WeakPolarHBondContact CD2-O 3.23Å; Q1066-T1068 PolarHBondContact O-N 2.81Å
1069	K	90.3	Very high	84.6	Confident	41 Å²	41	57.6 Å²	57.6	18%	0.178	34%	0.336	C	S	.	.			trans	-64.6	141.1	179.6	-63.5	-177.9	-173.1	176.9	0	110.8	D931 D933 L1056 R1057	D931-K1069 IonicContact OD1-NZ 3.77Å; D931-K1069 PolarHBondContact OD1-NZ 2.76Å; D931-K1069 WeakPolarHBondContact OD2-CE 3.41Å; D931-K1069 IonicContact OD2-NZ 2.75Å; D931-K1069 PolarHBondContact OD2-NZ 2.9Å; D933-K1069 IonicContact OD1-NZ 2.61Å; D933-K1069 PolarHBondContact OD1-NZ 2.81Å; D933-K1069 IonicContact OD2-NZ 2.72Å; D933-K1069 PolarHBondContact OD2-NZ 3.3Å; L1056-K1069 WeakPolarHBondContact CA-O 3.45Å; R1057-K1069 PolarHBondContact N-O 3.12Å
1070	R	93.7	Very high	85.4	Confident	38 Å²	38	56.7 Å²	56.7	14%	0.143	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	141.5	178.8	-66.9	172.5	177.7	-84.8	-3.3	109.9	C950 Y1054 R1055 L1056 T1085	C950-R1070 WeakPolarHBondContact CA-O 3.28Å; C950-R1070 VanDerWaalsContact CB-O 3.27Å; C950-R1070 WeakPolarHBondContact CB-O 3.38Å; C950-R1070 PolarHBondContact SG-O 3.29Å; C950-R1070 VanDerWaalsContact SG-O 3.38Å; Y1054-R1070 HydrophobicContact CD1-CB 3.75Å; Y1054-R1070 VanDerWaalsContact CD1-CD 3.47Å; Y1054-R1070 HydrophobicContact CD1-CG 4.27Å; Y1054-R1070 HydrophobicContact CD2-CB 3.82Å; Y1054-R1070 HydrophobicContact CE1-CB 3.57Å; Y1054-R1070 HydrophobicContact CE1-CG 4.22Å; Y1054-R1070 HydrophobicContact CE2-CB 3.64Å; Y1054-R1070 WeakPolarHBondContact CE2-O 3.05Å; Y1054-R1070 HydrophobicContact CG-CB 3.85Å; Y1054-R1070 VanDerWaalsContact CZ-CB 3.49Å; Y1054-R1070 PolarHBondContact O-NH1 2.87Å; Y1054-R1070 PolarHBondContact OH-O 3.12Å; R1055-R1070 CarbonylContact O-C 3.47Å; R1055-R1070 WeakPolarHBondContact O-CA 3.42Å; R1055-R1070 WeakPolarHBondContact O-CB 3.19Å; L1056-R1070 HydrophobicContact CD2-CG 3.71Å; L1056-R1070 HydrophobicContact CG-CG 4.07Å; R1070-T1085 VanDerWaalsContact CZ-O 3.23Å; R1070-T1085 PolarHBondContact NH1-O 3.1Å; R1070-T1085 PolarHBondContact NH2-O 3.4Å
1071	Y	95.4	Very high	86.2	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.008	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	160.1	174.9	67.9	-82	0	0	0	111.1	W562 Y565 A949 Y1054 R1055 R1057 I1073	W562-Y1071 HydrophobicContact CB-CD1 4.01Å; W562-Y1071 HydrophobicContact CB-CE1 3.73Å; W562-Y1071 HydrophobicContact CE3-CD2 4.43Å; W562-Y1071 HydrophobicContact CE3-CG 4.25Å; Y565-Y1071 WeakPolarHBondContact CB-OH 3.46Å; A949-Y1071 WeakPolarHBondContact O-CA 3.26Å; Y1054-Y1071 CarbonylContact C-O 3.51Å; Y1054-Y1071 WeakPolarHBondContact CA-O 3.18Å; Y1054-Y1071 WeakPolarHBondContact CD2-O 3.38Å; R1055-Y1071 HydrophobicContact CB-CE1 4.08Å; R1055-Y1071 HydrophobicContact CG-CE1 3.96Å; R1055-Y1071 PolarHBondContact N-O 3.42Å; R1055-Y1071 VanDerWaalsContact O-CD1 3.3Å; R1055-Y1071 WeakPolarHBondContact O-CD1 3.46Å; R1055-Y1071 PolarHBondContact O-N 2.91Å; R1057-Y1071 HydrophobicContact CB-CD1 4.42Å; Y1071-I1073 HydrophobicContact CD2-CG1 4.05Å; Y1071-I1073 HydrophobicContact CE2-CD1 3.74Å; Y1071-I1073 HydrophobicContact CE2-CG1 3.62Å
1072	V	96.6	Very high	87.1	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	139	-175.4	172.2	0	0	0	0	111.7	G540 T543 M544 Y566 A949 Y1054 F1089	G540-V1072 WeakPolarHBondContact O-CG2 3.42Å; T543-V1072 HydrophobicContact CG2-CB 4.44Å; T543-V1072 HydrophobicContact CG2-CG2 4.27Å; M544-V1072 HydrophobicContact CB-CG1 3.86Å; M544-V1072 HydrophobicContact CE-CG1 3.6Å; Y566-V1072 WeakPolarHBondContact CD2-O 3.41Å; A949-V1072 PolarHBondContact O-N 3.02Å; Y1054-V1072 HydrophobicContact CD2-CG2 4.01Å; Y1054-V1072 HydrophobicContact CE2-CG2 4.15Å; V1072-F1089 HydrophobicContact CG2-CE2 4.46Å; V1072-F1089 HydrophobicContact CG2-CZ 4.41Å
1073	I	96.2	Very high	88.5	Confident	1 Å²	1	53.9 Å²	53.9	1%	0.005	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	112.2	166.8	-52.2	175.9	0	0	0	108.3	G1052 I1053 R1055 Y1071 P1076 F1080	G1052-I1073 CarbonylContact C-O 3.55Å; G1052-I1073 WeakPolarHBondContact CA-O 3.46Å; I1053-I1073 HydrophobicContact CB-CB 4.27Å; I1053-I1073 PolarHBondContact N-O 2.81Å; I1053-I1073 PolarHBondContact O-N 2.88Å; R1055-I1073 HydrophobicContact CB-CD1 4.18Å; Y1071-I1073 HydrophobicContact CD2-CG1 4.05Å; Y1071-I1073 HydrophobicContact CE2-CD1 3.74Å; Y1071-I1073 HydrophobicContact CE2-CG1 3.62Å; I1073-P1076 HydrophobicContact CG2-CB 4.14Å; I1073-F1080 HydrophobicContact CD1-CE1 4.2Å; I1073-F1080 HydrophobicContact CD1-CZ 3.74Å
1074	T	95.3	Very high	89.5	Confident	2 Å²	2	51.3 Å²	51.3	1%	0.012	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	135.5	177.3	12.6	0	0	0	0	111.4	M544 L548 G569	M544-T1074 HydrophobicContact CB-CG2 4.42Å; M544-T1074 HydrophobicContact CE-CG2 3.9Å; M544-T1074 HydrophobicContact CG-CG2 3.55Å; M544-T1074 HydrophobicContact SD-CG2 4.08Å; L548-T1074 HydrophobicContact CD2-CG2 4.06Å; L548-T1074 HydrophobicContact CG-CG2 4.31Å; G569-T1074 WeakPolarHBondContact CA-OG1 3.39Å; G569-T1074 PolarHBondContact O-OG1 3.48Å
1075	N	95.1	Very high	90.5	Very high	21 Å²	21	47.4 Å²	47.4	11%	0.112	25%	0.247	C	C	.	.	S	Bend	trans	42.2	55.3	170.8	-173.6	43.5	0	0	0	115.3	N572 L602 I636 F1051	N572-N1075 PolarHBondContact OD1-ND2 2.97Å; L602-N1075 VanDerWaalsContact CB-OD1 3.31Å; L602-N1075 WeakPolarHBondContact CB-OD1 3.42Å; L602-N1075 HydrophobicContact CD2-CB 4.05Å; L602-N1075 WeakPolarHBondContact CD2-OD1 3.43Å; I636-N1075 HydrophobicContact CG2-CB 3.76Å; F1051-N1075 PolarHBondContact O-N 3.18Å
1076	P	94.5	Very high	91.3	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.006	23%	0.226	C	C	.	.			trans	-62.7	154.9	179.5	28.1	-36	0	0	0	111.9	Y596 Y1035 I1053 I1073 F1080	Y596-P1076 PolarHBondContact OH-O 3.24Å; Y1035-P1076 HydrophobicContact CD1-CG 3.79Å; Y1035-P1076 HydrophobicContact CD2-CG 3.76Å; Y1035-P1076 HydrophobicContact CE1-CG 3.78Å; Y1035-P1076 HydrophobicContact CE2-CG 3.73Å; Y1035-P1076 HydrophobicContact CG-CG 3.78Å; I1053-P1076 HydrophobicContact CD1-CB 4.29Å; I1053-P1076 HydrophobicContact CD1-CG 3.82Å; I1053-P1076 HydrophobicContact CG1-CG 4.08Å; I1073-P1076 HydrophobicContact CG2-CB 4.14Å; P1076-F1080 HydrophobicContact CB-CB 4.04Å; P1076-F1080 HydrophobicContact CB-CD1 4.12Å; P1076-F1080 HydrophobicContact CB-CD2 4.08Å; P1076-F1080 HydrophobicContact CB-CG 3.83Å
1077	P	92.4	Very high	92.3	Very high	47 Å²	47	37 Å²	37	31%	0.305	19%	0.193	S	C	.	.			trans	-68.7	162.3	-178.8	28.2	-35.3	0	0	0	112.8	E568 E1079 F1080	E568-P1077 WeakPolarHBondContact OE1-CD 3.12Å; E568-P1077 WeakPolarHBondContact OE1-CG 3.48Å; P1077-E1079 VanDerWaalsContact C-N 3.31Å; P1077-E1079 PolarHBondContact O-N 3.3Å; P1077-F1080 HydrophobicContact CG-CB 4.11Å; P1077-F1080 HydrophobicContact CG-CD2 4.16Å; P1077-F1080 WeakPolarHBondContact O-CB 3.46Å; P1077-F1080 PolarHBondContact O-N 3.02Å; P1077-F1080 VanDerWaalsContact O-N 3.08Å
1078	Y	91.6	Very high	92.9	Very high	56 Å²	56	35.7 Å²	35.7	22%	0.22	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-44.5	-177.3	-168.4	-81.9	0	0	0	113.4	Y596 V597 G1036 D1037 F1080	Y596-Y1078 HydrophobicContact CD1-CD2 4.09Å; Y596-Y1078 AromaticContact CE1-CD2 3.74Å; Y596-Y1078 HydrophobicContact CE1-CD2 3.74Å; Y596-Y1078 HydrophobicContact CE1-CE2 4.5Å; Y596-Y1078 PolarHBondContact OH-N 2.92Å; V597-Y1078 HydrophobicContact CG2-CD2 4.48Å; V597-Y1078 HydrophobicContact CG2-CE2 3.98Å; G1036-Y1078 VanDerWaalsContact CA-CD2 3.46Å; G1036-Y1078 VanDerWaalsContact CA-CE2 3.43Å; G1036-Y1078 PolarHBondContact N-O 3.42Å; D1037-Y1078 PolarHBondContact OD1-OH 2.97Å; Y1078-F1080 PolarHBondContact O-N 3.38Å
1079	E	93.3	Very high	93.4	Very high	146 Å²	146	32.5 Å²	32.5	68%	0.682	16%	0.164	S	C	*	.	T	Hydrogen-bonded Turn	trans	-77.4	3.5	-177.6	-48.7	-70.3	140.2	0	0	113.5	P1077 E1081	P1077-E1079 VanDerWaalsContact C-N 3.31Å; P1077-E1079 PolarHBondContact O-N 3.3Å; E1079-E1081 PolarHBondContact O-N 2.89Å
1080	F	93.9	Very high	93.6	Very high	16 Å²	16	30.6 Å²	30.6	7%	0.07	16%	0.156	C	C	.	.	P	Polyproline II helix	trans	-67.7	123.2	-173.3	-165.6	-92	0	0	0	111.7	Y565 Y1035 I1053 R1055 I1073 P1076 P1077 Y1078	Y565-F1080 AromaticContact CD1-CE2 3.86Å; Y565-F1080 HydrophobicContact CD1-CE2 3.86Å; Y565-F1080 HydrophobicContact CD1-CZ 4.01Å; Y565-F1080 HydrophobicContact CE1-CE2 4.36Å; Y1035-F1080 PolarHBondContact N-O 3Å; I1053-F1080 HydrophobicContact CD1-CD1 3.53Å; I1053-F1080 HydrophobicContact CD1-CE1 3.48Å; I1053-F1080 VanDerWaalsContact CD1-CE1 3.48Å; R1055-F1080 VanDerWaalsContact NH1-CE1 3.31Å; I1073-F1080 HydrophobicContact CD1-CE1 4.2Å; I1073-F1080 HydrophobicContact CD1-CZ 3.74Å; P1076-F1080 HydrophobicContact CB-CB 4.04Å; P1076-F1080 HydrophobicContact CB-CD1 4.12Å; P1076-F1080 HydrophobicContact CB-CD2 4.08Å; P1076-F1080 HydrophobicContact CB-CG 3.83Å; P1077-F1080 HydrophobicContact CG-CB 4.11Å; P1077-F1080 HydrophobicContact CG-CD2 4.16Å; P1077-F1080 WeakPolarHBondContact O-CB 3.46Å; P1077-F1080 PolarHBondContact O-N 3.02Å; P1077-F1080 VanDerWaalsContact O-N 3.08Å; Y1078-F1080 PolarHBondContact O-N 3.38Å
1081	E	92.5	Very high	93.6	Very high	133 Å²	133	28.9 Å²	28.9	62%	0.621	15%	0.149	S	C	*	.	B	Isolated β-bridge	trans	-70.5	131.3	-178	-174.5	173.8	-174	0	0	111.7	R1055 E1079	R1055-E1081 PolarHBondContact NH2-O 2.83Å; E1079-E1081 PolarHBondContact O-N 2.89Å
1082	L	92.3	Very high	93.4	Very high	2 Å²	2	31 Å²	31	1%	0.01	16%	0.16	C	C	.	.	P	Polyproline II helix	trans	-90.6	146.2	176.6	-65	174.7	0	0	0	111.9	L1021 L1029 G1032 G1033 Y1035 L1038 I1053 I1088	L1021-L1082 HydrophobicContact CD1-CB 4.15Å; L1021-L1082 HydrophobicContact CD1-CD1 4.1Å; L1021-L1082 HydrophobicContact CD1-CD2 4.17Å; L1021-L1082 HydrophobicContact CD1-CG 4.38Å; L1029-L1082 HydrophobicContact CB-CD1 4.49Å; G1032-L1082 PolarHBondContact N-O 2.65Å; G1033-L1082 WeakPolarHBondContact O-CB 3.27Å; G1033-L1082 WeakPolarHBondContact O-CG 3.29Å; G1033-L1082 PolarHBondContact O-N 3.39Å; Y1035-L1082 HydrophobicContact CD2-CD2 4.08Å; L1038-L1082 HydrophobicContact CB-CD1 3.98Å; L1038-L1082 HydrophobicContact CD2-CD1 3.82Å; L1038-L1082 HydrophobicContact CD2-CD2 4.41Å; L1038-L1082 HydrophobicContact CG-CD1 4.49Å; I1053-L1082 HydrophobicContact CD1-CD2 4.1Å; L1082-I1088 HydrophobicContact CD2-CD1 4.24Å
1083	V	90.7	Very high	92.9	Very high	40 Å²	40	33.3 Å²	33.3	24%	0.242	17%	0.171	C	C	.	.			trans	-111.9	137.6	172.4	-178.5	0	0	0	0	107.7	G1030 T1085 D1086	G1030-V1083 CarbonylContact O-C 3.53Å; V1083-T1085 WeakPolarHBondContact CG1-OG1 3.5Å; V1083-T1085 PolarHBondContact O-N 3.36Å; V1083-D1086 PolarHBondContact N-OD2 3.04Å; V1083-D1086 VanDerWaalsContact O-CB 3.3Å; V1083-D1086 WeakPolarHBondContact O-CB 3.45Å; V1083-D1086 PolarHBondContact O-N 3.31Å
1084	P	88.7	Confident	92.4	Very high	47 Å²	47	34.1 Å²	34.1	31%	0.305	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-13.1	-172.6	26.3	-34.6	0	0	0	113.5	L1021 Y1022 G1030	L1021-P1084 CarbonylContact C-O 3.56Å; Y1022-P1084 WeakPolarHBondContact CB-O 3.48Å; Y1022-P1084 PolarHBondContact N-O 3.21Å; Y1022-P1084 VanDerWaalsContact N-O 3.14Å; G1030-P1084 WeakPolarHBondContact O-CD 3.34Å; G1030-P1084 VanDerWaalsContact O-N 3.14Å
1085	T	90.1	Very high	91.4	Very high	56 Å²	56	37.6 Å²	37.6	34%	0.344	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.3	-5.3	173.8	60.2	0	0	0	0	113.8	L1056 R1070 V1083	L1056-T1085 HydrophobicContact CD1-CG2 4.49Å; R1070-T1085 VanDerWaalsContact CZ-O 3.23Å; R1070-T1085 PolarHBondContact NH1-O 3.1Å; R1070-T1085 PolarHBondContact NH2-O 3.4Å; V1083-T1085 WeakPolarHBondContact CG1-OG1 3.5Å; V1083-T1085 PolarHBondContact O-N 3.36Å
1086	D	92.9	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	21%	0.21	C	C	.	.			trans	-65.6	150.6	179.3	-73.5	-34.8	0	0	0	112.6	L1021 I1053 R1055 V1083 I1088	L1021-D1086 HydrophobicContact CD1-CB 4.18Å; L1021-D1086 PolarHBondContact N-O 2.72Å; I1053-D1086 HydrophobicContact CG2-CB 3.91Å; R1055-D1086 VanDerWaalsContact CA-OD1 3.3Å; R1055-D1086 WeakPolarHBondContact CA-OD1 3.46Å; R1055-D1086 VanDerWaalsContact CB-OD1 3.3Å; R1055-D1086 WeakPolarHBondContact CB-OD1 3.31Å; R1055-D1086 WeakPolarHBondContact CG-OD1 3.32Å; R1055-D1086 IonicContact CZ-OD1 3.76Å; R1055-D1086 IonicContact CZ-OD2 2.66Å; R1055-D1086 IonicContact NE-OD1 2.82Å; R1055-D1086 PolarHBondContact NE-OD1 3.31Å; R1055-D1086 VanDerWaalsContact NE-OD1 3.08Å; R1055-D1086 IonicContact NE-OD2 2.68Å; R1055-D1086 PolarHBondContact NE-OD2 3.41Å; R1055-D1086 IonicContact NH2-OD1 2.69Å; R1055-D1086 IonicContact NH2-OD2 3.11Å; R1055-D1086 PolarHBondContact NH2-OD2 3.19Å; V1083-D1086 PolarHBondContact N-OD2 3.04Å; V1083-D1086 VanDerWaalsContact O-CB 3.3Å; V1083-D1086 WeakPolarHBondContact O-CB 3.45Å; V1083-D1086 PolarHBondContact O-N 3.31Å; D1086-I1088 HydrophobicContact CB-CD1 4.43Å
1087	L	94.6	Very high	87.6	Confident	31 Å²	31	46.6 Å²	46.6	16%	0.162	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.5	164.7	-56.6	179.5	0	0	0	108.6	L1019 A1020 I1053 Y1054	L1019-L1087 CarbonylContact O-C 3.16Å; L1019-L1087 WeakPolarHBondContact O-CA 3.27Å; A1020-L1087 HydrophobicContact CB-CD2 3.67Å; I1053-L1087 CarbonylContact C-O 3.59Å; Y1054-L1087 HydrophobicContact CD1-CD1 4.33Å; Y1054-L1087 PolarHBondContact N-O 2.82Å; Y1054-L1087 PolarHBondContact O-N 3.13Å
1088	I	95.4	Very high	85.5	Confident	2 Å²	2	46.1 Å²	46.1	1%	0.01	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	125	-171.3	-54.6	-65.4	0	0	0	110	Q1018 L1019 L1021 L1038 C1050 I1053 L1082 D1086	Q1018-I1088 WeakPolarHBondContact CA-O 3.48Å; L1019-I1088 PolarHBondContact N-O 3.42Å; L1019-I1088 PolarHBondContact O-N 2.7Å; L1021-I1088 HydrophobicContact CD1-CD1 4.16Å; L1021-I1088 HydrophobicContact CD1-CG1 4.2Å; L1021-I1088 HydrophobicContact CD2-CG1 3.91Å; L1021-I1088 HydrophobicContact CG-CD1 4.42Å; L1021-I1088 HydrophobicContact CG-CG1 3.93Å; L1038-I1088 HydrophobicContact CD2-CD1 4.01Å; L1038-I1088 HydrophobicContact CD2-CG1 3.92Å; L1038-I1088 HydrophobicContact CD2-CG2 4.28Å; C1050-I1088 HydrophobicContact CB-CG2 4.06Å; I1053-I1088 HydrophobicContact CB-CD1 4.37Å; I1053-I1088 HydrophobicContact CG1-CD1 3.84Å; I1053-I1088 HydrophobicContact CG2-CD1 4.16Å; L1082-I1088 HydrophobicContact CD2-CD1 4.24Å; D1086-I1088 HydrophobicContact CB-CD1 4.43Å
1089	F	96.4	Very high	82.8	Confident	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	124.6	174	-68.2	-82	0	0	0	110.1	A538 Q539 L541 M544 Q1018 C1050 F1051 G1052 Y1054 V1072	A538-F1089 HydrophobicContact CB-CD1 4.15Å; A538-F1089 HydrophobicContact CB-CE1 4.11Å; Q539-F1089 WeakPolarHBondContact O-CE1 3.42Å; Q539-F1089 WeakPolarHBondContact O-CZ 3.43Å; L541-F1089 HydrophobicContact CB-CE1 4.26Å; L541-F1089 HydrophobicContact CD1-CD1 3.85Å; L541-F1089 HydrophobicContact CD1-CE1 4.08Å; M544-F1089 HydrophobicContact CE-CB 4.41Å; M544-F1089 HydrophobicContact CE-CD2 3.33Å; M544-F1089 HydrophobicContact CE-CE2 3.53Å; M544-F1089 HydrophobicContact CE-CG 3.91Å; M544-F1089 HydrophobicContact CE-CZ 4.28Å; M544-F1089 HydrophobicContact SD-CB 4.43Å; M544-F1089 HydrophobicContact SD-CD2 4.21Å; M544-F1089 HydrophobicContact SD-CG 4.2Å; Q1018-F1089 HydrophobicContact CG-CD1 4.07Å; Q1018-F1089 HydrophobicContact CG-CE1 4.24Å; C1050-F1089 WeakPolarHBondContact CA-O 3.29Å; F1051-F1089 HydrophobicContact CD1-CB 4.44Å; F1051-F1089 HydrophobicContact CD2-CB 4.31Å; F1051-F1089 HydrophobicContact CE1-CB 4.15Å; F1051-F1089 HydrophobicContact CE2-CB 4.03Å; F1051-F1089 HydrophobicContact CZ-CB 3.94Å; F1051-F1089 PolarHBondContact N-O 3.17Å; G1052-F1089 PolarHBondContact O-N 3.19Å; Y1054-F1089 HydrophobicContact CD2-CE2 4.26Å; Y1054-F1089 HydrophobicContact CD2-CZ 4.18Å; Y1054-F1089 HydrophobicContact CG-CE2 4.17Å; Y1054-F1089 HydrophobicContact CG-CZ 4.13Å; V1072-F1089 HydrophobicContact CG2-CE2 4.46Å; V1072-F1089 HydrophobicContact CG2-CZ 4.41Å
1090	C	94.3	Very high	79.9	Confident	0 Å²	0	45.7 Å²	45.7	0%	0	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	155.6	-180	75	0	0	0	0	113.9	A1017 L1019 L1049	A1017-C1090 PolarHBondContact N-O 2.73Å; A1017-C1090 PolarHBondContact O-N 3.3Å; A1017-C1090 PolarHBondContact O-SG 2.76Å; L1019-C1090 HydrophobicContact CD1-CB 4.27Å; L1049-C1090 CarbonylContact O-C 3.33Å; L1049-C1090 VanDerWaalsContact O-CA 3.23Å; L1049-C1090 WeakPolarHBondContact O-CA 3.4Å
1091	L	93.4	Very high	76.8	Confident	3 Å²	3	48 Å²	48	2%	0.016	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	103	169.1	-69	170.4	0	0	0	109.1	I604 I619 N620 L979 C1014 V1016 M1048 L1049 F1051	I604-L1091 HydrophobicContact CG2-CD1 4.05Å; I619-L1091 HydrophobicContact CG2-CD1 3.68Å; I619-L1091 HydrophobicContact CG2-CD2 4.26Å; N620-L1091 HydrophobicContact CB-CB 4.11Å; N620-L1091 HydrophobicContact CB-CD1 3.87Å; N620-L1091 PolarHBondContact ND2-O 3.31Å; N620-L1091 VanDerWaalsContact ND2-O 3.13Å; L979-L1091 HydrophobicContact CD1-CD2 4.19Å; C1014-L1091 HydrophobicContact CB-CB 4.2Å; C1014-L1091 HydrophobicContact CB-CD2 4.39Å; V1016-L1091 HydrophobicContact CG2-CD2 3.9Å; M1048-L1091 WeakPolarHBondContact CA-O 3.44Å; L1049-L1091 HydrophobicContact CB-CB 4.35Å; L1049-L1091 HydrophobicContact CD2-CD1 4.21Å; L1049-L1091 PolarHBondContact N-O 3.02Å; L1049-L1091 PolarHBondContact O-N 3.42Å; F1051-L1091 HydrophobicContact CD1-CG 4.17Å; F1051-L1091 HydrophobicContact CE1-CD2 4.27Å; F1051-L1091 HydrophobicContact CE1-CG 3.82Å
1092	M	90.3	Very high	73.9	Confident	47 Å²	47	52.1 Å²	52.1	23%	0.232	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	139.9	175.4	-57.5	-174.5	82.7	0	0	111	C1014 R1015 A1017 M1048	C1014-M1092 CarbonylContact C-O 3.54Å; C1014-M1092 WeakPolarHBondContact CA-O 3.44Å; R1015-M1092 HydrophobicContact CG-CB 4.03Å; R1015-M1092 PolarHBondContact N-O 3.21Å; R1015-M1092 PolarHBondContact O-N 3.22Å; A1017-M1092 HydrophobicContact CB-CG 3.91Å; A1017-M1092 HydrophobicContact CB-SD 3.57Å; A1017-M1092 VanDerWaalsContact CB-SD 3.57Å; M1048-M1092 HydrophobicContact CG-CG 4.47Å; M1048-M1092 HydrophobicContact SD-CE 3.76Å; M1048-M1092 HydrophobicContact SD-CG 3.91Å
1093	Q	87.9	Confident	70.8	Confident	48 Å²	48	58.2 Å²	58.2	22%	0.224	32%	0.316	C	S	.	.	P	Polyproline II helix	trans	-68	159.5	167.6	-59.8	-63.8	-28.5	0	0	111.3	N620 C1014 N1047	N620-Q1093 PolarHBondContact ND2-NE2 3.29Å; N620-Q1093 PolarHBondContact O-NE2 3Å; C1014-Q1093 PolarHBondContact SG-NE2 2.7Å; N1047-Q1093 HydrophobicContact CB-CG 3.84Å; N1047-Q1093 PolarHBondContact O-NE2 3.3Å
1094	F	84.3	Confident	67.8	Low	19 Å²	19	60.6 Å²	60.6	8%	0.083	33%	0.334	C	S	.	.	P	Polyproline II helix	trans	-79.5	126.5	166.6	-176.7	-103.6	0	0	0	110.3	N784 H786 R1011 H1096	N784-F1094 WeakPolarHBondContact O-CD2 3.29Å; H786-F1094 AromaticContact CE1-CE2 3.33Å; H786-F1094 WeakPolarHBondContact CE1-CE2 3.25Å; H786-F1094 AromaticContact CE1-CZ 3.54Å; H786-F1094 AromaticContact ND1-CE2 3.81Å; H786-F1094 AromaticContact NE2-CE2 3.68Å; H786-F1094 AromaticContact NE2-CZ 3.42Å; H786-F1094 WeakPolarHBondContact NE2-CZ 3.46Å; R1011-F1094 VanDerWaalsContact NH2-CE2 3.34Å; F1094-H1096 AromaticContact CD1-CE1 3.94Å; F1094-H1096 AromaticContact CE1-CE1 3.82Å; F1094-H1096 AromaticContact CE1-ND1 3.68Å
1095	D	75.1	Confident	64.9	Low	75 Å²	75	65.6 Å²	65.6	40%	0.401	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-100.1	126.4	173	172.9	40.4	0	0	0	111.3	H786 N1097 A1098	H786-D1095 PolarHBondContact CE1-O 2.74Å; H786-D1095 VanDerWaalsContact CE1-O 3.3Å; H786-D1095 PolarHBondContact NE2-O 3.06Å; D1095-N1097 VanDerWaalsContact CG-N 3.34Å; D1095-N1097 WeakPolarHBondContact OD1-CB 3.1Å; D1095-N1097 PolarHBondContact OD1-N 2.99Å; D1095-N1097 PolarHBondContact OD1-ND2 2.76Å; D1095-N1097 VanDerWaalsContact OD1-ND2 3.09Å; D1095-N1097 PolarHBondContact OD2-N 3.32Å; D1095-A1098 PolarHBondContact OD2-N 3.34Å
1096	H	62.8	Low	61.9	Low	101 Å²	101	67.3 Å²	67.3	47%	0.468	37%	0.372	S	S	.	.	S	Bend	trans	-75.8	-22.4	176.1	-69.4	-78.2	0	0	0	113.5	D1012 F1094	D1012-H1096 IonicContact OD1-CE1 3.75Å; D1012-H1096 PolarHBondContact OD1-CE1 3.13Å; D1012-H1096 IonicContact OD1-NE2 3.18Å; D1012-H1096 PolarHBondContact OD1-NE2 3.08Å; D1012-H1096 IonicContact OD2-CD2 2.71Å; D1012-H1096 IonicContact OD2-CE1 3.22Å; D1012-H1096 IonicContact OD2-NE2 2.89Å; D1012-H1096 PolarHBondContact OD2-NE2 3.31Å; F1094-H1096 AromaticContact CD1-CE1 3.94Å; F1094-H1096 AromaticContact CE1-CE1 3.82Å; F1094-H1096 AromaticContact CE1-ND1 3.68Å
1097	N	47.5	Very low	58.8	Low	110 Å²	110	76 Å²	76	59%	0.588	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-84.1	-27.5	-171.9	-60.1	-65.1	0	0	0	113.7	D1095 G1099 Q1100	D1095-N1097 VanDerWaalsContact CG-N 3.34Å; D1095-N1097 WeakPolarHBondContact OD1-CB 3.1Å; D1095-N1097 PolarHBondContact OD1-N 2.99Å; D1095-N1097 PolarHBondContact OD1-ND2 2.76Å; D1095-N1097 VanDerWaalsContact OD1-ND2 3.09Å; D1095-N1097 PolarHBondContact OD2-N 3.32Å; N1097-G1099 PolarHBondContact O-N 2.86Å; N1097-Q1100 PolarHBondContact O-N 2.61Å
1098	A	48.2	Very low	55.6	Low	37 Å²	37	80.6 Å²	80.6	31%	0.306	45%	0.447	S	S	.	.	G	3₁₀ helix	trans	-52.4	-24.7	176	0	0	0	0	0	114.2	D1095	D1095-A1098 PolarHBondContact OD2-N 3.34Å
1099	G	34.9	Very low	52.2	Low	49 Å²	49	85.2 Å²	85.2	51%	0.505	48%	0.479	S	S	.	.	G	3₁₀ helix	trans	-74.3	-21.7	175.3	0	0	0	0	0	115.7	N1097	N1097-G1099 PolarHBondContact O-N 2.86Å
1100	Q	32.5	Very low	49.1	Very low	143 Å²	143	93.8 Å²	93.8	67%	0.668	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.7	-19.1	-173.6	-63	-171.6	4.3	0	0	113.9	N1097 R1102 T1103	N1097-Q1100 PolarHBondContact O-N 2.61Å; Q1100-R1102 PolarHBondContact O-N 3.27Å; Q1100-R1102 VanDerWaalsContact O-N 3.15Å; Q1100-T1103 PolarHBondContact O-OG1 2.91Å
1101	S	27.7	Very low	45.9	Very low	66 Å²	66	99.1 Å²	99.1	46%	0.462	56%	0.556	S	S	.	*	T	Hydrogen-bonded Turn	trans	-75	-0.7	-169.6	59	0	0	0	0	115.9
1102	R	31.3	Very low	42.8	Very low	218 Å²	218	104.4 Å²	104.4	82%	0.823	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	-4.7	-179	-84.3	-174.1	166.8	-179.6	-3	116.1	Q1100	Q1100-R1102 PolarHBondContact O-N 3.27Å; Q1100-R1102 VanDerWaalsContact O-N 3.15Å
1103	T	27.7	Very low	39.9	Very low	131 Å²	131	111.4 Å²	111.4	80%	0.804	63%	0.625	S	S	*	*	S	Bend	trans	-92.5	-5.5	174.1	43.4	0	0	0	0	113.9	Q1100	Q1100-T1103 PolarHBondContact O-OG1 2.91Å
1104	S	28	Very low	36.9	Very low	89 Å²	89	114 Å²	114	62%	0.622	65%	0.649	S	S	*	*	S	Bend	trans	-120.4	13.9	-175.5	54	0	0	0	0	114.7
1105	L	27.9	Very low	34.1	Very low	153 Å²	153	118 Å²	118	80%	0.801	68%	0.679	S	S	*	*			trans	-108.9	58.4	178	-83.1	171	0	0	0	113
1106	S	25.8	Very low	31.9	Very low	91 Å²	91	119.1 Å²	119.1	64%	0.636	69%	0.693	S	S	*	*	S	Bend	trans	-125	132.4	153.1	60.4	0	0	0	0	109.2
1107	H	29.7	Very low	30.2	Very low	184 Å²	184	123.3 Å²	123.3	85%	0.852	71%	0.71	S	S	*	*	S	Bend	trans	60.6	83	-179.9	-53.6	-75.3	0	0	0	117.8
1108	S	25.6	Very low	29.2	Very low	126 Å²	126	127.2 Å²	127.2	88%	0.881	72%	0.721	S	S	*	*				-162.1	122.3	124.1	34.3	0	0	0	0	112
1109	S	25.8	Very low	28.2	Very low	99 Å²	99	130.3 Å²	130.3	69%	0.692	74%	0.741	S	S	*	*			trans	-128.2	146	165.6	53.7	0	0	0	0	108.5
1110	H	30.6	Very low	27.8	Very low	181 Å²	181	132.7 Å²	132.7	84%	0.838	75%	0.749	S	S	*	*			trans	67.4	142.4	-168.7	-45.5	-79.1	0	0	0	113.6
1111	S	27.6	Very low	27.6	Very low	112 Å²	112	131 Å²	131	78%	0.783	75%	0.753	S	S	*	*			cis	-148.2	154.9	4.2	50.1	0	0	0	0	111.7
1112	S	27.8	Very low	27.6	Very low	113 Å²	113	134.1 Å²	134.1	79%	0.79	77%	0.769	S	S	*	*			trans	-96.8	103.2	171.2	40.1	0	0	0	0	110.8
1113	H	28.1	Very low	27.4	Very low	194 Å²	194	131.9 Å²	131.9	90%	0.898	77%	0.768	S	S	*	*			trans	-148.8	145.9	161	-108.3	-75.5	0	0	0	111.2
1114	S	25.6	Very low	27.3	Very low	103 Å²	103	131.3 Å²	131.3	72%	0.72	77%	0.769	S	S	*	*			trans	-103.3	161.7	-169.8	56.1	0	0	0	0	113.9
1115	S	26.3	Very low	27.2	Very low	103 Å²	103	133.2 Å²	133.2	72%	0.72	78%	0.777	S	S	*	*			trans	86.6	92.5	157.8	76.4	0	0	0	0	121.4
1116	S	28.1	Very low	27.9	Very low	99 Å²	99	131.2 Å²	131.2	69%	0.692	77%	0.773	S	S	*	*				90.5	145.1	121.1	86.4	0	0	0	0	122.4
1117	K	28	Very low	28.1	Very low	188 Å²	188	132.9 Å²	132.9	82%	0.817	78%	0.782	S	S	*	*			trans	77.6	110.6	154.5	-65.3	168.4	-174.7	168.8	0	121.1
1118	K	27	Very low	27.9	Very low	193 Å²	193	128.8 Å²	128.8	84%	0.839	77%	0.774	S	S	*	*				63.8	106.7	128	-71.4	-167.3	173.2	-171.5	0	121.9
1119	S	26.1	Very low	28	Very low	101 Å²	101	128.8 Å²	128.8	71%	0.706	76%	0.764	S	S	*	*				69.3	132.9	123.3	65.7	0	0	0	0	124
1120	S	27.3	Very low	28.1	Very low	99 Å²	99	133.2 Å²	133.2	69%	0.692	77%	0.765	S	S	*	*			trans	80.8	102.9	134.3	63.7	0	0	0	0	123.1
1121	S	27.9	Very low	27.9	Very low	107 Å²	107	131.5 Å²	131.5	75%	0.748	76%	0.758	S	S	*	*				92.8	156	111.2	73.2	0	0	0	0	123.2
1122	V	26.6	Very low	28	Very low	132 Å²	132	131.5 Å²	131.5	80%	0.8	75%	0.749	S	S	*	*			trans	103.1	134.1	158.8	-173.7	0	0	0	0	119.5
1123	H	27.2	Very low	28.2	Very low	171 Å²	171	136.9 Å²	136.9	79%	0.792	75%	0.752	S	S	*	*			trans	-56.5	162.2	-174.7	-51.9	-83.4	0	0	0	119.5
1124	S	25.9	Very low	28.1	Very low	119 Å²	119	132.7 Å²	132.7	83%	0.832	75%	0.745	S	S	*	*				-161.7	168	113.1	35.4	0	0	0	0	111.9
1125	V	26.1	Very low	28.1	Very low	130 Å²	130	132.3 Å²	132.3	79%	0.788	74%	0.742	S	S	*	*			trans	-138.2	-171.6	-170.5	-141.4	0	0	0	0	110.9
1126	P	43.3	Very low	28.2	Very low	111 Å²	111	136.9 Å²	136.9	72%	0.721	75%	0.749	S	S	*	*				-98.7	-170.4	-128.7	43.4	-28.5	0	0	0	114.8
1127	P	30.1	Very low	28.1	Very low	125 Å²	125	137 Å²	137	81%	0.812	75%	0.75	S	S	*	*				-142	175.3	119.4	37.9	-24.5	0	0	0	116.5
1128	S	25.7	Very low	28.2	Very low	99 Å²	99	138.1 Å²	138.1	69%	0.692	75%	0.749	S	S	*	*			trans	-80.6	178.2	175.8	59.1	0	0	0	0	112.4
1129	N	26.3	Very low	28.1	Very low	125 Å²	125	136.4 Å²	136.4	67%	0.668	74%	0.744	S	S	*	*			cis	-178.2	148.4	45.9	-142.6	-11.1	0	0	0	114.8
1130	R	28.3	Very low	28.2	Very low	192 Å²	192	135.7 Å²	135.7	73%	0.725	74%	0.744	S	S	*	*			trans	56.6	127.8	144.5	-83.7	171.4	-176.7	-166.5	1.2	125.9
1131	Q	27.3	Very low	28.2	Very low	146 Å²	146	141.4 Å²	141.4	68%	0.682	75%	0.751	S	S	*	*				80.8	151.4	128.3	-74.7	172.4	-21.9	0	0	120.2
1132	N	29.1	Very low	28.2	Very low	111 Å²	111	141.9 Å²	141.9	59%	0.594	74%	0.741	S	S	*	*			cis	-158.6	141.4	7.8	-133.5	-14.7	0	0	0	115.3
1133	R	31.2	Very low	28.2	Very low	226 Å²	226	143.3 Å²	143.3	85%	0.853	74%	0.736	S	S	*	*			trans	59.6	155.6	149.7	-75.3	171.6	178.1	-174.4	-1.8	119.6
1134	S	25.9	Very low	28.2	Very low	106 Å²	106	142.8 Å²	142.8	74%	0.741	73%	0.734	S	S	*	*			cis	-162.1	168.3	8.7	8	0	0	0	0	110.6
1135	S	27.1	Very low	28.1	Very low	96 Å²	96	143.5 Å²	143.5	67%	0.671	73%	0.729	S	S	*	*			cis	175.9	154.8	-28.6	59.8	0	0	0	0	111.5
1136	K	27.7	Very low	28.1	Very low	198 Å²	198	141.8 Å²	141.8	86%	0.861	73%	0.729	S	S	*	*			trans	77.5	143.9	163.6	-68	-179.5	178.6	-179.1	0	118
1137	S	26.1	Very low	27.4	Very low	101 Å²	101	143.7 Å²	143.7	71%	0.706	74%	0.738	S	S	*	*			cis	-166.9	141.3	-5.5	43.3	0	0	0	0	115.6
1138	R	29.4	Very low	27.1	Very low	212 Å²	212	148.2 Å²	148.2	80%	0.8	74%	0.739	S	S	*	*			trans	49.2	131.9	139.7	-69.3	-157.9	138.1	151.6	-2.1	121.6
1139	E	26.5	Very low	27.2	Very low	157 Å²	157	150.3 Å²	150.3	73%	0.734	74%	0.74	S	S	*	*				66.2	142.8	59.4	-63.1	-179.3	136	0	0	114.9
1140	A	27.4	Very low	27.2	Very low	87 Å²	87	150.3 Å²	150.3	72%	0.719	74%	0.74	S	S	*	*			cis	-173.4	162.2	-20.8	0	0	0	0	0	111.2
1141	R	28.1	Very low	27.2	Very low	219 Å²	219	151 Å²	151	83%	0.826	74%	0.742	S	S	*	*			trans	68.5	136.5	152.5	-87.2	-173.8	172.6	-168.8	6.8	124.3
1142	E	27.3	Very low	27.2	Very low	117 Å²	117	151.8 Å²	151.8	55%	0.547	75%	0.748	S	S	.	*			trans	78.2	123.1	136.2	-74.2	-175.3	-125.9	0	0	125.1
1143	K	26.8	Very low	27.1	Very low	161 Å²	161	149.3 Å²	149.3	70%	0.7	75%	0.749	S	S	*	*			trans	78.6	119.7	133.4	-74.9	175	-179.6	148.5	0	123.7
1144	Q	26	Very low	27	Very low	160 Å²	160	146.9 Å²	146.9	75%	0.748	75%	0.747	S	S	*	*				87.3	136.5	128.6	-83.4	-175.5	-31.1	0	0	123.3
1145	N	24.6	Very low	27	Very low	134 Å²	134	149.1 Å²	149.1	72%	0.717	75%	0.746	S	S	*	*			trans	73	98.5	145.8	-61.4	-4.9	0	0	0	121.3
1146	A	25.3	Very low	27	Very low	95 Å²	95	153 Å²	153	79%	0.785	75%	0.75	S	S	*	*				48.2	131	123.7	0	0	0	0	0	122
1147	T	28.5	Very low	27	Very low	151 Å²	151	151.2 Å²	151.2	93%	0.926	74%	0.743	S	S	*	*				-153.8	169	129.5	-76.1	0	0	0	0	109.2
1148	R	25.7	Very low	27	Very low	219 Å²	219	157 Å²	157	83%	0.826	75%	0.749	S	S	*	*			trans	-131	141.8	-154.6	169.6	-152.2	-173.9	-177.6	4.1	110.6
1149	M	26.1	Very low	26.8	Very low	144 Å²	144	153.3 Å²	153.3	71%	0.709	74%	0.739	S	S	*	*				159.8	133.2	129	-88.9	175.8	69.6	0	0	114.8
1150	N	27.1	Very low	26.9	Very low	124 Å²	124	151.5 Å²	151.5	66%	0.663	74%	0.739	S	S	*	*			trans	58.3	141.8	143.9	-63	1.1	0	0	0	119.1
1151	R	29.2	Very low	26.8	Very low	207 Å²	207	153.5 Å²	153.5	78%	0.781	74%	0.738	S	S	*	*			cis	-159.5	171.5	6.3	-109.2	166.8	173.8	-170.5	-0.3	105.3
1152	M	27.1	Very low	26.9	Very low	163 Å²	163	151.8 Å²	151.8	80%	0.803	74%	0.739	S	S	*	*			cis	-160	170.5	1.8	-130.6	146	158.7	0	0	105.9
1153	G	27	Very low	27.3	Very low	59 Å²	59	151.3 Å²	151.3	61%	0.608	75%	0.746	S	S	*	*			cis	175.4	161.1	-5.8	0	0	0	0	0	111
1154	Q	27.5	Very low	27.4	Very low	174 Å²	174	151.5 Å²	151.5	81%	0.813	75%	0.75	S	S	*	*			trans	66	111.7	170.7	-58.9	-160.8	-92.2	0	0	117
1155	E	27.5	Very low	27.4	Very low	154 Å²	154	151.7 Å²	151.7	72%	0.72	76%	0.756	S	S	*	*				83	134.4	70.4	-77.3	178.2	143.1	0	0	112.5
1156	K	27.3	Very low	27.5	Very low	176 Å²	176	148.8 Å²	148.8	77%	0.765	75%	0.751	S	S	*	*			cis	-138.5	156.2	16.3	-50.4	164.8	-174.9	169.5	0	107.6
1157	K	26.2	Very low	27.7	Very low	161 Å²	161	154.9 Å²	154.9	70%	0.7	76%	0.755	S	S	*	*			cis	54.2	141.9	49.1	-70.3	-157.9	172.5	-163.8	0	113.5	F1159	K1157-F1159 HydrophobicContact CD-CD2 4.23Å; K1157-F1159 HydrophobicContact CD-CE2 4.38Å
1158	W	25.9	Very low	28.2	Very low	223 Å²	223	153.2 Å²	153.2	85%	0.845	75%	0.747	S	S	*	*			cis	-120.7	157.5	38.6	-64.3	67.1	0	0	0	111.7
1159	F	26	Very low	28.3	Very low	135 Å²	135	153.6 Å²	153.6	59%	0.592	75%	0.748	S	S	*	*				56.8	132.5	61.6	-89.7	-53.3	0	0	0	112.2	K1157 D1161	K1157-F1159 HydrophobicContact CD-CD2 4.23Å; K1157-F1159 HydrophobicContact CD-CE2 4.38Å; F1159-D1161 WeakPolarHBondContact CD1-OD1 3.38Å
1160	T	27.8	Very low	28.5	Very low	119 Å²	119	154.5 Å²	154.5	73%	0.73	76%	0.756	S	S	*	*			cis	-144.3	176.2	16.4	52.8	0	0	0	0	110.9
1161	D	26.5	Very low	28.7	Very low	128 Å²	128	155.2 Å²	155.2	68%	0.684	76%	0.758	S	S	*	*			cis	-166.2	-174.1	-32.3	-83.8	-22.9	0	0	0	108.7	F1159	F1159-D1161 WeakPolarHBondContact CD1-OD1 3.38Å
1162	E	29.4	Very low	28.5	Very low	183 Å²	183	153.5 Å²	153.5	86%	0.855	76%	0.759	S	S	*	*			trans	-82.1	174.6	179.7	-106.3	-177.3	-152.4	0	0	114.1
1163	P	36.9	Very low	28.7	Very low	107 Å²	107	153.8 Å²	153.8	70%	0.695	76%	0.762	S	S	*	*			cis	-146.2	-173.9	31.3	44.8	-23.7	0	0	0	118.9
1164	E	28.8	Very low	28.6	Very low	166 Å²	166	160.1 Å²	160.1	78%	0.776	77%	0.773	S	S	*	*			trans	5.2	128.8	156.4	-59.2	-177.8	152.6	0	0	121.2
1165	N	26.3	Very low	28.9	Very low	163 Å²	163	157.7 Å²	157.7	87%	0.872	77%	0.772	S	S	*	*				-169.2	168.8	110.3	-111.7	-82.6	0	0	0	114.1
1166	A	26.7	Very low	28.8	Very low	74 Å²	74	159.6 Å²	159.6	61%	0.612	78%	0.783	S	S	*	*			trans	-104.9	-175.4	-172.9	0	0	0	0	0	114.6
1167	Y	28	Very low	28.8	Very low	223 Å²	223	156.3 Å²	156.3	88%	0.875	78%	0.782	S	S	*	*			trans	89.5	147.4	173	-65.6	-79.6	0	0	0	118.1
1168	P	39.3	Very low	29.1	Very low	116 Å²	116	154.4 Å²	154.4	75%	0.753	78%	0.784	S	S	*	*			trans	-96.1	170.3	-151.3	38.2	-38.3	0	0	0	114.5
1169	R	27.9	Very low	29.2	Very low	227 Å²	227	152.3 Å²	152.3	86%	0.857	78%	0.784	S	S	*	*			trans	-126.8	108.5	168.6	-72.6	-171.5	175.8	-178.8	0.1	112.7
1170	N	31.1	Very low	29.1	Very low	163 Å²	163	155.3 Å²	155.3	87%	0.872	80%	0.802	S	S	*	*			trans	-63.2	131.5	148.6	-82.7	-29.6	0	0	0	109
1171	I	29.8	Very low	29.2	Very low	138 Å²	138	153.8 Å²	153.8	71%	0.708	80%	0.801	S	S	*	*			trans	-131.6	88.4	160.2	-58.9	-179	0	0	0	105.1
1172	Q	25.9	Very low	29.4	Very low	171 Å²	171	155 Å²	155	80%	0.799	81%	0.808	S	S	*	*				50.5	90.7	95.8	-75.7	-162.8	-24.6	0	0	113.6	K1174	Q1172-K1174 PolarHBondContact O-N 2.61Å
1173	I	31.4	Very low	29.3	Very low	169 Å²	169	155.9 Å²	155.9	87%	0.867	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-54.1	125.4	155.3	-61.2	165.7	0	0	0	108
1174	K	24.7	Very low	28.9	Very low	193 Å²	193	156.7 Å²	156.7	84%	0.839	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-88	127.7	164.3	-91.3	-174.7	173.4	-179.9	0	109.1	Q1172	Q1172-K1174 PolarHBondContact O-N 2.61Å
1175	P	34.4	Very low	28.9	Very low	123 Å²	123	155.7 Å²	155.7	80%	0.799	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-71.9	141.8	164.8	31.7	-32.9	0	0	0	109.3
1176	M	24.8	Very low	28.9	Very low	194 Å²	194	156.5 Å²	156.5	96%	0.956	81%	0.813	S	S	*	*			trans	-111.8	121.8	165.9	-168.9	159.7	176.9	0	0	108.5
1177	S	28.1	Very low	28.9	Very low	106 Å²	106	164.5 Å²	164.5	74%	0.741	83%	0.829	S	S	*	*			trans	-82.4	146	-167.6	50.8	0	0	0	0	113.2	H1179	S1177-H1179 PolarHBondContact O-N 3.32Å
1178	T	30.7	Very low	28.8	Very low	121 Å²	121	163.1 Å²	163.1	74%	0.742	83%	0.828	S	S	*	*			trans	-50.7	127.9	161.9	47.8	0	0	0	0	112
1179	H	28.4	Very low	28.3	Very low	180 Å²	180	163.3 Å²	163.3	83%	0.833	83%	0.832	S	S	*	*				174	108.2	129.5	-94.5	-63.6	0	0	0	111.2	S1177	S1177-H1179 PolarHBondContact O-N 3.32Å
1180	M	25.1	Very low	28.3	Very low	198 Å²	198	159.2 Å²	159.2	98%	0.975	83%	0.832	S	S	*	*				-168.9	146.3	129.4	-107	179.1	-175.7	0	0	109.9
1181	A	29.8	Very low	28.3	Very low	87 Å²	87	156.8 Å²	156.8	72%	0.719	83%	0.828	S	S	*	*			trans	-132.9	167.9	174.1	0	0	0	0	0	108.8
1182	N	29.6	Very low	28.2	Very low	154 Å²	154	155.9 Å²	155.9	82%	0.824	83%	0.834	S	S	*	*			trans	68.1	95.2	176.7	-55.7	-16.1	0	0	0	116.4
1183	Q	26.7	Very low	28.4	Very low	200 Å²	200	155.1 Å²	155.1	94%	0.935	83%	0.834	S	S	*	*				-143.4	140.7	126.2	-111.2	174.4	22.6	0	0	109.8
1184	V	29.9	Very low	28.2	Very low	124 Å²	124	154.8 Å²	154.8	75%	0.752	83%	0.833	S	S	*	*			trans	-138.9	151.4	-176.1	173.5	0	0	0	0	107.6
1185	N	28.1	Very low	28.7	Very low	145 Å²	145	150.4 Å²	150.4	78%	0.775	82%	0.824	S	S	*	*			trans	67.6	104.6	-178.4	-59.9	-34.1	0	0	0	115.9
1186	Q	26.8	Very low	28.6	Very low	180 Å²	180	150.8 Å²	150.8	84%	0.841	83%	0.827	S	S	*	*				-176.4	121.4	101.3	-97.2	176.4	43.6	0	0	111.1
1187	Y	26.4	Very low	28.8	Very low	242 Å²	242	148.9 Å²	148.9	95%	0.949	82%	0.819	S	S	*	*				-155.2	137.1	125.8	-105.5	-72.1	0	0	0	108.3
1188	K	26.6	Very low	28.9	Very low	194 Å²	194	155.1 Å²	155.1	84%	0.843	83%	0.826	S	S	*	*			trans	-93.5	143	-178.3	-73.1	-177.9	176	-179.5	0	110.6
1189	S	27.4	Very low	28.7	Very low	120 Å²	120	157.8 Å²	157.8	84%	0.839	83%	0.83	S	S	*	*			trans	-63.6	137.9	158.6	50.5	0	0	0	0	111.1
1190	T	29.5	Very low	28.7	Very low	142 Å²	142	154.6 Å²	154.6	87%	0.871	82%	0.823	S	S	*	*			trans	-105.4	132.9	159.7	45.5	0	0	0	0	109.3
1191	S	29.8	Very low	29	Very low	111 Å²	111	154.4 Å²	154.4	78%	0.776	82%	0.819	S	S	*	*			trans	-94.1	146.9	-173	52.3	0	0	0	0	113.2
1192	S	27.3	Very low	29.1	Very low	119 Å²	119	157.3 Å²	157.3	83%	0.832	82%	0.823	S	S	*	*			trans	-129.6	135.7	153.6	45.7	0	0	0	0	108.9
1193	L	29.8	Very low	29.2	Very low	155 Å²	155	158.7 Å²	158.7	81%	0.812	83%	0.825	S	S	*	*			trans	-88	146.5	-178.4	-72.1	72.1	0	0	0	110.4
1194	I	29.1	Very low	29.5	Very low	163 Å²	163	159.2 Å²	159.2	84%	0.836	85%	0.848	S	S	*	*			trans	-160.6	138.2	138.8	-97.8	143.8	0	0	0	106.9
1195	P	34.2	Very low	29.5	Very low	101 Å²	101	161 Å²	161	66%	0.656	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-82.7	155.5	-175.1	33.4	-36	0	0	0	113
1196	P	31.7	Very low	29.5	Very low	131 Å²	131	161.8 Å²	161.8	85%	0.851	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-71.4	138.3	168.8	30.9	-33.8	0	0	0	111
1197	I	29.1	Very low	29.7	Very low	154 Å²	154	160.8 Å²	160.8	79%	0.79	86%	0.858	S	S	*	*	P	Polyproline II helix	trans	-88.9	142.8	175	-68.5	172.7	0	0	0	109.4
1198	R	30	Very low	29.9	Very low	236 Å²	236	156.1 Å²	156.1	89%	0.891	85%	0.853	S	S	*	*	P	Polyproline II helix	trans	-88.1	127.8	165.2	-90.8	177.3	157.8	-178.3	-7.3	109.1
1199	E	27.3	Very low	30.1	Very low	178 Å²	178	153.7 Å²	153.7	83%	0.832	85%	0.853	S	S	*	*			trans	178.6	145.4	154.7	-101.9	151.4	-145.1	0	0	107.3
1200	V	29.3	Very low	30.3	Very low	113 Å²	113	155.9 Å²	155.9	69%	0.685	85%	0.854	S	S	*	*			cis	-154.9	154.6	-26.8	109.6	0	0	0	0	106.6	D1202	V1200-D1202 HydrophobicContact CG1-CB 4.44Å
1201	E	30.2	Very low	30.3	Very low	193 Å²	193	156.9 Å²	156.9	90%	0.902	85%	0.853	S	S	*	*			trans	-86	128	169.2	-65.7	171.7	127.5	0	0	108.9
1202	D	31.7	Very low	30.4	Very low	149 Å²	149	160.5 Å²	160.5	80%	0.797	86%	0.859	S	S	*	*			trans	-149.2	159.1	171.4	-105.2	-39.2	0	0	0	111.1	V1200	V1200-D1202 HydrophobicContact CG1-CB 4.44Å
1203	E	32.2	Very low	30.6	Very low	183 Å²	183	163.9 Å²	163.9	86%	0.855	86%	0.861	S	S	*	*			trans	-89.2	138.4	-155.5	-52.2	174.5	128.1	0	0	115.7
1204	C	33.1	Very low	30.7	Very low	211 Å²	211	164.7 Å²	164.7	100%	1.426	87%	0.865	S	S	*	*			trans	-174.7	0	135.1	-94.4	0	0	0	0	111.4

Retrieved 1,204 of 1,204 residues in 496.1 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).